#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tjp n GLU 2 N 0.00 1.39 -0.28 0.03 -0.00 -1.26 -4.98 120.64 115.55 1tjp n GLU 2 Ca 0.00 -3.39 -0.06 0.00 -0.00 0.00 0.00 57.16 53.71 1tjp n GLU 2 Cb 0.00 -1.35 0.06 0.00 -0.00 0.00 0.00 31.44 30.14 1tjp n GLU 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1tjp h ARG 3 N 2.95 1.17 -0.59 3.44 3.08 -1.97 -0.83 114.38 121.61 1tjp h ARG 3 Ca -0.06 -0.23 -0.09 0.00 0.07 0.00 0.00 59.98 59.68 1tjp h ARG 3 Cb 1.16 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 31.00 1tjp h ARG 3 CO 0.53 0.96 0.03 1.88 -1.07 0.00 0.00 179.97 182.31 1tjp h TYR 4 N 1.13 1.11 -0.63 3.04 0.05 -1.91 -1.27 116.97 118.48 1tjp h TYR 4 Ca 0.25 -0.18 -0.06 0.00 0.05 0.00 0.00 58.73 58.80 1tjp h TYR 4 Cb 0.25 -0.29 -0.03 0.00 1.01 0.00 0.00 36.73 37.67 1tjp h TYR 4 CO 0.02 0.98 0.18 1.49 -1.05 0.00 0.00 178.16 179.78 1tjp h GLU 5 N 0.92 1.00 -0.42 4.88 4.81 -1.79 -0.87 114.58 123.12 1tjp h GLU 5 Ca 0.17 -0.23 -0.06 0.00 -0.13 0.00 0.00 59.36 59.11 1tjp h GLU 5 Cb 0.51 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.74 1tjp h GLU 5 CO 0.02 0.89 0.02 -0.91 -0.73 0.00 0.00 179.01 178.31 1tjp h ASN 6 N 0.92 0.71 0.17 1.04 2.35 -1.02 -1.65 115.58 118.11 1tjp h ASN 6 Ca 0.20 -0.30 -0.01 0.00 -0.55 0.00 0.00 56.30 55.65 1tjp h ASN 6 Cb 0.33 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.50 1tjp h ASN 6 CO -0.00 0.83 -0.10 0.25 -1.65 0.00 0.00 177.43 176.76 1tjp h LEU 7 N 0.57 -0.25 -1.47 1.61 5.85 -0.92 -1.44 115.31 119.26 1tjp h LEU 7 Ca 0.12 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.83 1tjp h LEU 7 Cb 0.46 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 1tjp h LEU 7 CO 0.02 -0.17 0.05 -0.26 -0.34 0.00 0.00 178.44 177.74 1tjp h PHE 8 N -0.26 0.40 -0.38 1.25 0.04 -1.13 0.20 116.94 117.06 1tjp h PHE 8 Ca -0.02 -0.02 -0.10 0.00 2.80 0.00 0.00 57.97 60.63 1tjp h PHE 8 Cb 0.22 -0.12 -0.01 0.00 2.20 0.00 0.00 35.95 38.23 1tjp h PHE 8 CO -0.08 0.37 -0.17 0.00 -0.60 0.00 0.00 178.31 177.83 1tjp h ALA 9 N 1.67 0.53 -0.36 2.45 0.00 -1.12 -0.37 119.26 122.06 1tjp h ALA 9 Ca 0.09 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.59 1tjp h ALA 9 Cb 0.18 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1tjp h ALA 9 CO -0.00 0.46 -0.01 1.96 0.00 0.00 0.00 179.25 181.66 1tjp h GLN 10 N 0.58 0.65 -0.69 0.00 4.20 -0.71 -2.21 115.11 116.93 1tjp h GLN 10 Ca 0.09 -0.21 -0.03 0.00 0.06 0.00 0.00 58.65 58.56 1tjp h GLN 10 Cb 0.71 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.40 1tjp h GLN 10 CO 0.05 0.76 0.33 -0.07 -0.67 0.00 0.00 178.83 179.23 1tjp h LEU 11 N 0.46 0.90 -1.23 1.46 3.38 -0.52 -2.34 115.31 117.42 1tjp h LEU 11 Ca 0.10 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 1tjp h LEU 11 Cb 0.47 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1tjp h LEU 11 CO 0.02 0.78 0.10 -1.13 0.09 0.00 0.00 178.44 178.30 1tjp h ASN 12 N 0.96 0.58 0.40 -0.43 -1.24 -0.96 -0.12 115.58 114.77 1tjp h ASN 12 Ca 0.24 -0.09 -0.02 0.00 0.71 0.00 0.00 56.30 57.14 1tjp h ASN 12 Cb 0.12 -0.15 -0.00 0.00 0.73 0.00 0.00 38.32 39.02 1tjp h ASN 12 CO -0.03 0.59 -0.10 0.44 -1.29 0.00 0.00 177.43 177.04 1tjp h ASP 13 N 0.62 0.00 -0.60 1.15 3.32 -0.86 -0.93 116.42 119.12 1tjp h ASP 13 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1tjp h ASP 13 Cb 0.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.79 1tjp h ASP 13 CO -0.00 0.10 0.00 0.54 -1.72 0.00 0.00 179.24 178.16 1tjp n ARG 14 N -3.55 2.92 -3.83 3.56 1.74 -0.39 -4.96 116.66 112.14 1tjp n ARG 14 Ca -0.02 -2.53 -0.25 0.00 -0.77 0.00 0.00 57.85 54.28 1tjp n ARG 14 Cb 0.23 -1.54 0.01 0.00 -1.02 0.00 0.00 32.46 30.14 1tjp n ARG 14 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 1tjp n ARG 15 N 1.19 -3.33 -4.25 5.56 -4.01 -0.35 -4.97 116.66 106.49 1tjp n ARG 15 Ca 0.21 0.47 -0.21 0.00 -1.04 0.00 0.00 57.85 57.28 1tjp n ARG 15 Cb 0.61 -4.63 -0.12 0.00 -3.04 0.00 0.00 32.46 25.29 1tjp n ARG 15 CO 0.00 0.00 0.00 -1.21 -3.04 0.00 0.00 177.63 173.38 1tjp s GLU 16 N -6.29 1.04 0.33 2.89 2.02 -0.20 -4.77 118.70 113.73 1tjp s GLU 16 Ca 0.09 -1.17 0.05 0.00 0.02 0.00 0.00 54.97 53.96 1tjp s GLU 16 Cb -0.03 -1.11 -0.01 0.00 0.10 0.00 0.00 34.13 33.07 1tjp s GLU 16 CO 0.86 0.24 0.48 0.20 0.02 0.00 0.00 175.26 177.06 1tjp s GLY 17 N -2.12 1.51 0.15 -1.39 0.00 0.13 -4.31 107.32 101.29 1tjp s GLY 17 Ca 0.06 -1.35 -0.13 0.00 0.00 0.00 0.00 44.72 43.31 1tjp s GLY 17 CO 0.04 -1.27 0.53 0.00 0.00 0.00 0.00 173.10 172.40 1tjp s ALA 18 N -2.19 3.59 -0.14 3.20 0.00 0.20 -4.79 121.76 121.63 1tjp s ALA 18 Ca 0.43 -0.18 0.01 0.00 0.00 0.00 0.00 51.96 52.22 1tjp s ALA 18 Cb -0.09 -2.48 0.00 0.00 0.00 0.00 0.00 23.12 20.55 1tjp s ALA 18 CO 0.32 0.48 -0.18 0.12 0.00 0.00 0.00 175.76 176.49 1tjp s PHE 19 N -1.52 2.72 -0.20 0.00 5.36 -1.26 -0.98 117.98 122.10 1tjp s PHE 19 Ca 0.39 -1.11 -0.01 0.00 -0.96 0.00 0.00 56.93 55.24 1tjp s PHE 19 Cb -0.14 -1.84 0.06 0.00 -0.34 0.00 0.00 43.02 40.75 1tjp s PHE 19 CO 0.19 -0.49 -0.01 0.08 -1.46 0.00 0.00 175.22 173.53 1tjp s VAL 20 N 0.72 0.97 0.47 3.12 1.01 -0.18 -1.34 120.40 125.17 1tjp s VAL 20 Ca -0.08 -0.78 -0.13 0.00 0.00 0.00 0.00 61.98 60.99 1tjp s VAL 20 Cb -0.16 -1.33 -0.07 0.00 0.00 0.00 0.00 36.38 34.83 1tjp s VAL 20 CO 0.01 -0.10 0.88 -2.16 0.00 0.00 0.00 175.10 173.73 1tjp s PRO 21 N 1.66 3.83 -0.04 2.72 0.04 -1.25 -1.47 135.00 140.49 1tjp s PRO 21 Ca -0.02 0.69 0.05 0.00 0.04 0.00 0.00 61.00 61.76 1tjp s PRO 21 Cb -0.17 -2.25 -0.01 0.00 0.04 0.00 0.00 34.50 32.11 1tjp s PRO 21 CO -0.07 -0.19 -0.19 0.12 0.04 0.00 0.00 177.00 176.71 1tjp s PHE 22 N -2.56 1.85 0.05 0.56 2.19 -0.13 -1.86 117.98 118.08 1tjp s PHE 22 Ca 0.55 -0.50 -0.01 0.00 0.33 0.00 0.00 56.93 57.30 1tjp s PHE 22 Cb -0.10 -1.23 -0.04 0.00 -1.31 0.00 0.00 43.02 40.34 1tjp s PHE 22 CO 0.34 -0.15 -0.03 0.14 1.83 0.00 0.00 175.22 177.34 1tjp s VAL 23 N -0.09 0.22 -0.14 3.12 -7.23 -0.95 -4.55 120.40 110.78 1tjp s VAL 23 Ca -0.02 -1.77 -0.24 0.00 -1.81 0.00 0.00 61.98 58.14 1tjp s VAL 23 Cb -0.11 -1.47 -0.02 0.00 0.56 0.00 0.00 36.38 35.34 1tjp s VAL 23 CO 0.02 -0.97 0.76 -0.89 -0.31 0.00 0.00 175.10 173.70 1tjp s THR 24 N -3.80 4.95 0.18 5.32 2.01 -1.26 -0.88 115.64 122.16 1tjp s THR 24 Ca 0.06 1.50 -0.33 0.00 0.31 0.00 0.00 61.69 63.24 1tjp s THR 24 Cb 0.07 -4.08 -0.13 0.00 0.01 0.00 0.00 72.50 68.38 1tjp s THR 24 CO -0.09 0.11 1.68 0.18 -0.69 0.00 0.00 174.62 175.80 1tjp n LEU 25 N 4.78 3.68 0.00 4.42 4.77 0.17 -2.23 117.00 132.59 1tjp n LEU 25 Ca 0.02 1.06 0.00 0.00 -0.03 0.00 0.00 56.01 57.06 1tjp n LEU 25 Cb 0.50 -1.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.07 1tjp n LEU 25 CO 0.47 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1tjp n GLY 26 N 3.80 0.79 3.65 -0.72 0.00 -1.26 -4.58 105.19 106.86 1tjp n GLY 26 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 1tjp n GLY 26 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1tjp s ASP 27 N -2.69 6.25 0.00 1.61 2.15 -0.95 -0.99 116.67 122.05 1tjp s ASP 27 Ca 0.00 0.29 0.27 0.00 0.43 0.00 0.00 52.55 53.54 1tjp s ASP 27 Cb 0.00 -2.17 0.87 0.00 -0.30 0.00 0.00 42.92 41.32 1tjp s ASP 27 CO 0.00 -0.04 1.64 -0.81 -0.17 0.00 0.00 175.17 175.79 1tjp n PRO 28 N 4.61 0.70 -3.69 4.34 -0.04 -1.26 -4.33 135.00 135.34 1tjp n PRO 28 Ca -0.11 -0.37 -0.06 0.00 -0.04 0.00 0.00 63.50 62.92 1tjp n PRO 28 Cb 0.51 -1.49 -0.02 0.00 -0.04 0.00 0.00 33.50 32.47 1tjp n PRO 28 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1tjp s GLY 29 N -2.55 -0.29 0.08 0.55 0.00 -0.16 -4.64 107.32 100.31 1tjp s GLY 29 Ca 0.24 0.29 -0.28 0.00 0.00 0.00 0.00 44.72 44.97 1tjp s GLY 29 CO 0.52 0.07 1.68 -2.22 0.00 0.00 0.00 173.10 173.15 1tjp h ILE 30 N 2.00 0.63 -0.55 0.90 2.04 -1.92 0.27 117.51 120.88 1tjp h ILE 30 Ca -0.24 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 1tjp h ILE 30 Cb 1.24 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 37.92 1tjp h ILE 30 CO 0.27 0.00 0.31 -0.33 0.00 0.00 0.00 178.15 178.40 1tjp h GLU 31 N -0.48 0.76 -0.37 2.37 5.08 -1.98 -0.83 114.58 119.13 1tjp h GLU 31 Ca -0.04 -0.09 -0.13 0.00 -1.00 0.00 0.00 59.36 58.10 1tjp h GLU 31 Cb 0.38 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 1tjp h GLU 31 CO 0.06 0.58 -0.30 0.37 -1.00 0.00 0.00 179.01 178.72 1tjp h GLN 32 N 0.74 0.80 -0.71 2.33 5.75 -1.93 -2.03 115.11 120.06 1tjp h GLN 32 Ca 0.19 -0.37 -0.03 0.00 -0.15 0.00 0.00 58.65 58.29 1tjp h GLN 32 Cb 0.04 -0.01 -0.03 0.00 1.07 0.00 0.00 27.48 28.54 1tjp h GLN 32 CO -0.03 0.99 0.31 1.03 -2.65 0.00 0.00 178.83 178.49 1tjp h SER 33 N 0.68 0.95 -0.71 -0.69 0.87 -0.57 0.16 113.55 114.24 1tjp h SER 33 Ca 0.08 -0.15 -0.01 0.00 -1.23 0.00 0.00 61.79 60.48 1tjp h SER 33 Cb 0.84 -0.25 -0.04 0.00 -0.44 0.00 0.00 62.40 62.52 1tjp h SER 33 CO 0.07 0.84 0.43 -0.07 -0.53 0.00 0.00 176.83 177.57 1tjp h LEU 34 N 1.00 0.87 -0.37 2.23 3.38 -0.90 -0.18 115.31 121.33 1tjp h LEU 34 Ca 0.24 -0.05 -0.16 0.00 0.09 0.00 0.00 57.88 57.99 1tjp h LEU 34 Cb 0.16 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 1tjp h LEU 34 CO -0.03 0.67 -0.41 0.11 0.09 0.00 0.00 178.44 178.88 1tjp h LYS 35 N 1.00 0.94 -0.33 1.13 1.57 -0.63 -2.10 116.57 118.15 1tjp h LYS 35 Ca 0.26 -0.51 0.01 0.00 -1.87 0.00 0.00 60.65 58.54 1tjp h LYS 35 Cb -0.03 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 1tjp h LYS 35 CO -0.05 1.16 0.19 0.82 -0.57 0.00 0.00 179.45 181.01 1tjp h ILE 36 N 0.75 1.03 -0.67 1.86 2.04 -0.29 -1.81 117.51 120.42 1tjp h ILE 36 Ca 0.05 -0.13 -0.06 0.00 1.00 0.00 0.00 64.86 65.72 1tjp h ILE 36 Cb 1.01 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 1tjp h ILE 36 CO 0.10 0.07 0.20 0.40 0.00 0.00 0.00 178.15 178.92 1tjp h ILE 37 N 0.39 1.25 -0.26 -0.67 2.04 -0.92 -0.31 117.51 119.04 1tjp h ILE 37 Ca 0.13 -0.89 -0.05 0.00 1.00 0.00 0.00 64.86 65.05 1tjp h ILE 37 Cb 0.00 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 36.62 1tjp h ILE 37 CO -0.06 0.34 -0.04 0.44 0.00 0.00 0.00 178.15 178.83 1tjp h ASP 38 N 0.99 0.38 -0.41 1.72 3.32 -1.15 -1.68 116.42 119.59 1tjp h ASP 38 Ca 0.22 -0.07 -0.11 0.00 0.02 0.00 0.00 57.03 57.09 1tjp h ASP 38 Cb 0.32 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 1tjp h ASP 38 CO -0.00 0.48 -0.17 0.74 -1.72 0.00 0.00 179.24 178.56 1tjp h THR 39 N 0.39 1.28 -0.81 0.35 2.02 -0.76 0.55 112.91 115.94 1tjp h THR 39 Ca 0.08 -1.30 -0.01 0.00 0.77 0.00 0.00 66.41 65.95 1tjp h THR 39 Cb 0.33 1.24 -0.04 0.00 -1.74 0.00 0.00 68.15 67.94 1tjp h THR 39 CO 0.01 0.44 0.48 -0.07 0.37 0.00 0.00 175.52 176.75 1tjp h LEU 40 N 0.66 0.98 -0.22 2.58 3.38 -0.52 -0.61 115.31 121.57 1tjp h LEU 40 Ca 0.10 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1tjp h LEU 40 Cb 0.72 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 1tjp h LEU 40 CO 0.05 0.77 -0.04 0.40 0.09 0.00 0.00 178.44 179.72 1tjp h ILE 41 N 1.11 1.28 0.00 1.22 2.04 -1.08 -1.87 117.51 120.21 1tjp h ILE 41 Ca 0.29 -1.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.11 1tjp h ILE 41 Cb -0.02 1.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 1tjp h ILE 41 CO -0.05 0.31 -0.19 -0.78 0.00 0.00 0.00 178.15 177.44 1tjp h ASP 42 N 0.15 0.00 0.76 1.72 3.58 -0.60 -1.67 116.42 120.35 1tjp h ASP 42 Ca 0.06 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.51 1tjp h ASP 42 Cb 0.48 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.53 1tjp h ASP 42 CO 0.02 0.19 -0.04 0.00 -2.88 0.00 0.00 179.24 176.53 1tjp n ALA 43 N -2.34 2.49 0.00 -0.78 0.00 -0.26 -4.91 120.51 114.71 1tjp n ALA 43 Ca -0.02 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1tjp n ALA 43 Cb 0.29 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.29 1tjp n ALA 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tjp n GLY 44 N 1.40 1.02 3.75 0.00 0.00 -0.63 -3.61 105.19 107.11 1tjp n GLY 44 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1tjp n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tjp s ALA 45 N -1.68 3.74 -0.11 4.61 0.00 -0.72 -4.84 121.76 122.76 1tjp s ALA 45 Ca 0.00 1.54 0.15 0.00 0.00 0.00 0.00 51.96 53.65 1tjp s ALA 45 Cb 0.00 -3.64 -0.10 0.00 0.00 0.00 0.00 23.12 19.38 1tjp s ALA 45 CO 0.00 -0.95 0.99 -0.44 0.00 0.00 0.00 175.76 175.36 1tjp h ASP 46 N 4.93 0.00 -5.15 0.00 3.45 -1.56 -3.45 116.42 114.64 1tjp h ASP 46 Ca -0.47 0.00 -0.02 0.00 0.43 0.00 0.00 57.03 56.97 1tjp h ASP 46 Cb 1.22 0.00 -0.06 0.00 -0.56 0.00 0.00 39.33 39.92 1tjp h ASP 46 CO 0.80 0.62 0.05 0.00 -1.57 0.00 0.00 179.24 179.14 1tjp s ALA 47 N -2.89 -0.58 0.04 3.45 0.00 -1.25 -4.20 121.76 116.33 1tjp s ALA 47 Ca -0.01 -0.71 0.06 0.00 0.00 0.00 0.00 51.96 51.30 1tjp s ALA 47 Cb 0.08 0.95 -0.02 0.00 0.00 0.00 0.00 23.12 24.13 1tjp s ALA 47 CO 0.80 -0.93 -0.16 -0.51 0.00 0.00 0.00 175.76 174.95 1tjp s LEU 48 N -3.01 2.16 -0.11 0.00 1.43 -0.28 -3.89 118.68 114.99 1tjp s LEU 48 Ca 0.18 -0.46 0.03 0.00 -1.03 0.00 0.00 54.13 52.85 1tjp s LEU 48 Cb -0.03 -0.74 0.00 0.00 0.03 0.00 0.00 46.19 45.46 1tjp s LEU 48 CO 0.09 0.09 -0.23 -0.70 0.23 0.00 0.00 176.35 175.83 1tjp s GLU 49 N -1.10 3.05 -0.08 1.70 2.12 -0.78 -1.06 118.70 122.56 1tjp s GLU 49 Ca 0.04 -0.87 0.01 0.00 0.36 0.00 0.00 54.97 54.51 1tjp s GLU 49 Cb -0.08 -2.35 0.02 0.00 0.26 0.00 0.00 34.13 31.98 1tjp s GLU 49 CO 0.01 0.12 -0.09 -0.51 -0.54 0.00 0.00 175.26 174.25 1tjp s LEU 50 N 0.50 1.39 -0.06 2.70 1.43 0.43 -2.24 118.68 122.83 1tjp s LEU 50 Ca -0.15 -0.26 -0.16 0.00 -1.03 0.00 0.00 54.13 52.53 1tjp s LEU 50 Cb -0.17 -0.74 -0.05 0.00 0.03 0.00 0.00 46.19 45.25 1tjp s LEU 50 CO 0.05 -0.04 0.42 -0.83 0.23 0.00 0.00 176.35 176.18 1tjp s GLY 51 N 1.10 2.42 -0.12 -3.19 0.00 -0.06 -0.87 107.32 106.59 1tjp s GLY 51 Ca -0.07 -0.24 -0.20 0.00 0.00 0.00 0.00 44.72 44.21 1tjp s GLY 51 CO -0.01 0.39 0.58 0.14 0.00 0.00 0.00 173.10 174.20 1tjp s VAL 52 N -0.31 5.11 0.13 1.40 1.01 -1.13 -0.66 120.40 125.95 1tjp s VAL 52 Ca 0.23 1.15 -0.34 0.00 0.00 0.00 0.00 61.98 63.02 1tjp s VAL 52 Cb -0.16 -3.91 -0.14 0.00 0.00 0.00 0.00 36.38 32.17 1tjp s VAL 52 CO 0.11 0.25 1.58 -2.65 0.00 0.00 0.00 175.10 174.40 1tjp n PRO 53 N 4.03 2.05 -4.24 2.72 -0.02 -1.26 -4.90 135.00 133.38 1tjp n PRO 53 Ca -0.04 0.74 -0.18 0.00 -2.02 0.00 0.00 63.50 62.00 1tjp n PRO 53 Cb 0.51 -2.50 -0.13 0.00 -0.02 0.00 0.00 33.50 31.36 1tjp n PRO 53 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1tjp s PHE 54 N 1.19 1.02 0.41 6.00 5.36 -1.26 -4.88 117.98 125.82 1tjp s PHE 54 Ca 0.81 -0.38 0.14 0.00 -0.96 0.00 0.00 56.93 56.55 1tjp s PHE 54 Cb -0.71 -0.60 0.91 0.00 -0.34 0.00 0.00 43.02 42.27 1tjp s PHE 54 CO 0.40 0.01 1.93 0.66 -1.46 0.00 0.00 175.22 176.76 1tjp h SER 55 N 4.84 0.00 -2.15 6.13 4.64 -1.96 -3.37 113.55 121.68 1tjp h SER 55 Ca -0.37 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.38 1tjp h SER 55 Cb 1.19 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.88 1tjp h SER 55 CO 0.43 0.26 -0.97 0.47 -0.87 0.00 0.00 176.83 176.15 1tjp n ASP 56 N -4.18 0.87 -4.58 4.97 8.00 -1.26 -5.05 116.55 115.32 1tjp n ASP 56 Ca -0.02 -2.81 -0.40 0.00 0.71 0.00 0.00 54.79 52.27 1tjp n ASP 56 Cb 0.31 -0.64 -0.01 0.00 -0.02 0.00 0.00 41.12 40.76 1tjp n ASP 56 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1tjp s PRO 57 N -1.24 3.68 0.00 -0.24 0.04 -1.26 -4.83 135.00 131.15 1tjp s PRO 57 Ca 0.35 -1.78 0.22 0.00 0.04 0.00 0.00 61.00 59.84 1tjp s PRO 57 Cb 0.14 -5.47 1.24 0.00 0.04 0.00 0.00 34.50 30.45 1tjp s PRO 57 CO -0.11 -2.58 1.72 1.47 0.04 0.00 0.00 177.00 177.54 1tjp n LEU 58 N 9.57 0.00 -0.97 -3.56 -0.00 -1.26 -1.96 117.00 118.82 1tjp n LEU 58 Ca 0.47 0.14 0.09 0.00 -0.00 0.00 0.00 56.01 56.71 1tjp n LEU 58 Cb 0.46 -0.14 0.20 0.00 -0.00 0.00 0.00 43.42 43.95 1tjp n LEU 58 CO 0.74 -0.04 0.67 0.00 -0.00 0.00 0.00 177.39 178.76 1tjp n ALA 59 N -1.14 2.35 -2.54 1.47 0.00 -1.26 -4.99 120.51 114.39 1tjp n ALA 59 Ca 0.14 -1.06 -0.33 0.00 0.00 0.00 0.00 53.44 52.18 1tjp n ALA 59 Cb 0.12 -0.70 -0.12 0.00 0.00 0.00 0.00 19.45 18.76 1tjp n ALA 59 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1tjp s ASP 60 N -1.17 4.42 1.09 0.00 1.01 -0.83 -1.86 116.67 119.34 1tjp s ASP 60 Ca 0.34 -0.08 -0.16 0.00 0.71 0.00 0.00 52.55 53.35 1tjp s ASP 60 Cb 0.19 -1.05 0.23 0.00 1.01 0.00 0.00 42.92 43.30 1tjp s ASP 60 CO 0.25 0.36 1.11 0.61 0.21 0.00 0.00 175.17 177.71 1tjp n GLY 61 N 2.25 -1.99 0.37 0.21 0.00 -0.80 -4.68 105.19 100.54 1tjp n GLY 61 Ca -0.18 -1.62 0.12 0.00 0.00 0.00 0.00 46.02 44.34 1tjp n GLY 61 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1tjp h PRO 62 N 0.00 0.64 -0.03 1.61 0.11 -1.99 -0.85 132.00 131.49 1tjp h PRO 62 Ca -0.38 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1tjp h PRO 62 Cb 1.09 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.06 1tjp h PRO 62 CO 0.26 0.42 0.02 1.15 -0.21 0.00 0.00 178.00 179.65 1tjp h THR 63 N 0.66 1.01 0.00 -1.15 2.02 -1.93 -0.27 112.91 113.26 1tjp h THR 63 Ca 0.42 -0.02 -0.13 0.00 0.77 0.00 0.00 66.41 67.45 1tjp h THR 63 Cb 0.68 0.97 -0.02 0.00 -1.74 0.00 0.00 68.15 68.04 1tjp h THR 63 CO -0.18 0.01 -0.62 0.40 0.37 0.00 0.00 175.52 175.50 1tjp h ILE 64 N 0.04 1.17 -0.64 3.11 2.04 -1.86 -2.39 117.51 118.98 1tjp h ILE 64 Ca 0.01 -2.36 0.04 0.00 1.00 0.00 0.00 64.86 63.55 1tjp h ILE 64 Cb -0.00 2.38 -0.05 0.00 -0.74 0.00 0.00 36.82 38.41 1tjp h ILE 64 CO -0.00 0.61 0.37 1.56 0.00 0.00 0.00 178.15 180.68 1tjp h GLN 65 N 0.00 0.68 0.00 2.37 4.20 -0.81 -1.44 115.11 120.11 1tjp h GLN 65 Ca -0.01 -0.04 -0.08 0.00 0.06 0.00 0.00 58.65 58.58 1tjp h GLN 65 Cb 1.33 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.95 1tjp h GLN 65 CO 0.08 0.45 -0.38 -0.91 -0.67 0.00 0.00 178.83 177.41 1tjp h ASN 66 N 0.70 0.00 -0.55 1.46 2.35 -0.86 -1.64 115.58 117.04 1tjp h ASN 66 Ca 0.27 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.91 1tjp h ASN 66 Cb 0.11 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.47 1tjp h ASN 66 CO -0.15 0.38 -0.08 0.00 -1.65 0.00 0.00 177.43 175.92 1tjp h ALA 67 N 1.62 0.75 -0.63 -0.83 0.00 -0.82 0.15 119.26 119.51 1tjp h ALA 67 Ca -0.00 -0.34 -0.06 0.00 0.00 0.00 0.00 54.91 54.50 1tjp h ALA 67 Cb 0.71 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1tjp h ALA 67 CO 0.05 0.65 0.14 -0.91 0.00 0.00 0.00 179.25 179.18 1tjp h ASN 68 N 0.91 0.96 -0.42 0.00 4.21 -1.06 -1.62 115.58 118.56 1tjp h ASN 68 Ca 0.15 -0.24 -0.01 0.00 1.21 0.00 0.00 56.30 57.41 1tjp h ASN 68 Cb 0.65 -0.25 -0.02 0.00 -1.12 0.00 0.00 38.32 37.58 1tjp h ASN 68 CO 0.04 0.95 0.24 0.25 -1.29 0.00 0.00 177.43 177.63 1tjp h LEU 69 N 0.93 0.51 -0.92 1.61 5.85 -0.98 -1.58 115.31 120.72 1tjp h LEU 69 Ca 0.20 -0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 1tjp h LEU 69 Cb 0.37 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 1tjp h LEU 69 CO 0.00 0.43 0.52 0.03 -0.34 0.00 0.00 178.44 179.09 1tjp h ARG 70 N 0.55 1.28 -0.60 1.25 3.08 -0.43 -0.91 114.38 118.60 1tjp h ARG 70 Ca 0.15 -0.14 -0.06 0.00 0.07 0.00 0.00 59.98 60.00 1tjp h ARG 70 Cb 0.03 -0.26 -0.03 0.00 0.08 0.00 0.00 29.97 29.79 1tjp h ARG 70 CO -0.03 0.92 0.14 0.00 -1.07 0.00 0.00 179.97 179.93 1tjp h ALA 71 N 1.29 1.12 -0.29 0.04 0.00 -0.97 -1.86 119.26 118.58 1tjp h ALA 71 Ca 0.33 -0.22 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 1tjp h ALA 71 Cb -0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1tjp h ALA 71 CO -0.06 0.59 -0.24 0.74 0.00 0.00 0.00 179.25 180.28 1tjp h PHE 72 N 0.89 0.63 -0.15 0.00 0.04 -0.81 -1.83 116.94 115.71 1tjp h PHE 72 Ca 0.19 -0.14 -0.02 0.00 2.80 0.00 0.00 57.97 60.80 1tjp h PHE 72 Cb 0.33 -0.15 -0.01 0.00 2.20 0.00 0.00 35.95 38.32 1tjp h PHE 72 CO 0.02 0.76 -0.01 0.00 -0.60 0.00 0.00 178.31 178.48 1tjp h ALA 73 N 1.24 1.71 -0.00 2.45 0.00 -0.67 0.22 119.26 124.21 1tjp h ALA 73 Ca 0.07 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1tjp h ALA 73 Cb 0.68 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1tjp h ALA 73 CO 0.05 0.22 -0.00 0.00 0.00 0.00 0.00 179.25 179.52 1tjp n ALA 74 N -2.50 2.66 -1.06 0.00 0.00 -0.75 -4.92 120.51 113.93 1tjp n ALA 74 Ca -0.01 -0.27 -0.02 0.00 0.00 0.00 0.00 53.44 53.14 1tjp n ALA 74 Cb 0.17 -1.42 -0.01 0.00 0.00 0.00 0.00 19.45 18.19 1tjp n ALA 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tjp n GLY 75 N 1.05 0.56 3.68 0.00 0.00 0.07 -4.92 105.19 105.62 1tjp n GLY 75 Ca 0.23 -0.80 -0.42 0.00 0.00 0.00 0.00 46.02 45.02 1tjp n GLY 75 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tjp s VAL 76 N -2.06 3.55 0.34 1.61 1.01 -0.77 -5.01 120.40 119.07 1tjp s VAL 76 Ca 0.00 0.86 0.08 0.00 0.00 0.00 0.00 61.98 62.93 1tjp s VAL 76 Cb 0.00 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.78 1tjp s VAL 76 CO 0.00 -0.03 0.13 0.42 0.00 0.00 0.00 175.10 175.62 1tjp s THR 77 N 3.03 3.01 0.38 3.92 -4.23 -1.26 -4.72 115.64 115.76 1tjp s THR 77 Ca 0.68 -1.71 0.07 0.00 -1.18 0.00 0.00 61.69 59.55 1tjp s THR 77 Cb -0.33 -2.97 0.19 0.00 1.34 0.00 0.00 72.50 70.73 1tjp s THR 77 CO 0.28 -0.19 1.95 -0.65 -0.54 0.00 0.00 174.62 175.47 1tjp h PRO 78 N 1.57 0.42 -0.72 3.99 0.11 -1.95 -1.54 132.00 133.88 1tjp h PRO 78 Ca -0.44 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 65.54 1tjp h PRO 78 Cb 1.25 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 1tjp h PRO 78 CO 0.63 0.43 0.19 0.00 -0.21 0.00 0.00 178.00 179.05 1tjp h ALA 79 N 1.63 0.98 -0.12 -0.75 0.00 -2.00 -1.60 119.26 117.39 1tjp h ALA 79 Ca 0.10 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 1tjp h ALA 79 Cb 0.23 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1tjp h ALA 79 CO 0.00 0.67 -0.30 1.96 0.00 0.00 0.00 179.25 181.58 1tjp h GLN 80 N 1.09 0.22 -0.69 0.00 4.20 -1.82 -2.34 115.11 115.77 1tjp h GLN 80 Ca 0.23 -0.08 -0.07 0.00 0.06 0.00 0.00 58.65 58.79 1tjp h GLN 80 Cb 0.35 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.08 1tjp h GLN 80 CO -0.00 0.51 0.16 0.00 -0.67 0.00 0.00 178.83 178.83 1tjp h PHE 82 N 1.04 0.55 -0.58 0.00 0.04 -1.05 0.17 116.94 117.12 1tjp h PHE 82 Ca 0.22 -0.13 -0.06 0.00 2.80 0.00 0.00 57.97 60.80 1tjp h PHE 82 Cb 0.37 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 38.37 1tjp h PHE 82 CO 0.03 0.73 0.13 0.93 -0.60 0.00 0.00 178.31 179.52 1tjp h GLU 83 N 0.42 0.93 -0.50 1.51 5.08 -1.07 -1.37 114.58 119.60 1tjp h GLU 83 Ca 0.06 -0.23 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 1tjp h GLU 83 Cb 0.72 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 1tjp h GLU 83 CO 0.06 0.87 0.31 0.52 -1.00 0.00 0.00 179.01 179.77 1tjp h MET 84 N 0.83 0.66 -0.86 2.33 2.86 -0.74 -2.30 114.93 117.72 1tjp h MET 84 Ca 0.18 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.76 1tjp h MET 84 Cb 0.37 -0.14 -0.04 0.00 0.06 0.00 0.00 31.60 31.84 1tjp h MET 84 CO 0.00 0.47 0.51 -0.07 1.06 0.00 0.00 176.91 178.88 1tjp h LEU 85 N 0.67 1.03 -0.81 1.22 3.38 -0.79 0.01 115.31 120.02 1tjp h LEU 85 Ca 0.18 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1tjp h LEU 85 Cb -0.04 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.41 1tjp h LEU 85 CO -0.04 0.80 0.46 0.00 0.09 0.00 0.00 178.44 179.75 1tjp h ALA 86 N 1.28 1.04 -0.50 1.53 0.00 -1.03 -1.26 119.26 120.31 1tjp h ALA 86 Ca 0.31 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 55.01 1tjp h ALA 86 Cb -0.04 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 1tjp h ALA 86 CO -0.06 0.53 -0.08 1.25 0.00 0.00 0.00 179.25 180.89 1tjp h LEU 87 N 1.12 0.93 -0.65 0.00 5.85 -0.82 -1.16 115.31 120.58 1tjp h LEU 87 Ca 0.29 -0.34 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 1tjp h LEU 87 Cb 0.00 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.75 1tjp h LEU 87 CO -0.05 1.05 0.37 0.40 -0.34 0.00 0.00 178.44 179.87 1tjp h ILE 88 N 0.79 1.20 -0.22 4.05 2.04 -0.69 -1.53 117.51 123.15 1tjp h ILE 88 Ca 0.13 -0.49 -0.08 0.00 1.00 0.00 0.00 64.86 65.42 1tjp h ILE 88 Cb 0.62 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.03 1tjp h ILE 88 CO 0.04 0.22 -0.23 -0.09 0.00 0.00 0.00 178.15 178.09 1tjp h ARG 89 N 0.89 0.40 0.00 2.37 9.65 -1.03 -1.11 114.38 125.55 1tjp h ARG 89 Ca 0.23 -0.14 -0.06 0.00 -1.10 0.00 0.00 59.98 58.92 1tjp h ARG 89 Cb 0.02 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 28.56 1tjp h ARG 89 CO -0.04 0.61 -0.28 0.93 2.80 0.00 0.00 179.97 183.98 1tjp h GLU 90 N 0.36 0.00 0.10 0.20 5.08 -0.60 -2.86 114.58 116.86 1tjp h GLU 90 Ca 0.06 0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 58.12 1tjp h GLU 90 Cb 0.60 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 1tjp h GLU 90 CO 0.04 0.28 -1.52 0.87 -1.00 0.00 0.00 179.01 177.68 1tjp h LYS 91 N 0.00 0.21 -3.99 2.33 1.57 -0.80 -3.44 116.57 112.46 1tjp h LYS 91 Ca -0.00 -0.35 -0.61 0.00 -1.87 0.00 0.00 60.65 57.82 1tjp h LYS 91 Cb 0.60 0.13 -0.40 0.00 0.08 0.00 0.00 32.23 32.64 1tjp h LYS 91 CO 0.04 1.05 -0.75 -1.01 -0.57 0.00 0.00 179.45 178.21 1tjp s HIS 92 N -2.62 2.41 -0.21 -1.35 3.76 -0.46 -5.02 115.29 111.79 1tjp s HIS 92 Ca -0.08 -2.12 0.25 0.00 -0.15 0.00 0.00 55.06 52.96 1tjp s HIS 92 Cb 0.07 -2.07 0.65 0.00 1.11 0.00 0.00 32.58 32.34 1tjp s HIS 92 CO 0.84 -0.89 1.72 -1.00 -0.85 0.00 0.00 174.74 174.57 1tjp h PRO 93 N 7.93 0.00 0.00 8.40 0.13 -1.85 -3.37 132.00 143.23 1tjp h PRO 93 Ca -0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.02 1tjp h PRO 93 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 1tjp h PRO 93 CO 0.48 0.07 -0.74 0.25 -0.23 0.00 0.00 178.00 177.83 1tjp n THR 94 N -3.14 0.00 -2.13 1.56 -2.24 -1.26 -5.01 114.28 102.06 1tjp n THR 94 Ca 0.02 -0.26 -0.42 0.00 -2.27 0.00 0.00 64.05 61.13 1tjp n THR 94 Cb 0.48 0.71 -0.03 0.00 -2.10 0.00 0.00 70.33 69.39 1tjp n THR 94 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1tjp s ILE 95 N -1.97 3.16 0.30 2.28 2.07 -1.26 -4.89 121.20 120.88 1tjp s ILE 95 Ca 0.00 0.85 -0.29 0.00 -1.41 0.00 0.00 60.65 59.80 1tjp s ILE 95 Cb 0.04 -3.54 -0.10 0.00 0.13 0.00 0.00 42.46 38.99 1tjp s ILE 95 CO 0.26 0.08 1.27 -2.84 -1.91 0.00 0.00 174.94 171.80 1tjp s PRO 96 N 0.87 4.42 -0.15 3.50 0.02 -1.26 -4.92 135.00 137.47 1tjp s PRO 96 Ca 0.64 2.11 0.01 0.00 0.02 0.00 0.00 61.00 63.78 1tjp s PRO 96 Cb -0.38 -3.12 0.02 0.00 0.02 0.00 0.00 34.50 31.04 1tjp s PRO 96 CO 0.32 -0.12 -0.16 0.42 -0.33 0.00 0.00 177.00 177.13 1tjp s ILE 97 N -0.91 1.71 0.05 2.83 1.01 -1.26 -1.12 121.20 123.51 1tjp s ILE 97 Ca 0.50 -0.72 0.08 0.00 0.00 0.00 0.00 60.65 60.51 1tjp s ILE 97 Cb -0.38 -1.58 -0.03 0.00 0.01 0.00 0.00 42.46 40.49 1tjp s ILE 97 CO 0.48 0.48 -0.22 -0.83 0.00 0.00 0.00 174.94 174.85 1tjp s GLY 98 N 1.38 1.51 0.05 6.18 0.00 -0.23 0.01 107.32 116.22 1tjp s GLY 98 Ca 0.04 -1.24 0.01 0.00 0.00 0.00 0.00 44.72 43.53 1tjp s GLY 98 CO -0.10 -1.14 0.12 1.08 0.00 0.00 0.00 173.10 173.06 1tjp s LEU 99 N -1.41 4.02 -0.32 0.66 1.43 -0.30 -0.43 118.68 122.32 1tjp s LEU 99 Ca 0.13 0.12 -0.05 0.00 -1.03 0.00 0.00 54.13 53.30 1tjp s LEU 99 Cb -0.10 -2.59 0.04 0.00 0.03 0.00 0.00 46.19 43.56 1tjp s LEU 99 CO 0.04 0.20 0.08 -0.22 0.23 0.00 0.00 176.35 176.67 1tjp s LEU 100 N -2.28 4.14 0.36 1.79 1.98 -0.05 -1.02 118.68 123.60 1tjp s LEU 100 Ca 0.30 -1.09 0.09 0.00 -2.89 0.00 0.00 54.13 50.53 1tjp s LEU 100 Cb -0.12 -1.84 -0.07 0.00 0.66 0.00 0.00 46.19 44.82 1tjp s LEU 100 CO 0.22 -0.29 -0.08 -0.04 -1.89 0.00 0.00 176.35 174.28 1tjp s MET 101 N 1.39 1.84 0.08 1.98 -1.94 -0.04 -2.83 119.30 119.78 1tjp s MET 101 Ca -0.02 -1.97 0.09 0.00 -1.71 0.00 0.00 55.69 52.08 1tjp s MET 101 Cb -0.19 -1.69 -0.03 0.00 2.01 0.00 0.00 34.83 34.93 1tjp s MET 101 CO 0.02 0.10 -0.22 0.71 -0.01 0.00 0.00 175.02 175.62 1tjp s TYR 102 N -2.63 2.43 0.32 -0.03 2.02 -1.26 -0.71 117.35 117.49 1tjp s TYR 102 Ca 0.33 -0.33 0.06 0.00 -0.37 0.00 0.00 57.07 56.76 1tjp s TYR 102 Cb 0.04 -1.37 0.71 0.00 -0.40 0.00 0.00 41.96 40.94 1tjp s TYR 102 CO 0.17 0.27 1.84 0.00 -1.57 0.00 0.00 175.55 176.26 1tjp h ALA 103 N 4.28 1.69 -0.03 3.71 0.00 -1.91 -1.77 119.26 125.24 1tjp h ALA 103 Ca -0.49 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.41 1tjp h ALA 103 Cb 1.16 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 1tjp h ALA 103 CO 0.44 0.04 -0.16 -0.97 0.00 0.00 0.00 179.25 178.60 1tjp h ASN 104 N 0.82 0.04 0.72 0.00 -1.24 -1.98 0.29 115.58 114.23 1tjp h ASN 104 Ca 0.49 -0.01 -0.08 0.00 0.71 0.00 0.00 56.30 57.41 1tjp h ASN 104 Cb 0.67 -0.01 -0.01 0.00 0.73 0.00 0.00 38.32 39.70 1tjp h ASN 104 CO -0.26 0.21 -0.38 -0.07 -1.29 0.00 0.00 177.43 175.64 1tjp h LEU 105 N 0.04 0.00 0.23 0.34 3.38 -1.74 0.11 115.31 117.68 1tjp h LEU 105 Ca 0.01 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.65 1tjp h LEU 105 Cb 0.31 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.09 1tjp h LEU 105 CO 0.02 0.38 -1.50 0.58 0.09 0.00 0.00 178.44 178.01 1tjp h VAL 106 N 0.00 1.21 0.00 1.22 2.07 -1.33 -3.36 116.25 116.06 1tjp h VAL 106 Ca -0.00 -2.64 -0.14 0.00 0.82 0.00 0.00 66.70 64.73 1tjp h VAL 106 Cb 0.84 2.99 -0.02 0.00 -1.52 0.00 0.00 31.29 33.58 1tjp h VAL 106 CO 0.05 0.81 -0.69 0.15 0.02 0.00 0.00 177.57 177.91 1tjp h PHE 107 N 0.09 0.00 -0.82 1.57 3.57 -0.90 -3.24 116.94 117.21 1tjp h PHE 107 Ca -0.27 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.30 1tjp h PHE 107 Cb 2.12 0.00 -0.10 0.00 2.79 0.00 0.00 35.95 40.76 1tjp h PHE 107 CO 0.13 0.69 -0.49 -1.71 -2.23 0.00 0.00 178.31 174.70 1tjp n ASN 108 N -3.43 -0.87 -1.28 0.41 5.15 0.38 -1.10 115.26 114.51 1tjp n ASN 108 Ca 0.00 1.60 0.02 0.00 -0.60 0.00 0.00 54.58 55.60 1tjp n ASN 108 Cb 0.75 -0.26 0.26 0.00 -0.53 0.00 0.00 39.78 40.01 1tjp n ASN 108 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1tjp n ASN 109 N -4.88 3.90 0.00 1.20 5.15 -1.26 -5.02 115.26 114.34 1tjp n ASN 109 Ca 0.02 -3.24 0.00 0.00 -0.60 0.00 0.00 54.58 50.76 1tjp n ASN 109 Cb 0.21 -0.62 0.00 0.00 -0.53 0.00 0.00 39.78 38.84 1tjp n ASN 109 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1tjp n GLY 110 N -0.52 2.06 0.16 8.20 0.00 -0.26 -4.70 105.19 110.14 1tjp n GLY 110 Ca 0.30 -1.22 -0.08 0.00 0.00 0.00 0.00 46.02 45.01 1tjp n GLY 110 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1tjp h ILE 111 N 0.00 1.10 -0.68 -0.61 2.04 -1.73 -1.46 117.51 116.17 1tjp h ILE 111 Ca 0.00 -0.19 -0.02 0.00 1.00 0.00 0.00 64.86 65.65 1tjp h ILE 111 Cb 0.00 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 36.62 1tjp h ILE 111 CO 0.00 0.10 0.34 -0.78 0.00 0.00 0.00 178.15 177.81 1tjp h ASP 112 N 0.50 0.88 -0.47 1.72 3.58 -1.91 -2.34 116.42 118.38 1tjp h ASP 112 Ca 0.13 -0.12 -0.01 0.00 0.42 0.00 0.00 57.03 57.45 1tjp h ASP 112 Cb -0.05 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 40.75 1tjp h ASP 112 CO -0.03 0.75 0.25 0.00 -2.88 0.00 0.00 179.24 177.34 1tjp h ALA 113 N 1.16 1.50 0.05 -0.78 0.00 -1.78 -0.81 119.26 118.61 1tjp h ALA 113 Ca 0.24 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1tjp h ALA 113 Cb 0.09 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1tjp h ALA 113 CO -0.03 0.40 -0.03 0.35 0.00 0.00 0.00 179.25 179.95 1tjp h PHE 114 N 0.70 -0.07 -0.15 0.00 3.57 -0.74 -1.39 116.94 118.87 1tjp h PHE 114 Ca 0.18 -0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.60 1tjp h PHE 114 Cb 0.05 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 1tjp h PHE 114 CO 0.00 0.14 -0.27 1.88 -2.23 0.00 0.00 178.31 177.84 1tjp h TYR 115 N -0.27 0.30 -0.54 0.41 0.05 -1.21 -1.66 116.97 114.05 1tjp h TYR 115 Ca -0.01 -0.06 -0.06 0.00 0.05 0.00 0.00 58.73 58.65 1tjp h TYR 115 Cb 0.24 -0.08 -0.02 0.00 1.01 0.00 0.00 36.73 37.88 1tjp h TYR 115 CO -0.01 0.52 0.08 0.00 -1.05 0.00 0.00 178.16 177.71 1tjp h ALA 116 N 1.48 1.13 -0.51 3.88 0.00 -0.99 -1.33 119.26 122.93 1tjp h ALA 116 Ca 0.04 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.60 1tjp h ALA 116 Cb 0.60 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1tjp h ALA 116 CO 0.04 0.57 -0.13 -0.09 0.00 0.00 0.00 179.25 179.64 1tjp h ARG 117 N 0.82 0.99 -0.57 0.00 9.65 -0.69 -1.46 114.38 123.11 1tjp h ARG 117 Ca 0.17 -0.38 0.05 0.00 -1.10 0.00 0.00 59.98 58.71 1tjp h ARG 117 Cb 0.37 -0.05 -0.05 0.00 -1.39 0.00 0.00 29.97 28.85 1tjp h ARG 117 CO 0.01 1.06 0.31 0.00 2.80 0.00 0.00 179.97 184.15 1tjp h GLU 119 N 0.59 1.17 -0.78 0.00 4.81 -0.92 -1.10 114.58 118.35 1tjp h GLU 119 Ca 0.25 -0.23 -0.03 0.00 -0.13 0.00 0.00 59.36 59.22 1tjp h GLU 119 Cb 0.14 -0.18 -0.04 0.00 0.63 0.00 0.00 28.75 29.30 1tjp h GLU 119 CO -0.16 0.97 0.37 0.37 -0.73 0.00 0.00 179.01 179.84 1tjp h GLN 120 N 1.13 1.11 -0.00 1.92 4.15 -0.69 -2.42 115.11 120.32 1tjp h GLN 120 Ca 0.25 -0.16 0.00 0.00 0.77 0.00 0.00 58.65 59.51 1tjp h GLN 120 Cb 0.26 -0.20 0.00 0.00 0.21 0.00 0.00 27.48 27.75 1tjp h GLN 120 CO -0.01 0.86 -0.36 1.33 -1.93 0.00 0.00 178.83 178.71 1tjp n VAL 121 N -4.32 0.00 -0.20 2.39 0.24 -0.67 -4.95 118.33 110.83 1tjp n VAL 121 Ca 0.08 -0.01 0.00 0.00 -2.04 0.00 0.00 64.34 62.37 1tjp n VAL 121 Cb 0.14 0.08 0.00 0.00 -1.47 0.00 0.00 33.84 32.59 1tjp n VAL 121 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1tjp n GLY 122 N 1.48 0.88 3.76 7.63 0.00 -0.77 -4.27 105.19 113.91 1tjp n GLY 122 Ca 0.07 -0.19 -0.36 0.00 0.00 0.00 0.00 46.02 45.54 1tjp n GLY 122 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tjp s VAL 123 N -2.00 2.90 -0.17 1.61 1.01 -0.49 -4.81 120.40 118.45 1tjp s VAL 123 Ca 0.00 0.57 0.12 0.00 0.00 0.00 0.00 61.98 62.67 1tjp s VAL 123 Cb 0.00 -3.23 -0.19 0.00 0.00 0.00 0.00 36.38 32.95 1tjp s VAL 123 CO 0.00 -0.11 0.01 0.47 0.00 0.00 0.00 175.10 175.47 1tjp n ASP 124 N -1.37 1.16 -3.82 3.32 8.00 0.10 -4.63 116.55 119.30 1tjp n ASP 124 Ca 0.12 -0.02 -0.10 0.00 0.71 0.00 0.00 54.79 55.50 1tjp n ASP 124 Cb 0.50 0.67 -0.06 0.00 -0.02 0.00 0.00 41.12 42.21 1tjp n ASP 124 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1tjp s SER 125 N -5.26 -0.05 -0.04 -2.24 1.04 -0.94 -0.61 113.70 105.60 1tjp s SER 125 Ca -0.12 -0.62 -0.01 0.00 0.48 0.00 0.00 55.95 55.67 1tjp s SER 125 Cb 0.05 0.44 0.03 0.00 0.10 0.00 0.00 66.02 66.65 1tjp s SER 125 CO 0.65 -0.87 0.08 -0.69 0.98 0.00 0.00 173.24 173.39 1tjp s VAL 126 N -3.89 -0.10 -0.25 5.02 1.01 -0.66 -1.16 120.40 120.38 1tjp s VAL 126 Ca 0.09 0.28 -0.07 0.00 0.00 0.00 0.00 61.98 62.29 1tjp s VAL 126 Cb 0.03 -0.16 -0.02 0.00 0.00 0.00 0.00 36.38 36.23 1tjp s VAL 126 CO -0.06 0.12 0.05 -0.22 0.00 0.00 0.00 175.10 174.99 1tjp s LEU 127 N 1.53 3.42 -0.41 3.92 2.96 -0.19 -1.76 118.68 128.15 1tjp s LEU 127 Ca -0.04 -0.32 -0.13 0.00 -0.22 0.00 0.00 54.13 53.42 1tjp s LEU 127 Cb -0.12 -1.89 0.05 0.00 0.50 0.00 0.00 46.19 44.72 1tjp s LEU 127 CO -0.04 -0.06 0.28 -0.69 -1.32 0.00 0.00 176.35 174.52 1tjp s VAL 128 N 1.58 4.83 0.39 1.68 1.01 -1.26 -0.86 120.40 127.77 1tjp s VAL 128 Ca 0.06 -0.95 0.06 0.00 0.00 0.00 0.00 61.98 61.14 1tjp s VAL 128 Cb -0.15 -3.78 0.26 0.00 0.00 0.00 0.00 36.38 32.71 1tjp s VAL 128 CO 0.02 -0.38 2.04 0.00 0.00 0.00 0.00 175.10 176.79 1tjp h ALA 129 N 8.55 1.66 -0.64 5.51 0.00 -1.29 -2.71 119.26 130.34 1tjp h ALA 129 Ca -0.26 -0.04 -0.25 0.00 0.00 0.00 0.00 54.91 54.37 1tjp h ALA 129 Cb 1.11 -0.19 -0.15 0.00 0.00 0.00 0.00 17.79 18.56 1tjp h ALA 129 CO 0.75 0.31 0.24 -0.40 0.00 0.00 0.00 179.25 180.15 1tjp n ASP 130 N -4.46 3.92 -4.07 0.00 5.75 -1.26 -4.82 116.55 111.61 1tjp n ASP 130 Ca 0.04 -3.41 -0.33 0.00 -0.01 0.00 0.00 54.79 51.08 1tjp n ASP 130 Cb 0.06 -0.72 -0.14 0.00 -1.03 0.00 0.00 41.12 39.29 1tjp n ASP 130 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1tjp s VAL 131 N -3.10 2.58 0.81 2.12 1.01 -1.03 -4.89 120.40 117.90 1tjp s VAL 131 Ca 0.51 -2.04 -0.12 0.00 0.00 0.00 0.00 61.98 60.34 1tjp s VAL 131 Cb 0.43 -2.75 0.08 0.00 0.00 0.00 0.00 36.38 34.14 1tjp s VAL 131 CO 0.09 -0.46 1.11 -2.16 0.00 0.00 0.00 175.10 173.68 1tjp s PRO 132 N 1.03 1.98 0.43 2.72 0.04 -1.26 -4.82 135.00 135.12 1tjp s PRO 132 Ca 0.05 0.50 0.17 0.00 0.04 0.00 0.00 61.00 61.76 1tjp s PRO 132 Cb -0.20 -1.92 1.09 0.00 0.04 0.00 0.00 34.50 33.51 1tjp s PRO 132 CO -0.06 -1.66 1.90 -0.39 0.04 0.00 0.00 177.00 176.83 1tjp h VAL 133 N -1.11 0.75 0.00 -0.36 -1.51 -1.99 -0.70 116.25 111.32 1tjp h VAL 133 Ca -0.47 -0.13 -0.01 0.00 -1.23 0.00 0.00 66.70 64.86 1tjp h VAL 133 Cb 1.28 0.33 -0.00 0.00 -2.13 0.00 0.00 31.29 30.77 1tjp h VAL 133 CO 0.61 0.07 -0.03 -0.33 -1.23 0.00 0.00 177.57 176.66 1tjp h GLU 134 N 0.39 0.00 -0.25 5.19 3.07 -2.04 -1.77 114.58 119.17 1tjp h GLU 134 Ca 0.40 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.26 1tjp h GLU 134 Cb 0.99 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.90 1tjp h GLU 134 CO -0.13 0.03 0.00 0.39 -1.40 0.00 0.00 179.01 177.90 1tjp n GLU 135 N -3.81 2.23 0.05 2.33 -0.58 -0.32 -4.76 120.64 115.78 1tjp n GLU 135 Ca -0.03 -1.80 0.13 0.00 -0.42 0.00 0.00 57.16 55.04 1tjp n GLU 135 Cb 0.12 -1.25 0.50 0.00 -0.57 0.00 0.00 31.44 30.24 1tjp n GLU 135 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1tjp n SER 136 N 0.53 0.33 -0.13 1.62 3.41 -0.67 -4.47 113.62 114.24 1tjp n SER 136 Ca 0.10 0.54 -0.05 0.00 -0.26 0.00 0.00 58.87 59.20 1tjp n SER 136 Cb 0.38 -0.63 0.01 0.00 -0.26 0.00 0.00 64.21 63.71 1tjp n SER 136 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1tjp h ALA 137 N 2.71 0.03 0.00 7.33 0.00 -1.86 -0.20 119.26 127.28 1tjp h ALA 137 Ca 0.00 0.14 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 1tjp h ALA 137 Cb 0.53 0.58 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1tjp h ALA 137 CO 0.00 -0.61 -0.26 -1.00 0.00 0.00 0.00 179.25 177.38 1tjp h PRO 138 N -0.16 0.00 -0.03 0.00 0.13 -2.00 -1.09 132.00 128.85 1tjp h PRO 138 Ca 0.20 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.29 1tjp h PRO 138 Cb 0.48 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.62 1tjp h PRO 138 CO -0.54 0.26 -0.17 0.74 -0.23 0.00 0.00 178.00 178.07 1tjp h PHE 139 N 0.00 0.23 -0.29 1.56 -1.00 -1.52 -2.21 116.94 113.71 1tjp h PHE 139 Ca -0.00 -0.10 -0.12 0.00 2.81 0.00 0.00 57.97 60.55 1tjp h PHE 139 Cb 0.57 -0.04 -0.01 0.00 3.61 0.00 0.00 35.95 40.08 1tjp h PHE 139 CO 0.00 0.81 -0.32 0.07 -1.61 0.00 0.00 178.31 177.26 1tjp h ARG 140 N -0.42 0.62 -0.27 1.51 0.11 -0.93 -0.15 114.38 114.85 1tjp h ARG 140 Ca -0.01 -0.28 -0.01 0.00 0.10 0.00 0.00 59.98 59.77 1tjp h ARG 140 Cb 0.83 -0.01 -0.01 0.00 1.11 0.00 0.00 29.97 31.89 1tjp h ARG 140 CO 0.03 0.86 0.11 1.96 0.10 0.00 0.00 179.97 183.04 1tjp h GLN 141 N 0.53 0.41 -0.65 0.08 4.20 -1.26 -1.37 115.11 117.05 1tjp h GLN 141 Ca 0.06 -0.07 -0.06 0.00 0.06 0.00 0.00 58.65 58.64 1tjp h GLN 141 Cb 0.81 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.50 1tjp h GLN 141 CO 0.07 0.42 0.18 0.00 -0.67 0.00 0.00 178.83 178.83 1tjp h ALA 142 N 0.96 0.85 -0.12 3.87 0.00 -1.22 -1.02 119.26 122.57 1tjp h ALA 142 Ca 0.09 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.82 1tjp h ALA 142 Cb 0.17 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 1tjp h ALA 142 CO -0.01 0.55 -0.17 0.00 0.00 0.00 0.00 179.25 179.62 1tjp h ALA 143 N 1.07 -0.10 -0.35 0.00 0.00 -0.85 -2.55 119.26 116.48 1tjp h ALA 143 Ca 0.20 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 1tjp h ALA 143 Cb 0.33 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 1tjp h ALA 143 CO -0.00 -0.62 -0.08 -0.07 0.00 0.00 0.00 179.25 178.47 1tjp h LEU 144 N -0.21 0.56 -2.02 0.00 3.38 -1.05 0.70 115.31 116.67 1tjp h LEU 144 Ca 0.09 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1tjp h LEU 144 Cb 0.35 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 1tjp h LEU 144 CO -0.25 0.69 -0.07 0.03 0.09 0.00 0.00 178.44 178.94 1tjp h ARG 145 N 0.54 0.00 -0.33 1.13 3.08 -0.92 -2.63 114.38 115.26 1tjp h ARG 145 Ca 0.10 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.13 1tjp h ARG 145 Cb 0.47 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.51 1tjp h ARG 145 CO 0.03 0.07 0.01 0.72 -1.07 0.00 0.00 179.97 179.72 1tjp n HIS 146 N -4.15 1.18 -2.73 3.04 8.25 -0.50 -4.96 115.22 115.34 1tjp n HIS 146 Ca -0.03 -0.94 -0.20 0.00 -0.26 0.00 0.00 57.72 56.30 1tjp n HIS 146 Cb 0.15 -0.37 0.02 0.00 1.12 0.00 0.00 29.99 30.90 1tjp n HIS 146 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1tjp n ASN 147 N -0.41 -5.67 -4.60 0.41 3.02 -0.82 -4.60 115.26 102.59 1tjp n ASN 147 Ca 0.24 -0.17 -0.34 0.00 -0.03 0.00 0.00 54.58 54.28 1tjp n ASN 147 Cb 0.97 -4.58 -0.11 0.00 -0.61 0.00 0.00 39.78 35.46 1tjp n ASN 147 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1tjp s ILE 148 N -3.06 3.88 -0.15 2.41 -1.09 0.12 -4.68 121.20 118.63 1tjp s ILE 148 Ca 0.17 -0.41 -0.26 0.00 -2.23 0.00 0.00 60.65 57.93 1tjp s ILE 148 Cb -0.08 -2.61 -0.02 0.00 -1.58 0.00 0.00 42.46 38.18 1tjp s ILE 148 CO 0.21 0.59 0.85 0.00 -1.23 0.00 0.00 174.94 175.36 1tjp s ALA 149 N -0.67 3.49 -0.09 9.38 0.00 0.22 -3.62 121.76 130.47 1tjp s ALA 149 Ca 0.10 0.09 -0.24 0.00 0.00 0.00 0.00 51.96 51.91 1tjp s ALA 149 Cb -0.12 -3.25 -0.03 0.00 0.00 0.00 0.00 23.12 19.73 1tjp s ALA 149 CO 0.02 -0.61 0.75 -1.25 0.00 0.00 0.00 175.76 174.66 1tjp s PRO 150 N 2.06 4.41 -0.12 0.00 0.04 -1.26 -1.66 135.00 138.47 1tjp s PRO 150 Ca 0.40 0.94 -0.05 0.00 0.04 0.00 0.00 61.00 62.33 1tjp s PRO 150 Cb -0.17 -3.48 -0.04 0.00 0.04 0.00 0.00 34.50 30.85 1tjp s PRO 150 CO 0.13 -0.04 0.08 0.42 0.04 0.00 0.00 177.00 177.63 1tjp s ILE 151 N 1.15 4.96 0.03 0.56 -1.09 -0.72 -2.17 121.20 123.93 1tjp s ILE 151 Ca 0.38 0.01 0.07 0.00 -2.23 0.00 0.00 60.65 58.88 1tjp s ILE 151 Cb -0.18 -3.15 -0.02 0.00 -1.58 0.00 0.00 42.46 37.53 1tjp s ILE 151 CO 0.17 0.59 -0.21 -0.36 -1.23 0.00 0.00 174.94 173.90 1tjp s PHE 152 N -0.75 1.88 -0.10 3.97 0.08 -1.26 -4.49 117.98 117.31 1tjp s PHE 152 Ca 0.13 -0.38 -0.19 0.00 0.12 0.00 0.00 56.93 56.61 1tjp s PHE 152 Cb -0.12 -1.14 -0.04 0.00 -0.57 0.00 0.00 43.02 41.15 1tjp s PHE 152 CO 0.03 0.07 0.53 0.42 -0.10 0.00 0.00 175.22 176.17 1tjp s ILE 153 N -0.75 5.14 -0.32 0.64 1.01 -1.26 -1.99 121.20 123.67 1tjp s ILE 153 Ca 0.08 1.07 -0.09 0.00 0.00 0.00 0.00 60.65 61.72 1tjp s ILE 153 Cb -0.09 -3.87 0.01 0.00 0.01 0.00 0.00 42.46 38.52 1tjp s ILE 153 CO 0.01 0.32 0.13 0.00 0.00 0.00 0.00 174.94 175.41 1tjp s PRO 155 N 1.55 2.94 0.30 0.00 0.02 -1.26 -1.58 135.00 136.96 1tjp s PRO 155 Ca 0.03 1.45 0.05 0.00 0.02 0.00 0.00 61.00 62.55 1tjp s PRO 155 Cb -0.18 -1.96 0.78 0.00 0.02 0.00 0.00 34.50 33.16 1tjp s PRO 155 CO 0.05 -1.15 1.68 -1.35 -0.33 0.00 0.00 177.00 175.89 1tjp h PRO 156 N 0.33 0.33 -1.18 5.54 0.11 -1.91 -2.12 132.00 133.11 1tjp h PRO 156 Ca -0.48 -0.02 -0.60 0.00 0.11 0.00 0.00 66.00 65.01 1tjp h PRO 156 Cb 1.25 -0.08 -0.39 0.00 0.11 0.00 0.00 31.00 31.89 1tjp h PRO 156 CO 0.55 0.22 -0.41 0.09 -0.21 0.00 0.00 178.00 178.24 1tjp n ASN 157 N -5.09 5.42 -4.71 -2.05 3.02 -1.26 -4.82 115.26 105.78 1tjp n ASN 157 Ca 0.23 -3.75 -0.42 0.00 -0.03 0.00 0.00 54.58 50.61 1tjp n ASN 157 Cb 0.71 -0.53 -0.01 0.00 -0.61 0.00 0.00 39.78 39.34 1tjp n ASN 157 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1tjp n ALA 158 N -0.63 1.45 -1.93 5.41 0.00 -0.80 -4.98 120.51 119.03 1tjp n ALA 158 Ca 0.45 0.36 -0.28 0.00 0.00 0.00 0.00 53.44 53.97 1tjp n ALA 158 Cb 0.75 -2.28 0.13 0.00 0.00 0.00 0.00 19.45 18.06 1tjp n ALA 158 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1tjp s ASP 159 N -0.28 3.88 0.25 0.00 3.84 -1.26 -4.80 116.67 118.30 1tjp s ASP 159 Ca 0.55 0.32 -0.06 0.00 -0.00 0.00 0.00 52.55 53.36 1tjp s ASP 159 Cb -0.56 -0.61 0.28 0.00 -1.38 0.00 0.00 42.92 40.65 1tjp s ASP 159 CO 0.62 -2.24 1.91 -0.78 -0.00 0.00 0.00 175.17 174.69 1tjp h ASP 160 N -1.18 1.10 -0.46 2.11 3.58 -1.99 -0.72 116.42 118.86 1tjp h ASP 160 Ca -0.44 -0.02 -0.02 0.00 0.42 0.00 0.00 57.03 56.98 1tjp h ASP 160 Cb 1.27 -0.27 -0.02 0.00 1.72 0.00 0.00 39.33 42.04 1tjp h ASP 160 CO 0.48 0.78 0.22 0.44 -2.88 0.00 0.00 179.24 178.28 1tjp h ASP 161 N 1.29 0.61 -0.43 2.28 3.32 -1.99 -0.92 116.42 120.57 1tjp h ASP 161 Ca 0.37 -0.13 -0.04 0.00 0.02 0.00 0.00 57.03 57.25 1tjp h ASP 161 Cb -0.09 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.29 1tjp h ASP 161 CO -0.10 0.57 0.13 0.25 -1.72 0.00 0.00 179.24 178.37 1tjp h LEU 162 N 0.61 0.63 -0.72 1.55 5.85 -1.85 -1.79 115.31 119.59 1tjp h LEU 162 Ca 0.16 -0.21 0.04 0.00 0.84 0.00 0.00 57.88 58.71 1tjp h LEU 162 Cb 0.13 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 40.94 1tjp h LEU 162 CO -0.02 0.68 0.43 -0.07 -0.34 0.00 0.00 178.44 179.12 1tjp h LEU 163 N 0.55 0.69 -0.91 2.25 3.38 -0.77 0.10 115.31 120.60 1tjp h LEU 163 Ca 0.14 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 1tjp h LEU 163 Cb 0.28 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 1tjp h LEU 163 CO -0.00 0.46 0.29 0.03 0.09 0.00 0.00 178.44 179.31 1tjp h ARG 164 N 0.82 1.08 -0.01 1.13 3.08 -0.99 -0.62 114.38 118.87 1tjp h ARG 164 Ca 0.30 -0.19 -0.00 0.00 0.07 0.00 0.00 59.98 60.16 1tjp h ARG 164 Cb 0.09 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 29.97 1tjp h ARG 164 CO -0.14 0.88 -0.00 1.96 -1.07 0.00 0.00 179.97 181.59 1tjp h GLN 165 N 1.06 0.02 -0.93 0.04 4.20 -0.76 -0.59 115.11 118.15 1tjp h GLN 165 Ca 0.24 -0.01 0.06 0.00 0.06 0.00 0.00 58.65 59.01 1tjp h GLN 165 Cb 0.20 -0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.92 1tjp h GLN 165 CO -0.02 0.40 0.59 0.28 -0.67 0.00 0.00 178.83 179.41 1tjp h VAL 166 N -0.36 1.06 -0.63 -0.54 2.07 -0.76 0.14 116.25 117.23 1tjp h VAL 166 Ca 0.00 -0.37 -0.09 0.00 0.82 0.00 0.00 66.70 67.07 1tjp h VAL 166 Cb 0.40 -0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.04 1tjp h VAL 166 CO 0.00 0.19 0.05 0.00 0.02 0.00 0.00 177.57 177.84 1tjp h ALA 167 N 1.43 0.90 -0.05 1.67 0.00 -1.01 -1.72 119.26 120.48 1tjp h ALA 167 Ca 0.40 -0.29 -0.17 0.00 0.00 0.00 0.00 54.91 54.86 1tjp h ALA 167 Cb 0.18 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.74 1tjp h ALA 167 CO -0.18 0.66 -0.63 1.03 0.00 0.00 0.00 179.25 180.14 1tjp h SER 168 N 0.99 0.64 0.86 0.00 0.87 -0.44 -3.38 113.55 113.10 1tjp h SER 168 Ca 0.19 -0.70 -0.23 0.00 -1.23 0.00 0.00 61.79 59.81 1tjp h SER 168 Cb 0.49 -0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 62.23 1tjp h SER 168 CO 0.02 1.25 -1.16 1.88 -0.53 0.00 0.00 176.83 178.29 1tjp h TYR 169 N 0.09 0.05 -4.18 2.24 0.05 -0.77 -3.47 116.97 110.98 1tjp h TYR 169 Ca -0.06 -0.04 -0.49 0.00 0.05 0.00 0.00 58.73 58.19 1tjp h TYR 169 Cb 1.30 -0.00 0.06 0.00 1.01 0.00 0.00 36.73 39.10 1tjp h TYR 169 CO 0.12 1.03 0.33 0.20 -1.05 0.00 0.00 178.16 178.80 1tjp s GLY 170 N -4.79 1.62 0.14 3.88 0.00 -0.65 -4.78 107.32 102.74 1tjp s GLY 170 Ca -0.01 -0.37 -0.07 0.00 0.00 0.00 0.00 44.72 44.28 1tjp s GLY 170 CO 0.83 -0.07 0.20 0.50 0.00 0.00 0.00 173.10 174.56 1tjp s ARG 171 N -5.17 1.03 0.00 2.90 1.81 -0.92 -4.71 118.95 113.89 1tjp s ARG 171 Ca 0.55 -1.21 0.00 0.00 -1.72 0.00 0.00 55.73 53.35 1tjp s ARG 171 Cb -0.11 0.33 0.00 0.00 -0.45 0.00 0.00 34.95 34.72 1tjp s ARG 171 CO 0.50 -0.35 0.00 0.41 -0.68 0.00 0.00 175.30 175.18 1tjp n GLY 172 N -0.15 2.22 3.34 -3.53 0.00 -1.26 -4.45 105.19 101.36 1tjp n GLY 172 Ca -0.08 -0.12 -0.11 0.00 0.00 0.00 0.00 46.02 45.70 1tjp n GLY 172 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1tjp s TYR 173 N 0.00 -0.28 -0.18 1.61 -0.85 -1.26 -4.26 117.35 112.14 1tjp s TYR 173 Ca 0.00 0.04 -0.06 0.00 -0.52 0.00 0.00 57.07 56.52 1tjp s TYR 173 Cb 0.00 0.30 -0.04 0.00 0.38 0.00 0.00 41.96 42.61 1tjp s TYR 173 CO 0.00 -0.70 0.04 0.99 -1.52 0.00 0.00 175.55 174.36 1tjp s THR 174 N -3.52 4.55 -0.52 -3.49 2.01 0.23 -4.56 115.64 110.34 1tjp s THR 174 Ca 0.01 -0.12 -0.26 0.00 0.31 0.00 0.00 61.69 61.63 1tjp s THR 174 Cb 0.01 -3.04 0.03 0.00 0.01 0.00 0.00 72.50 69.51 1tjp s THR 174 CO -0.10 0.47 1.00 -0.47 -0.69 0.00 0.00 174.62 174.82 1tjp s TYR 175 N 0.38 2.81 -0.43 4.92 6.14 -0.84 -0.85 117.35 129.48 1tjp s TYR 175 Ca 0.01 0.26 -0.19 0.00 0.64 0.00 0.00 57.07 57.79 1tjp s TYR 175 Cb -0.13 -4.15 0.02 0.00 0.42 0.00 0.00 41.96 38.13 1tjp s TYR 175 CO 0.01 -1.30 0.55 -1.17 0.64 0.00 0.00 175.55 174.28 1tjp s LEU 176 N 4.10 4.67 0.18 6.97 2.96 0.29 -0.34 118.68 137.51 1tjp s LEU 176 Ca 0.36 -0.50 -0.30 0.00 -0.22 0.00 0.00 54.13 53.47 1tjp s LEU 176 Cb -0.10 -2.57 -0.08 0.00 0.50 0.00 0.00 46.19 43.94 1tjp s LEU 176 CO 0.24 -0.69 1.28 -0.76 -1.32 0.00 0.00 176.35 175.10 1tjp s LEU 177 N 2.50 4.42 0.34 -0.68 1.43 -0.61 -1.34 118.68 124.74 1tjp s LEU 177 Ca 0.18 2.32 0.18 0.00 -1.03 0.00 0.00 54.13 55.77 1tjp s LEU 177 Cb -0.15 -3.60 0.47 0.00 0.03 0.00 0.00 46.19 42.93 1tjp s LEU 177 CO 0.16 -0.49 1.63 0.28 0.23 0.00 0.00 176.35 178.16 1tjp h SER 178 N 5.56 0.00 -5.54 2.29 0.02 -1.36 -3.33 113.55 111.19 1tjp h SER 178 Ca -0.44 0.00 0.24 0.00 -0.84 0.00 0.00 61.79 60.74 1tjp h SER 178 Cb 1.21 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 63.68 1tjp h SER 178 CO 0.77 0.42 0.66 0.00 -1.14 0.00 0.00 176.83 177.55 1tjp s ARG 179 N -3.36 0.90 0.70 3.45 1.70 -1.26 -4.41 118.95 116.66 1tjp s ARG 179 Ca 0.01 -0.54 -0.12 0.00 -0.47 0.00 0.00 55.73 54.62 1tjp s ARG 179 Cb 0.10 0.28 0.16 0.00 -0.57 0.00 0.00 34.95 34.92 1tjp s ARG 179 CO 0.71 -0.42 0.90 -1.13 -1.08 0.00 0.00 175.30 174.28 1tjp n SER 180 N -0.77 -0.14 0.00 -2.89 3.41 -1.26 -4.89 113.62 107.08 1tjp n SER 180 Ca -0.05 -1.29 0.00 0.00 -0.26 0.00 0.00 58.87 57.27 1tjp n SER 180 Cb 0.61 -0.70 0.00 0.00 -0.26 0.00 0.00 64.21 63.85 1tjp n SER 180 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tjp n GLY 181 N -1.18 -1.57 3.65 5.00 0.00 -1.26 -5.01 105.19 104.83 1tjp n GLY 181 Ca 0.11 -1.73 -0.29 0.00 0.00 0.00 0.00 46.02 44.12 1tjp n GLY 181 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1tjp s VAL 182 N 0.00 1.89 0.61 1.61 -7.23 -1.26 -5.01 120.40 111.01 1tjp s VAL 182 Ca 0.00 -1.98 -0.19 0.00 -1.81 0.00 0.00 61.98 58.00 1tjp s VAL 182 Cb 0.00 -2.87 -0.03 0.00 0.56 0.00 0.00 36.38 34.05 1tjp s VAL 182 CO 0.00 0.00 1.23 0.35 -0.31 0.00 0.00 175.10 176.37 1tjp n THR 183 N -1.04 4.43 0.00 5.32 -2.24 -0.78 -4.66 114.28 115.32 1tjp n THR 183 Ca -0.07 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.21 1tjp n THR 183 Cb 0.67 -1.45 0.00 0.00 -2.10 0.00 0.00 70.33 67.45 1tjp n THR 183 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tjp n GLY 184 N 0.97 2.71 0.23 3.38 0.00 -1.26 -1.91 105.19 109.32 1tjp n GLY 184 Ca 0.14 0.09 0.11 0.00 0.00 0.00 0.00 46.02 46.36 1tjp n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tjp h ALA 185 N 0.00 1.01 -0.01 4.61 0.00 -1.89 -3.12 119.26 119.86 1tjp h ALA 185 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1tjp h ALA 185 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1tjp h ALA 185 CO 0.00 0.25 0.00 -0.85 0.00 0.00 0.00 179.25 178.65 1tjp n GLU 186 N -3.35 1.03 -3.65 0.00 -0.00 -1.26 -4.51 120.64 108.90 1tjp n GLU 186 Ca 0.00 -0.04 -0.29 0.00 -0.00 0.00 0.00 57.16 56.83 1tjp n GLU 186 Cb 0.42 -1.04 -0.15 0.00 -0.00 0.00 0.00 31.44 30.67 1tjp n GLU 186 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 1tjp s ASN 187 N -1.06 3.53 0.11 -1.84 3.84 -1.18 -5.13 114.94 113.20 1tjp s ASN 187 Ca 0.04 -1.29 -0.22 0.00 0.21 0.00 0.00 52.86 51.60 1tjp s ASN 187 Cb 0.02 -0.57 -0.07 0.00 -0.55 0.00 0.00 41.25 40.08 1tjp s ASN 187 CO 0.03 -0.40 0.65 -0.13 -2.79 0.00 0.00 177.10 174.46 1tjp s ARG 188 N 1.89 4.35 0.18 0.43 0.52 -1.26 -4.16 118.95 120.90 1tjp s ARG 188 Ca 0.07 0.91 -0.28 0.00 -0.52 0.00 0.00 55.73 55.90 1tjp s ARG 188 Cb -0.17 -3.24 -0.08 0.00 0.52 0.00 0.00 34.95 31.98 1tjp s ARG 188 CO -0.26 0.61 0.89 0.20 0.02 0.00 0.00 175.30 176.76 1tjp s GLY 189 N -1.13 3.02 0.00 -3.53 0.00 -1.26 -4.94 107.32 99.48 1tjp s GLY 189 Ca 0.32 0.52 0.00 0.00 0.00 0.00 0.00 44.72 45.56 1tjp s GLY 189 CO 0.22 1.15 0.68 0.00 0.00 0.00 0.00 173.10 175.15 1tjp n ALA 190 N 1.86 1.69 -2.52 3.20 0.00 -1.26 -5.02 120.51 118.47 1tjp n ALA 190 Ca -0.02 -0.68 -0.42 0.00 0.00 0.00 0.00 53.44 52.32 1tjp n ALA 190 Cb 0.48 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.90 1tjp n ALA 190 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1tjp s LEU 191 N -0.46 4.41 0.14 0.00 0.05 -1.26 -4.98 118.68 116.58 1tjp s LEU 191 Ca 0.00 1.77 -0.31 0.00 0.05 0.00 0.00 54.13 55.64 1tjp s LEU 191 Cb 0.00 -3.58 -0.10 0.00 -2.05 0.00 0.00 46.19 40.46 1tjp s LEU 191 CO 0.00 -0.24 1.63 -2.84 -0.55 0.00 0.00 176.35 174.35 1tjp s PRO 192 N 0.68 4.19 -0.16 1.48 0.02 -1.26 -4.88 135.00 135.07 1tjp s PRO 192 Ca 0.52 2.40 0.16 0.00 0.02 0.00 0.00 61.00 64.09 1tjp s PRO 192 Cb -0.23 -3.29 0.57 0.00 0.02 0.00 0.00 34.50 31.57 1tjp s PRO 192 CO 0.29 -0.67 1.48 1.28 -0.33 0.00 0.00 177.00 179.05 1tjp n LEU 193 N 4.51 4.19 -0.15 -5.54 4.77 -1.26 -4.64 117.00 118.88 1tjp n LEU 193 Ca 0.15 -2.85 -0.07 0.00 -0.03 0.00 0.00 56.01 53.21 1tjp n LEU 193 Cb 0.39 -0.54 0.02 0.00 -2.33 0.00 0.00 43.42 40.96 1tjp n LEU 193 CO 0.62 0.68 1.06 0.45 -1.33 0.00 0.00 177.39 178.87 1tjp h HIS 194 N 2.40 0.55 0.16 -1.77 3.86 -1.90 -1.83 115.15 116.62 1tjp h HIS 194 Ca 0.00 0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.22 1tjp h HIS 194 Cb 1.47 -0.18 0.00 0.00 1.06 0.00 0.00 27.41 29.75 1tjp h HIS 194 CO 0.60 0.33 -0.08 1.25 0.86 0.00 0.00 177.93 180.90 1tjp h HIS 195 N 0.59 -0.20 -0.20 2.45 -0.00 -1.93 -1.64 115.15 114.22 1tjp h HIS 195 Ca 0.18 -0.00 0.01 0.00 -0.00 0.00 0.00 60.37 60.55 1tjp h HIS 195 Cb -0.03 0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 27.43 1tjp h HIS 195 CO -0.05 -0.11 0.11 -0.07 -0.00 0.00 0.00 177.93 177.80 1tjp h LEU 196 N -0.23 0.17 -0.91 0.26 3.38 -1.84 -0.97 115.31 115.17 1tjp h LEU 196 Ca -0.02 0.01 0.13 0.00 0.09 0.00 0.00 57.88 58.08 1tjp h LEU 196 Cb 0.18 -0.03 -0.09 0.00 0.09 0.00 0.00 40.66 40.82 1tjp h LEU 196 CO 0.04 0.13 0.53 0.40 0.09 0.00 0.00 178.44 179.62 1tjp h ILE 197 N 0.23 0.84 -0.40 1.22 2.04 -1.22 0.17 117.51 120.38 1tjp h ILE 197 Ca 0.08 -0.28 -0.15 0.00 1.00 0.00 0.00 64.86 65.51 1tjp h ILE 197 Cb 0.01 -0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.04 1tjp h ILE 197 CO -0.05 0.15 -0.34 -0.33 0.00 0.00 0.00 178.15 177.58 1tjp h GLU 198 N 0.80 0.93 -0.50 2.37 5.08 -0.59 -2.47 114.58 120.21 1tjp h GLU 198 Ca 0.47 -0.47 -0.10 0.00 -1.00 0.00 0.00 59.36 58.26 1tjp h GLU 198 Cb 0.55 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 1tjp h GLU 198 CO -0.30 1.13 -0.08 0.87 -1.00 0.00 0.00 179.01 179.63 1tjp h LYS 199 N 0.75 0.91 -0.77 2.33 1.79 -0.39 -0.82 116.57 120.37 1tjp h LYS 199 Ca 0.07 -0.30 -0.01 0.00 -2.18 0.00 0.00 60.65 58.23 1tjp h LYS 199 Cb 0.94 -0.07 -0.04 0.00 -1.58 0.00 0.00 32.23 31.47 1tjp h LYS 199 CO 0.09 0.95 0.44 -0.07 -1.08 0.00 0.00 179.45 179.78 1tjp h LEU 200 N 0.82 0.94 -0.63 2.94 3.38 -0.62 -1.63 115.31 120.51 1tjp h LEU 200 Ca 0.14 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 1tjp h LEU 200 Cb 0.60 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 1tjp h LEU 200 CO 0.04 0.75 0.10 0.11 0.09 0.00 0.00 178.44 179.53 1tjp h LYS 201 N 1.05 1.05 -0.71 1.13 1.57 -1.16 -0.11 116.57 119.39 1tjp h LYS 201 Ca 0.27 -0.28 0.07 0.00 -1.87 0.00 0.00 60.65 58.85 1tjp h LYS 201 Cb 0.00 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.15 1tjp h LYS 201 CO -0.05 0.97 0.47 1.49 -0.57 0.00 0.00 179.45 181.76 1tjp h GLU 202 N 0.96 0.66 -0.63 3.15 4.81 -0.54 -1.27 114.58 121.72 1tjp h GLU 202 Ca 0.19 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 1tjp h GLU 202 Cb 0.43 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.66 1tjp h GLU 202 CO 0.01 0.44 0.00 0.66 -0.73 0.00 0.00 179.01 179.39 1tjp n TYR 203 N -4.48 1.22 -3.83 0.92 4.01 -0.67 -4.93 117.16 109.39 1tjp n TYR 203 Ca 0.11 -0.47 -0.27 0.00 -0.16 0.00 0.00 57.90 57.10 1tjp n TYR 203 Cb 0.27 -0.23 0.03 0.00 -0.31 0.00 0.00 39.34 39.10 1tjp n TYR 203 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1tjp n HIS 204 N 0.78 -2.27 -1.44 -0.72 8.25 -0.48 -4.77 115.22 114.58 1tjp n HIS 204 Ca 0.20 0.90 -0.31 0.00 -0.26 0.00 0.00 57.72 58.26 1tjp n HIS 204 Cb 0.75 -4.19 0.08 0.00 1.12 0.00 0.00 29.99 27.75 1tjp n HIS 204 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1tjp s ALA 205 N -3.39 2.40 0.61 -1.41 0.00 -0.09 -4.94 121.76 114.95 1tjp s ALA 205 Ca 0.50 0.10 -0.19 0.00 0.00 0.00 0.00 51.96 52.37 1tjp s ALA 205 Cb -0.24 -3.20 -0.03 0.00 0.00 0.00 0.00 23.12 19.65 1tjp s ALA 205 CO 0.82 -1.55 1.27 0.00 0.00 0.00 0.00 175.76 176.30 1tjp s ALA 206 N -3.00 2.50 0.24 0.00 0.00 -1.26 -4.85 121.76 115.39 1tjp s ALA 206 Ca 0.60 1.16 -0.30 0.00 0.00 0.00 0.00 51.96 53.41 1tjp s ALA 206 Cb -0.15 -3.52 -0.15 0.00 0.00 0.00 0.00 23.12 19.30 1tjp s ALA 206 CO 0.55 -1.40 1.14 -2.30 0.00 0.00 0.00 175.76 173.75 1tjp n PRO 207 N -1.65 1.41 -2.87 0.00 -0.02 -1.26 -3.41 135.00 127.19 1tjp n PRO 207 Ca 0.14 0.50 -0.41 0.00 -2.02 0.00 0.00 63.50 61.72 1tjp n PRO 207 Cb 0.48 -1.97 -0.04 0.00 -0.02 0.00 0.00 33.50 31.95 1tjp n PRO 207 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1tjp s ALA 208 N -0.56 3.30 -0.18 3.55 0.00 -1.26 -0.60 121.76 126.01 1tjp s ALA 208 Ca 0.66 0.39 -0.00 0.00 0.00 0.00 0.00 51.96 53.01 1tjp s ALA 208 Cb -0.75 -3.13 0.00 0.00 0.00 0.00 0.00 23.12 19.25 1tjp s ALA 208 CO 0.55 -0.02 -0.15 -0.51 0.00 0.00 0.00 175.76 175.63 1tjp s LEU 209 N 0.21 2.43 0.06 0.00 1.43 -0.03 0.03 118.68 122.81 1tjp s LEU 209 Ca 0.43 -0.52 -0.27 0.00 -1.03 0.00 0.00 54.13 52.73 1tjp s LEU 209 Cb -0.21 -1.57 -0.05 0.00 0.03 0.00 0.00 46.19 44.39 1tjp s LEU 209 CO 0.25 0.03 0.86 -1.58 0.23 0.00 0.00 176.35 176.15 1tjp s GLN 210 N 1.12 4.58 0.05 1.70 0.74 -0.62 -0.54 119.66 126.67 1tjp s GLN 210 Ca 0.00 1.24 -0.04 0.00 0.05 0.00 0.00 55.36 56.62 1tjp s GLN 210 Cb -0.14 -3.38 -0.02 0.00 1.10 0.00 0.00 33.01 30.56 1tjp s GLN 210 CO -0.05 0.20 0.05 0.20 -0.55 0.00 0.00 175.29 175.14 1tjp s GLY 211 N 0.14 0.27 0.00 2.59 0.00 -0.45 -0.26 107.32 109.61 1tjp s GLY 211 Ca 0.43 -0.78 0.00 0.00 0.00 0.00 0.00 44.72 44.37 1tjp s GLY 211 CO 0.26 -0.91 0.00 0.69 0.00 0.00 0.00 173.10 173.14 1tjp n PHE 212 N 0.54 0.00 -0.96 1.90 3.01 -1.26 -1.12 117.46 119.56 1tjp n PHE 212 Ca -0.17 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.29 1tjp n PHE 212 Cb 0.59 -0.10 0.00 0.00 -0.01 0.00 0.00 39.48 39.97 1tjp n PHE 212 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1tjp n GLY 213 N 2.86 0.67 3.61 1.37 0.00 -1.23 -4.48 105.19 107.98 1tjp n GLY 213 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1tjp n GLY 213 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1tjp s ILE 214 N -2.81 4.37 0.00 -0.61 -1.09 -1.26 -4.57 121.20 115.23 1tjp s ILE 214 Ca 0.00 1.28 0.00 0.00 -2.23 0.00 0.00 60.65 59.70 1tjp s ILE 214 Cb 0.00 -4.50 0.00 0.00 -1.58 0.00 0.00 42.46 36.38 1tjp s ILE 214 CO 0.00 -0.80 0.44 -1.54 -1.23 0.00 0.00 174.94 171.81 1tjp n SER 215 N 7.38 0.32 -3.89 3.58 3.41 -1.26 -4.54 113.62 118.61 1tjp n SER 215 Ca 0.11 -1.13 -0.10 0.00 -0.26 0.00 0.00 58.87 57.49 1tjp n SER 215 Cb 0.48 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.34 1tjp n SER 215 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1tjp s SER 216 N -0.13 0.10 0.31 4.04 1.04 -1.26 -5.02 113.70 112.78 1tjp s SER 216 Ca 0.00 -0.41 0.03 0.00 0.48 0.00 0.00 55.95 56.05 1tjp s SER 216 Cb 0.00 0.24 0.61 0.00 0.10 0.00 0.00 66.02 66.97 1tjp s SER 216 CO 0.00 -0.49 1.87 -0.65 0.98 0.00 0.00 173.24 174.96 1tjp h PRO 217 N 3.76 0.91 0.00 4.02 0.11 -1.92 -1.64 132.00 137.24 1tjp h PRO 217 Ca -0.32 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.70 1tjp h PRO 217 Cb 1.19 -0.20 -0.00 0.00 0.11 0.00 0.00 31.00 32.09 1tjp h PRO 217 CO 0.47 0.60 -0.16 1.05 -0.21 0.00 0.00 178.00 179.75 1tjp h GLU 218 N 0.94 0.00 -0.03 1.05 4.11 -1.96 -0.98 114.58 117.71 1tjp h GLU 218 Ca 0.45 0.00 -0.16 0.00 0.07 0.00 0.00 59.36 59.72 1tjp h GLU 218 Cb 0.44 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 1tjp h GLU 218 CO -0.21 0.16 -0.70 1.96 0.07 0.00 0.00 179.01 180.30 1tjp h GLN 219 N 0.00 0.16 -0.05 1.06 4.20 -1.72 -1.10 115.11 117.66 1tjp h GLN 219 Ca -0.00 -0.14 -0.01 0.00 0.06 0.00 0.00 58.65 58.56 1tjp h GLN 219 Cb 0.43 0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.24 1tjp h GLN 219 CO 0.02 0.80 0.00 0.28 -0.67 0.00 0.00 178.83 179.26 1tjp h VAL 220 N 0.11 1.25 -0.78 -0.54 2.07 -1.13 -1.45 116.25 115.79 1tjp h VAL 220 Ca -0.02 -0.76 -0.03 0.00 0.82 0.00 0.00 66.70 66.71 1tjp h VAL 220 Cb 1.24 1.65 -0.04 0.00 -1.52 0.00 0.00 31.29 32.63 1tjp h VAL 220 CO 0.10 0.21 0.36 0.28 0.02 0.00 0.00 177.57 178.54 1tjp h SER 221 N -0.19 1.03 -0.63 0.57 0.02 -1.34 -2.47 113.55 110.54 1tjp h SER 221 Ca 0.02 -0.13 -0.04 0.00 -0.84 0.00 0.00 61.79 60.79 1tjp h SER 221 Cb 0.33 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.57 1tjp h SER 221 CO 0.00 0.88 0.23 0.00 -1.14 0.00 0.00 176.83 176.81 1tjp h ALA 222 N 1.27 1.17 -0.34 3.77 0.00 -1.14 -1.06 119.26 122.92 1tjp h ALA 222 Ca 0.27 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 1tjp h ALA 222 Cb 0.14 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1tjp h ALA 222 CO -0.03 0.59 0.06 0.00 0.00 0.00 0.00 179.25 179.86 1tjp h ALA 223 N 1.30 0.46 -0.51 0.00 0.00 -0.83 -1.14 119.26 118.54 1tjp h ALA 223 Ca 0.22 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1tjp h ALA 223 Cb 0.23 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1tjp h ALA 223 CO -0.01 0.16 -0.07 0.28 0.00 0.00 0.00 179.25 179.61 1tjp h VAL 224 N 0.41 1.26 -0.12 0.00 2.07 -1.34 -1.79 116.25 116.73 1tjp h VAL 224 Ca 0.10 -1.17 -0.07 0.00 0.82 0.00 0.00 66.70 66.38 1tjp h VAL 224 Cb 0.35 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1tjp h VAL 224 CO 0.01 0.41 -0.24 -0.09 0.02 0.00 0.00 177.57 177.68 1tjp h ARG 225 N 0.83 0.21 0.00 1.57 2.43 -0.94 -1.55 114.38 116.94 1tjp h ARG 225 Ca 0.14 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1tjp h ARG 225 Cb 0.59 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.12 1tjp h ARG 225 CO 0.04 0.45 0.00 0.00 -1.51 0.00 0.00 179.97 178.94 1tjp n ALA 226 N -2.48 2.18 0.00 2.80 0.00 -0.45 -4.88 120.51 117.67 1tjp n ALA 226 Ca -0.01 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1tjp n ALA 226 Cb 0.34 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.42 1tjp n ALA 226 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tjp n GLY 227 N 0.72 0.73 3.83 0.00 0.00 -0.58 -4.66 105.19 105.23 1tjp n GLY 227 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 1tjp n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tjp s ALA 228 N -2.00 2.92 -1.24 4.61 0.00 -0.70 -4.89 121.76 120.46 1tjp s ALA 228 Ca 0.00 0.22 0.29 0.00 0.00 0.00 0.00 51.96 52.47 1tjp s ALA 228 Cb 0.00 -3.16 1.35 0.00 0.00 0.00 0.00 23.12 21.31 1tjp s ALA 228 CO 0.00 -0.57 1.96 0.00 0.00 0.00 0.00 175.76 177.15 1tjp n ALA 229 N -1.99 2.37 0.00 0.00 0.00 0.10 -4.24 120.51 116.75 1tjp n ALA 229 Ca 0.07 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1tjp n ALA 229 Cb 0.54 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.52 1tjp n ALA 229 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tjp n GLY 230 N 1.28 -1.51 3.13 0.00 0.00 -1.15 -0.63 105.19 106.31 1tjp n GLY 230 Ca 0.11 -1.10 -0.12 0.00 0.00 0.00 0.00 46.02 44.90 1tjp n GLY 230 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tjp s ALA 231 N -1.18 -0.48 -0.07 4.61 0.00 -0.16 -1.60 121.76 122.88 1tjp s ALA 231 Ca 0.00 0.18 0.01 0.00 0.00 0.00 0.00 51.96 52.15 1tjp s ALA 231 Cb 0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 23.12 23.05 1tjp s ALA 231 CO 0.00 -0.19 -0.08 0.42 0.00 0.00 0.00 175.76 175.91 1tjp s ILE 232 N -0.92 3.56 -0.08 0.00 1.01 0.64 -1.01 121.20 124.40 1tjp s ILE 232 Ca -0.10 -0.52 -0.00 0.00 0.00 0.00 0.00 60.65 60.02 1tjp s ILE 232 Cb -0.05 -2.46 0.02 0.00 0.01 0.00 0.00 42.46 39.98 1tjp s ILE 232 CO 0.02 0.59 -0.04 -0.55 0.00 0.00 0.00 174.94 174.95 1tjp s SER 233 N -0.64 1.69 0.01 3.58 0.15 -0.55 -4.41 113.70 113.54 1tjp s SER 233 Ca 0.10 -0.18 -0.01 0.00 0.70 0.00 0.00 55.95 56.56 1tjp s SER 233 Cb -0.11 -0.60 -0.00 0.00 -1.71 0.00 0.00 66.02 63.59 1tjp s SER 233 CO 0.02 -0.13 -0.02 0.61 1.20 0.00 0.00 173.24 174.91 1tjp n GLY 234 N 4.81 -0.05 0.36 9.45 0.00 -1.26 -0.96 105.19 117.54 1tjp n GLY 234 Ca -0.13 -0.02 0.12 0.00 0.00 0.00 0.00 46.02 45.99 1tjp n GLY 234 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1tjp h SER 235 N -0.06 0.79 -0.42 1.61 0.02 -1.90 0.23 113.55 113.82 1tjp h SER 235 Ca 0.00 0.08 -0.05 0.00 -0.84 0.00 0.00 61.79 60.97 1tjp h SER 235 Cb 0.06 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.50 1tjp h SER 235 CO 0.00 0.33 0.08 0.00 -1.14 0.00 0.00 176.83 176.10 1tjp h ALA 236 N 1.61 1.24 -0.14 3.77 0.00 -1.88 0.41 119.26 124.27 1tjp h ALA 236 Ca 0.54 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 55.18 1tjp h ALA 236 Cb 0.80 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 1tjp h ALA 236 CO -0.32 0.52 -0.15 0.82 0.00 0.00 0.00 179.25 180.12 1tjp h ILE 237 N 0.72 1.35 -0.14 0.00 1.08 -1.36 -3.21 117.51 115.95 1tjp h ILE 237 Ca 0.16 -1.31 -0.07 0.00 -0.39 0.00 0.00 64.86 63.24 1tjp h ILE 237 Cb 0.32 1.89 -0.01 0.00 -3.07 0.00 0.00 36.82 35.95 1tjp h ILE 237 CO 0.00 0.39 -0.22 0.58 -0.69 0.00 0.00 178.15 178.21 1tjp h VAL 238 N -0.02 1.22 -0.31 1.67 2.07 -0.65 -1.99 116.25 118.25 1tjp h VAL 238 Ca 0.02 -1.03 -0.02 0.00 0.82 0.00 0.00 66.70 66.49 1tjp h VAL 238 Cb 0.68 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.80 1tjp h VAL 238 CO 0.04 0.31 0.09 0.11 0.02 0.00 0.00 177.57 178.14 1tjp h LYS 239 N 0.22 0.44 -0.51 1.57 1.57 -0.93 -0.32 116.57 118.61 1tjp h LYS 239 Ca 0.04 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.68 1tjp h LYS 239 Cb 0.52 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.73 1tjp h LYS 239 CO 0.04 0.40 -0.00 0.82 -0.57 0.00 0.00 179.45 180.14 1tjp h ILE 240 N 0.44 1.25 0.06 1.86 2.04 -1.36 0.67 117.51 122.46 1tjp h ILE 240 Ca 0.11 -1.05 -0.00 0.00 1.00 0.00 0.00 64.86 64.91 1tjp h ILE 240 Cb 0.15 0.86 0.00 0.00 -0.74 0.00 0.00 36.82 37.09 1tjp h ILE 240 CO -0.01 0.37 -0.03 0.40 0.00 0.00 0.00 178.15 178.89 1tjp h ILE 241 N 0.80 1.14 -0.90 -0.67 2.04 -1.23 -2.71 117.51 115.99 1tjp h ILE 241 Ca 0.15 -0.66 0.05 0.00 1.00 0.00 0.00 64.86 65.41 1tjp h ILE 241 Cb 0.48 1.57 -0.06 0.00 -0.74 0.00 0.00 36.82 38.07 1tjp h ILE 241 CO 0.02 0.16 0.57 -0.08 0.00 0.00 0.00 178.15 178.83 1tjp h GLU 242 N -0.37 1.04 0.00 2.37 4.81 -0.84 -2.05 114.58 119.55 1tjp h GLU 242 Ca -0.01 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.12 1tjp h GLU 242 Cb 0.33 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 1tjp h GLU 242 CO 0.01 0.68 -0.19 0.87 -0.73 0.00 0.00 179.01 179.65 1tjp h LYS 243 N 1.07 0.00 -0.17 1.92 1.57 -0.84 -3.25 116.57 116.86 1tjp h LYS 243 Ca 0.38 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 59.09 1tjp h LYS 243 Cb 0.11 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.38 1tjp h LYS 243 CO -0.15 0.19 -0.18 0.09 -0.57 0.00 0.00 179.45 178.83 1tjp n ASN 244 N -3.30 2.42 -0.28 0.86 3.02 -0.80 -4.76 115.26 112.42 1tjp n ASN 244 Ca 0.01 -3.58 0.10 0.00 -0.03 0.00 0.00 54.58 51.07 1tjp n ASN 244 Cb 0.45 -0.55 0.34 0.00 -0.61 0.00 0.00 39.78 39.40 1tjp n ASN 244 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1tjp h LEU 245 N 0.93 0.73 -0.02 3.41 3.38 -1.51 -0.17 115.31 122.07 1tjp h LEU 245 Ca 0.08 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1tjp h LEU 245 Cb 1.31 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1tjp h LEU 245 CO 0.18 0.40 -0.01 0.00 0.09 0.00 0.00 178.44 179.10 1tjp n ALA 246 N -2.42 2.53 -3.48 1.53 0.00 -1.26 -4.28 120.51 113.13 1tjp n ALA 246 Ca 0.16 -0.16 -0.27 0.00 0.00 0.00 0.00 53.44 53.17 1tjp n ALA 246 Cb 0.39 -1.48 -0.10 0.00 0.00 0.00 0.00 19.45 18.25 1tjp n ALA 246 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1tjp s SER 247 N -2.50 2.00 0.29 0.00 0.01 -0.08 -5.00 113.70 108.43 1tjp s SER 247 Ca 0.31 -3.17 0.03 0.00 1.31 0.00 0.00 55.95 54.43 1tjp s SER 247 Cb 0.20 -0.63 0.66 0.00 0.21 0.00 0.00 66.02 66.47 1tjp s SER 247 CO 0.45 -0.16 1.76 -0.65 0.41 0.00 0.00 173.24 175.05 1tjp h PRO 248 N 5.64 0.65 -0.26 12.44 0.11 -1.74 0.53 132.00 149.35 1tjp h PRO 248 Ca 0.24 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.25 1tjp h PRO 248 Cb 0.89 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.84 1tjp h PRO 248 CO 0.42 0.43 -0.10 0.87 -0.21 0.00 0.00 178.00 179.41 1tjp h LYS 249 N 0.67 0.53 -0.45 1.05 6.56 -1.94 -2.30 116.57 120.69 1tjp h LYS 249 Ca 0.54 -0.22 -0.06 0.00 -1.06 0.00 0.00 60.65 59.84 1tjp h LYS 249 Cb 0.83 -0.02 -0.02 0.00 -0.57 0.00 0.00 32.23 32.45 1tjp h LYS 249 CO -0.39 0.77 0.03 0.37 -2.06 0.00 0.00 179.45 178.17 1tjp h GLN 250 N 0.27 0.72 -0.30 3.15 4.15 -1.73 -1.36 115.11 120.01 1tjp h GLN 250 Ca 0.06 -0.17 0.03 0.00 0.77 0.00 0.00 58.65 59.34 1tjp h GLN 250 Cb 0.60 -0.10 -0.03 0.00 0.21 0.00 0.00 27.48 28.16 1tjp h GLN 250 CO 0.03 0.71 0.10 1.98 -1.93 0.00 0.00 178.83 179.73 1tjp h MET 251 N 0.68 0.23 -0.54 1.69 4.05 -0.76 0.01 114.93 120.29 1tjp h MET 251 Ca 0.14 -0.01 -0.09 0.00 -0.28 0.00 0.00 59.70 59.46 1tjp h MET 251 Cb 0.38 -0.05 -0.02 0.00 -0.80 0.00 0.00 31.60 31.10 1tjp h MET 251 CO 0.01 0.15 -0.01 -0.07 0.23 0.00 0.00 176.91 177.23 1tjp h LEU 252 N 0.24 0.91 -0.62 3.39 3.38 -1.00 -0.73 115.31 120.89 1tjp h LEU 252 Ca 0.14 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 1tjp h LEU 252 Cb 0.10 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 1tjp h LEU 252 CO -0.14 0.97 0.27 0.00 0.09 0.00 0.00 178.44 179.63 1tjp h ALA 253 N 1.12 0.80 -0.17 1.53 0.00 -0.83 -0.83 119.26 120.87 1tjp h ALA 253 Ca 0.16 -0.16 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 1tjp h ALA 253 Cb 0.52 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1tjp h ALA 253 CO 0.03 0.39 -0.48 0.93 0.00 0.00 0.00 179.25 180.12 1tjp h GLU 254 N 0.85 0.45 -0.44 0.00 5.08 -0.77 -1.77 114.58 117.99 1tjp h GLU 254 Ca 0.21 -0.25 -0.04 0.00 -1.00 0.00 0.00 59.36 58.27 1tjp h GLU 254 Cb 0.17 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 1tjp h GLU 254 CO -0.02 0.83 0.11 -0.07 -1.00 0.00 0.00 179.01 178.86 1tjp h LEU 255 N 0.36 0.66 -0.13 1.33 3.38 -0.89 -1.67 115.31 118.35 1tjp h LEU 255 Ca 0.02 -0.23 0.02 0.00 0.09 0.00 0.00 57.88 57.78 1tjp h LEU 255 Cb 0.98 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.54 1tjp h LEU 255 CO 0.09 0.72 0.02 -0.09 0.09 0.00 0.00 178.44 179.26 1tjp h ARG 256 N 0.57 0.07 -0.60 1.13 2.43 -0.91 -0.15 114.38 116.93 1tjp h ARG 256 Ca 0.14 -0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.34 1tjp h ARG 256 Cb 0.31 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.81 1tjp h ARG 256 CO 0.00 0.04 0.35 0.77 -1.51 0.00 0.00 179.97 179.63 1tjp h SER 257 N 0.07 0.56 0.04 -3.80 0.02 -1.18 0.38 113.55 109.63 1tjp h SER 257 Ca 0.06 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.02 1tjp h SER 257 Cb 0.06 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.49 1tjp h SER 257 CO -0.08 0.38 -0.02 0.15 -1.14 0.00 0.00 176.83 176.12 1tjp h PHE 258 N 0.68 -0.05 -0.46 3.45 3.57 -1.03 -2.01 116.94 121.09 1tjp h PHE 258 Ca 0.25 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.74 1tjp h PHE 258 Cb 0.07 0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.80 1tjp h PHE 258 CO -0.07 0.24 0.25 0.28 -2.23 0.00 0.00 178.31 176.79 1tjp h VAL 259 N -0.34 1.17 -0.76 1.41 2.07 -0.94 -0.22 116.25 118.63 1tjp h VAL 259 Ca -0.01 -0.43 0.07 0.00 0.82 0.00 0.00 66.70 67.16 1tjp h VAL 259 Cb 0.31 0.61 -0.06 0.00 -1.52 0.00 0.00 31.29 30.63 1tjp h VAL 259 CO 0.01 0.18 0.44 -1.28 0.02 0.00 0.00 177.57 176.94 1tjp h SER 260 N 0.61 0.66 -0.39 0.57 0.87 -0.89 0.19 113.55 115.17 1tjp h SER 260 Ca 0.16 0.03 -0.10 0.00 -1.23 0.00 0.00 61.79 60.65 1tjp h SER 260 Cb 0.06 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 61.91 1tjp h SER 260 CO -0.03 0.41 -0.16 0.00 -0.53 0.00 0.00 176.83 176.52 1tjp h ALA 261 N 1.40 0.54 -0.39 6.23 0.00 -0.71 -0.85 119.26 125.47 1tjp h ALA 261 Ca 0.35 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1tjp h ALA 261 Cb 0.24 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1tjp h ALA 261 CO -0.20 0.47 0.06 0.52 0.00 0.00 0.00 179.25 180.09 1tjp h MET 262 N 0.59 0.65 -0.59 0.00 2.86 -0.57 -2.58 114.93 115.30 1tjp h MET 262 Ca 0.09 -0.18 -0.05 0.00 -2.06 0.00 0.00 59.70 57.50 1tjp h MET 262 Cb 0.71 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 32.27 1tjp h MET 262 CO 0.05 0.71 0.16 -0.22 1.06 0.00 0.00 176.91 178.67 1tjp h LYS 263 N 0.50 0.90 -0.82 1.72 1.63 -0.57 -2.87 116.57 117.06 1tjp h LYS 263 Ca 0.12 -0.18 0.01 0.00 -0.85 0.00 0.00 60.65 59.75 1tjp h LYS 263 Cb 0.38 -0.14 -0.04 0.00 -0.60 0.00 0.00 32.23 31.83 1tjp h LYS 263 CO 0.01 0.79 0.54 0.00 -3.45 0.00 0.00 179.45 177.35 1tjp h ALA 264 N 1.30 1.43 0.00 5.00 0.00 -0.86 -1.18 119.26 124.95 1tjp h ALA 264 Ca 0.19 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1tjp h ALA 264 Cb 0.29 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1tjp h ALA 264 CO -0.00 0.52 0.00 0.00 0.00 0.00 0.00 179.25 179.77 1tjp h ALA 265 N 1.49 1.00 -0.00 0.00 0.00 -1.23 -2.27 119.26 118.25 1tjp h ALA 265 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1tjp h ALA 265 Cb -0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1tjp h ALA 265 CO -0.07 0.00 -0.21 -1.13 0.00 0.00 0.00 179.25 177.84 1tjp n SER 266 N -2.42 0.46 -0.58 0.00 3.41 -0.45 -3.74 113.62 110.30 1tjp n SER 266 Ca -0.00 -0.32 0.14 0.00 -0.26 0.00 0.00 58.87 58.42 1tjp n SER 266 Cb 0.12 -0.04 0.44 0.00 -0.26 0.00 0.00 64.21 64.47 1tjp n SER 266 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42