#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jxp s THR 4 N 0.00 2.28 -0.21 9.51 2.01 -1.26 -4.86 115.64 123.11 1jxp s THR 4 Ca 0.00 -1.33 -0.27 0.00 0.31 0.00 0.00 61.69 60.40 1jxp s THR 4 Cb 0.00 -2.61 0.10 0.00 0.01 0.00 0.00 72.50 69.99 1jxp s THR 4 CO 0.00 0.00 0.85 0.00 -0.69 0.00 0.00 174.62 174.78 1jxp s ALA 5 N -2.59 -1.86 0.02 7.40 0.00 -1.26 -5.05 121.76 118.41 1jxp s ALA 5 Ca 0.46 1.75 0.02 0.00 0.00 0.00 0.00 51.96 54.19 1jxp s ALA 5 Cb -0.03 -0.92 -0.01 0.00 0.00 0.00 0.00 23.12 22.15 1jxp s ALA 5 CO 0.28 -0.31 -0.06 1.52 0.00 0.00 0.00 175.76 177.18 1jxp s TYR 6 N -0.27 0.56 0.86 0.00 1.13 -1.26 -4.68 117.35 113.69 1jxp s TYR 6 Ca -0.02 -0.26 -0.12 0.00 -1.41 0.00 0.00 57.07 55.26 1jxp s TYR 6 Cb -0.03 -0.35 0.11 0.00 -1.10 0.00 0.00 41.96 40.59 1jxp s TYR 6 CO 0.01 -0.04 1.11 -1.54 -2.51 0.00 0.00 175.55 172.58 1jxp s SER 7 N -0.75 3.93 -0.30 -0.18 1.04 -1.26 -4.88 113.70 111.30 1jxp s SER 7 Ca -0.03 1.22 -0.13 0.00 0.48 0.00 0.00 55.95 57.50 1jxp s SER 7 Cb -0.05 -1.90 0.14 0.00 0.10 0.00 0.00 66.02 64.31 1jxp s SER 7 CO 0.00 -2.32 0.80 -1.58 0.98 0.00 0.00 173.24 171.13 1jxp s GLN 8 N -5.15 0.46 0.12 4.02 0.74 -1.26 -5.09 119.66 113.50 1jxp s GLN 8 Ca 0.62 1.12 -0.13 0.00 0.05 0.00 0.00 55.36 57.03 1jxp s GLN 8 Cb -0.15 0.64 -0.06 0.00 1.10 0.00 0.00 33.01 34.53 1jxp s GLN 8 CO 0.55 -0.15 0.49 -0.65 -0.55 0.00 0.00 175.29 174.97 1jxp s GLN 9 N 2.61 3.89 0.00 1.67 -0.21 -1.26 -4.96 119.66 121.41 1jxp s GLN 9 Ca -0.05 0.36 0.00 0.00 0.02 0.00 0.00 55.36 55.70 1jxp s GLN 9 Cb -0.09 -2.96 0.00 0.00 1.00 0.00 0.00 33.01 30.96 1jxp s GLN 9 CO -0.18 0.52 0.21 0.25 -2.12 0.00 0.00 175.29 173.97 1jxp n THR 10 N 0.87 0.00 -3.51 -0.19 -2.24 -1.26 -5.06 114.28 102.90 1jxp n THR 10 Ca -0.07 -0.45 -0.15 0.00 -2.27 0.00 0.00 64.05 61.11 1jxp n THR 10 Cb 0.52 1.04 -0.05 0.00 -2.10 0.00 0.00 70.33 69.74 1jxp n THR 10 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1jxp s ARG 11 N -0.48 1.03 0.33 -0.78 3.52 -1.26 -5.11 118.95 116.20 1jxp s ARG 11 Ca 0.00 0.06 0.05 0.00 -0.13 0.00 0.00 55.73 55.70 1jxp s ARG 11 Cb 0.00 0.48 0.05 0.00 -1.56 0.00 0.00 34.95 33.92 1jxp s ARG 11 CO 0.00 -0.36 0.38 0.41 -0.81 0.00 0.00 175.30 174.92 1jxp n GLY 12 N 0.55 2.30 0.20 8.12 0.00 -1.26 -4.90 105.19 110.19 1jxp n GLY 12 Ca -0.17 -2.21 -0.02 0.00 0.00 0.00 0.00 46.02 43.62 1jxp n GLY 12 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1jxp h LEU 13 N 0.00 -0.08 -1.41 0.99 5.85 -2.02 0.13 115.31 118.77 1jxp h LEU 13 Ca -0.17 0.10 0.15 0.00 0.84 0.00 0.00 57.88 58.80 1jxp h LEU 13 Cb 0.73 0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.85 1jxp h LEU 13 CO 0.26 -0.01 0.55 0.25 -0.34 0.00 0.00 178.44 179.14 1jxp h LEU 14 N 0.19 0.54 0.16 2.25 6.46 -1.98 0.22 115.31 123.15 1jxp h LEU 14 Ca 0.25 0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 58.03 1jxp h LEU 14 Cb 0.35 -0.07 0.00 0.00 -0.73 0.00 0.00 40.66 40.21 1jxp h LEU 14 CO -0.36 0.27 -0.08 1.23 -0.62 0.00 0.00 178.44 178.88 1jxp h GLY 15 N 0.57 -0.23 0.57 3.75 0.00 -1.16 -2.03 103.07 104.55 1jxp h GLY 15 Ca 0.42 0.08 0.03 0.00 0.00 0.00 0.00 47.33 47.87 1jxp h GLY 15 CO -0.17 -0.08 -0.12 0.00 0.00 0.00 0.00 176.54 176.17 1jxp h ILE 17 N -0.15 0.25 -0.22 0.00 2.04 -0.67 0.16 117.51 118.92 1jxp h ILE 17 Ca 0.08 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.83 1jxp h ILE 17 Cb 0.26 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 36.58 1jxp h ILE 17 CO -0.19 0.00 -0.31 0.40 0.00 0.00 0.00 178.15 178.05 1jxp h ILE 18 N -0.47 1.28 0.00 -0.67 5.03 -1.30 -2.42 117.51 118.97 1jxp h ILE 18 Ca 0.07 -1.36 0.00 0.00 -0.12 0.00 0.00 64.86 63.45 1jxp h ILE 18 Cb 0.58 1.45 0.00 0.00 -3.03 0.00 0.00 36.82 35.82 1jxp h ILE 18 CO -0.32 0.43 0.00 0.74 -0.68 0.00 0.00 178.15 178.32 1jxp h THR 19 N 0.39 0.00 0.00 -0.27 2.02 -0.61 -2.05 112.91 112.39 1jxp h THR 19 Ca 0.05 -0.53 -0.17 0.00 0.77 0.00 0.00 66.41 66.53 1jxp h THR 19 Cb 0.74 1.51 -0.03 0.00 -1.74 0.00 0.00 68.15 68.63 1jxp h THR 19 CO 0.06 0.00 -1.40 0.77 0.37 0.00 0.00 175.52 175.32 1jxp h SER 20 N 0.00 0.00 0.02 4.18 4.64 -0.48 -2.66 113.55 119.26 1jxp h SER 20 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1jxp h SER 20 Cb 0.74 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.83 1jxp h SER 20 CO 0.00 0.58 -0.01 -0.07 -0.87 0.00 0.00 176.83 176.46 1jxp h LEU 21 N 0.00 -0.02 -0.01 5.97 3.38 -1.33 -3.29 115.31 120.00 1jxp h LEU 21 Ca -0.16 -0.73 0.00 0.00 0.09 0.00 0.00 57.88 57.08 1jxp h LEU 21 Cb 1.58 0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.34 1jxp h LEU 21 CO 0.05 0.79 -0.03 0.35 0.09 0.00 0.00 178.44 179.69 1jxp n THR 22 N -4.70 0.00 -0.20 0.22 -2.24 -0.78 -4.91 114.28 101.67 1jxp n THR 22 Ca -0.08 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 1jxp n THR 22 Cb 0.36 -0.44 0.00 0.00 -2.10 0.00 0.00 70.33 68.15 1jxp n THR 22 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jxp n GLY 23 N 1.42 0.00 3.67 3.38 0.00 -1.00 -4.67 105.19 108.00 1jxp n GLY 23 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 1jxp n GLY 23 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1jxp s ARG 24 N -0.41 4.12 -0.36 1.61 3.52 -1.25 -1.92 118.95 124.26 1jxp s ARG 24 Ca 0.00 -0.12 0.03 0.00 -0.13 0.00 0.00 55.73 55.52 1jxp s ARG 24 Cb 0.00 -3.53 0.10 0.00 -1.56 0.00 0.00 34.95 29.97 1jxp s ARG 24 CO 0.00 0.06 0.08 0.34 -0.81 0.00 0.00 175.30 174.97 1jxp s ASP 25 N 0.98 4.61 0.00 -2.12 -1.08 0.77 -4.79 116.67 115.04 1jxp s ASP 25 Ca 0.11 -2.20 0.27 0.00 -0.52 0.00 0.00 52.55 50.20 1jxp s ASP 25 Cb -0.14 -1.53 1.56 0.00 -1.46 0.00 0.00 42.92 41.35 1jxp s ASP 25 CO 0.05 -0.37 1.94 0.29 0.52 0.00 0.00 175.17 177.60 1jxp n LYS 26 N 4.18 0.77 -2.34 4.34 5.02 -1.26 -2.82 118.16 126.04 1jxp n LYS 26 Ca 0.04 0.01 -0.42 0.00 -2.02 0.00 0.00 58.31 55.91 1jxp n LYS 26 Cb 0.41 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.89 1jxp n LYS 26 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1jxp s ASN 27 N -2.08 7.01 0.21 4.39 0.02 -1.26 -4.98 114.94 118.25 1jxp s ASN 27 Ca 0.38 2.14 -0.32 0.00 -1.02 0.00 0.00 52.86 54.04 1jxp s ASN 27 Cb 0.18 -2.59 -0.12 0.00 0.02 0.00 0.00 41.25 38.74 1jxp s ASN 27 CO 0.32 -0.50 1.68 0.00 0.02 0.00 0.00 177.10 178.61 1jxp n GLN 28 N 3.70 2.65 -3.31 -0.60 0.00 -1.26 -4.95 117.38 113.61 1jxp n GLN 28 Ca 0.09 0.96 -0.39 0.00 0.00 0.00 0.00 57.00 57.66 1jxp n GLN 28 Cb 0.45 -2.78 -0.07 0.00 0.00 0.00 0.00 30.24 27.84 1jxp n GLN 28 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1jxp s VAL 29 N 0.94 5.14 0.01 -0.39 1.01 -1.26 -5.05 120.40 120.81 1jxp s VAL 29 Ca 0.74 0.84 -0.08 0.00 0.00 0.00 0.00 61.98 63.48 1jxp s VAL 29 Cb -0.53 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.05 1jxp s VAL 29 CO 0.36 0.20 0.14 -1.61 0.00 0.00 0.00 175.10 174.19 1jxp s GLU 30 N 1.53 0.54 0.00 2.72 2.02 -1.26 -4.47 118.70 119.78 1jxp s GLU 30 Ca 0.22 -0.49 0.00 0.00 0.02 0.00 0.00 54.97 54.72 1jxp s GLU 30 Cb -0.15 0.22 0.00 0.00 0.10 0.00 0.00 34.13 34.30 1jxp s GLU 30 CO 0.09 -0.13 0.00 0.41 0.02 0.00 0.00 175.26 175.64 1jxp n GLY 31 N 1.21 0.25 1.57 -1.39 0.00 -1.26 -4.86 105.19 100.71 1jxp n GLY 31 Ca -0.22 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.29 1jxp n GLY 31 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1jxp n GLU 32 N 0.00 0.00 -3.29 1.61 4.71 -1.26 -4.52 120.64 117.89 1jxp n GLU 32 Ca 0.00 0.00 -0.38 0.00 -0.01 0.00 0.00 57.16 56.77 1jxp n GLU 32 Cb 0.00 0.00 -0.06 0.00 -1.01 0.00 0.00 31.44 30.37 1jxp n GLU 32 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 1jxp s VAL 33 N -1.96 5.13 0.06 2.62 1.01 -1.26 -1.90 120.40 124.09 1jxp s VAL 33 Ca 0.00 1.03 0.08 0.00 0.00 0.00 0.00 61.98 63.09 1jxp s VAL 33 Cb 0.00 -3.85 -0.03 0.00 0.00 0.00 0.00 36.38 32.50 1jxp s VAL 33 CO 0.00 0.35 -0.21 -1.10 0.00 0.00 0.00 175.10 174.14 1jxp s GLN 34 N 0.43 1.93 -0.24 2.72 -1.52 0.11 -4.95 119.66 118.14 1jxp s GLN 34 Ca 0.28 -1.06 -0.11 0.00 -1.95 0.00 0.00 55.36 52.51 1jxp s GLN 34 Cb -0.16 -2.11 -0.05 0.00 -0.22 0.00 0.00 33.01 30.47 1jxp s GLN 34 CO 0.12 0.52 0.21 0.08 -0.25 0.00 0.00 175.29 175.97 1jxp s VAL 35 N -0.93 5.32 0.25 1.09 1.01 -1.26 -0.50 120.40 125.38 1jxp s VAL 35 Ca 0.14 0.27 0.07 0.00 0.00 0.00 0.00 61.98 62.46 1jxp s VAL 35 Cb -0.10 -3.54 -0.05 0.00 0.00 0.00 0.00 36.38 32.68 1jxp s VAL 35 CO 0.05 0.31 -0.10 0.68 0.00 0.00 0.00 175.10 176.04 1jxp s VAL 36 N 1.24 1.70 -0.01 2.92 -7.23 0.33 -4.97 120.40 114.38 1jxp s VAL 36 Ca 0.09 -2.17 -0.16 0.00 -1.81 0.00 0.00 61.98 57.93 1jxp s VAL 36 Cb -0.14 -2.27 0.03 0.00 0.56 0.00 0.00 36.38 34.56 1jxp s VAL 36 CO 0.06 -0.43 0.34 -0.55 -0.31 0.00 0.00 175.10 174.21 1jxp s SER 37 N -3.39 -0.23 0.00 4.85 0.15 -1.26 -1.41 113.70 112.41 1jxp s SER 37 Ca 0.26 0.13 0.00 0.00 0.70 0.00 0.00 55.95 57.05 1jxp s SER 37 Cb 0.02 0.33 0.00 0.00 -1.71 0.00 0.00 66.02 64.66 1jxp s SER 37 CO 0.10 -0.47 0.00 0.35 1.20 0.00 0.00 173.24 174.42 1jxp n THR 38 N 1.21 0.00 1.59 6.45 -2.24 -0.81 -5.03 114.28 115.45 1jxp n THR 38 Ca -0.21 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.71 1jxp n THR 38 Cb 0.56 -0.15 0.66 0.00 -2.10 0.00 0.00 70.33 69.30 1jxp n THR 38 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1jxp n ALA 39 N -3.00 2.69 -0.58 6.98 0.00 -1.26 -4.15 120.51 121.19 1jxp n ALA 39 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.12 1jxp n ALA 39 Cb 0.00 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.14 1jxp n ALA 39 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1jxp n THR 40 N -0.54 0.04 -3.68 0.00 -2.24 -1.26 -5.11 114.28 101.48 1jxp n THR 40 Ca 0.19 -0.23 -0.00 0.00 -2.27 0.00 0.00 64.05 61.74 1jxp n THR 40 Cb 0.26 1.51 -0.01 0.00 -2.10 0.00 0.00 70.33 70.00 1jxp n THR 40 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1jxp s GLN 41 N -0.04 0.68 0.04 -0.78 -2.07 -1.26 -5.18 119.66 111.06 1jxp s GLN 41 Ca 0.00 -0.38 -0.00 0.00 -1.82 0.00 0.00 55.36 53.16 1jxp s GLN 41 Cb 0.00 0.23 -0.03 0.00 -1.09 0.00 0.00 33.01 32.12 1jxp s GLN 41 CO 0.00 -0.31 -0.03 0.45 -1.32 0.00 0.00 175.29 174.07 1jxp s SER 42 N -3.01 0.44 0.00 12.60 0.15 -1.26 -1.93 113.70 120.69 1jxp s SER 42 Ca 0.14 -0.78 0.00 0.00 0.70 0.00 0.00 55.95 56.02 1jxp s SER 42 Cb 0.02 0.15 0.00 0.00 -1.71 0.00 0.00 66.02 64.48 1jxp s SER 42 CO -0.01 -0.45 0.00 2.22 1.20 0.00 0.00 173.24 176.19 1jxp n PHE 43 N 0.77 -0.44 -4.20 3.44 -1.74 -0.50 -4.45 117.46 110.34 1jxp n PHE 43 Ca -0.18 0.00 -0.26 0.00 -0.56 0.00 0.00 57.45 56.45 1jxp n PHE 43 Cb 0.58 0.00 -0.07 0.00 1.52 0.00 0.00 39.48 41.52 1jxp n PHE 43 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 1jxp s LEU 44 N 0.00 2.94 -0.11 5.98 1.43 -0.78 -0.51 118.68 127.63 1jxp s LEU 44 Ca 0.00 -1.19 -0.07 0.00 -1.03 0.00 0.00 54.13 51.84 1jxp s LEU 44 Cb 0.00 -1.28 0.04 0.00 0.03 0.00 0.00 46.19 44.98 1jxp s LEU 44 CO 0.00 -0.66 0.26 0.00 0.23 0.00 0.00 176.35 176.18 1jxp s ALA 45 N -2.67 -0.63 -0.13 4.21 0.00 0.35 -4.25 121.76 118.64 1jxp s ALA 45 Ca 0.35 0.96 -0.02 0.00 0.00 0.00 0.00 51.96 53.25 1jxp s ALA 45 Cb 0.03 -0.59 -0.02 0.00 0.00 0.00 0.00 23.12 22.54 1jxp s ALA 45 CO 0.20 -0.18 -0.08 0.99 0.00 0.00 0.00 175.76 176.69 1jxp s THR 46 N 0.91 3.54 -0.53 0.00 2.01 -0.60 0.09 115.64 121.05 1jxp s THR 46 Ca -0.06 -0.49 -0.21 0.00 0.31 0.00 0.00 61.69 61.23 1jxp s THR 46 Cb -0.07 -2.51 0.05 0.00 0.01 0.00 0.00 72.50 69.98 1jxp s THR 46 CO -0.06 0.52 0.76 0.00 -0.69 0.00 0.00 174.62 175.15 1jxp s VAL 48 N 3.19 1.71 -1.45 0.00 1.01 0.86 -0.50 120.40 125.22 1jxp s VAL 48 Ca 0.21 -0.84 -0.10 0.00 0.00 0.00 0.00 61.98 61.25 1jxp s VAL 48 Cb -0.17 -1.48 0.04 0.00 0.00 0.00 0.00 36.38 34.77 1jxp s VAL 48 CO 0.15 0.48 1.00 0.59 0.00 0.00 0.00 175.10 177.32 1jxp n ASN 49 N 3.40 -5.71 0.00 3.32 3.02 -1.18 -1.35 115.26 116.76 1jxp n ASN 49 Ca -0.19 -0.58 0.00 0.00 -0.03 0.00 0.00 54.58 53.78 1jxp n ASN 49 Cb 0.52 -4.53 0.00 0.00 -0.61 0.00 0.00 39.78 35.16 1jxp n ASN 49 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1jxp n GLY 50 N -1.80 0.50 3.14 7.41 0.00 -1.26 -5.02 105.19 108.16 1jxp n GLY 50 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 1jxp n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jxp s VAL 51 N -2.18 1.37 -0.50 1.61 1.01 -0.45 -1.28 120.40 119.98 1jxp s VAL 51 Ca 0.00 -0.71 -0.25 0.00 0.00 0.00 0.00 61.98 61.01 1jxp s VAL 51 Cb 0.00 -1.16 0.03 0.00 0.00 0.00 0.00 36.38 35.25 1jxp s VAL 51 CO 0.00 0.39 0.96 0.00 0.00 0.00 0.00 175.10 176.46 1jxp s TRP 53 N 3.96 3.62 0.27 0.00 0.52 0.20 -2.30 118.94 125.21 1jxp s TRP 53 Ca 0.36 0.76 -0.21 0.00 0.02 0.00 0.00 56.10 57.02 1jxp s TRP 53 Cb -0.10 -2.13 0.02 0.00 -1.15 0.00 0.00 33.47 30.11 1jxp s TRP 53 CO 0.24 0.60 0.74 -0.08 0.02 0.00 0.00 176.95 178.47 1jxp s THR 54 N -1.25 0.00 0.26 2.01 -1.32 0.02 -1.56 115.64 113.80 1jxp s THR 54 Ca 0.27 -0.97 -0.30 0.00 -1.21 0.00 0.00 61.69 59.48 1jxp s THR 54 Cb -0.14 -2.02 -0.09 0.00 -1.51 0.00 0.00 72.50 68.73 1jxp s THR 54 CO 0.15 0.00 1.09 0.68 -2.21 0.00 0.00 174.62 174.33 1jxp s VAL 55 N -3.83 3.56 0.20 5.08 -7.23 -1.26 -0.77 120.40 116.15 1jxp s VAL 55 Ca 0.11 1.54 0.21 0.00 -1.81 0.00 0.00 61.98 62.03 1jxp s VAL 55 Cb -0.06 -3.98 0.18 0.00 0.56 0.00 0.00 36.38 33.08 1jxp s VAL 55 CO 0.07 0.36 1.80 0.22 -0.31 0.00 0.00 175.10 177.24 1jxp h TYR 56 N 4.00 0.00 -0.13 2.82 3.20 -1.49 -0.24 116.97 125.13 1jxp h TYR 56 Ca -0.46 0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.33 1jxp h TYR 56 Cb 1.21 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.47 1jxp h TYR 56 CO 0.59 0.31 -0.27 1.12 -1.64 0.00 0.00 178.16 178.27 1jxp h HIS 57 N 0.00 0.27 0.05 -3.82 2.07 -1.91 0.25 115.15 112.05 1jxp h HIS 57 Ca -0.00 -0.05 -0.25 0.00 -2.85 0.00 0.00 60.37 57.21 1jxp h HIS 57 Cb 0.77 -0.07 -0.02 0.00 2.57 0.00 0.00 27.41 30.66 1jxp h HIS 57 CO 0.00 0.50 -1.36 0.78 -3.07 0.00 0.00 177.93 174.79 1jxp h GLY 58 N 1.00 0.12 0.29 6.13 0.00 -1.88 -3.41 103.07 105.31 1jxp h GLY 58 Ca 0.03 -0.29 -0.00 0.00 0.00 0.00 0.00 47.33 47.06 1jxp h GLY 58 CO 0.04 0.26 -0.02 0.00 0.00 0.00 0.00 176.54 176.82 1jxp h ALA 59 N -0.26 0.00 -0.43 3.60 0.00 -1.05 -3.48 119.26 117.65 1jxp h ALA 59 Ca -0.33 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.21 1jxp h ALA 59 Cb 1.52 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.31 1jxp h ALA 59 CO -0.09 -0.12 0.00 0.41 0.00 0.00 0.00 179.25 179.45 1jxp n GLY 60 N 0.87 0.06 0.40 0.00 0.00 0.88 -3.06 105.19 104.34 1jxp n GLY 60 Ca -0.09 -0.94 0.06 0.00 0.00 0.00 0.00 46.02 45.04 1jxp n GLY 60 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1jxp n SER 61 N -0.84 1.16 -4.64 1.61 3.41 -1.26 -4.91 113.62 108.15 1jxp n SER 61 Ca 0.00 -1.86 -0.33 0.00 -0.26 0.00 0.00 58.87 56.42 1jxp n SER 61 Cb 0.00 -0.12 0.13 0.00 -0.26 0.00 0.00 64.21 63.96 1jxp n SER 61 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1jxp n LYS 62 N 0.08 -0.03 -2.67 4.33 5.02 -1.17 -4.78 118.16 118.94 1jxp n LYS 62 Ca 0.10 0.07 -0.26 0.00 -2.02 0.00 0.00 58.31 56.19 1jxp n LYS 62 Cb 0.21 -2.32 0.01 0.00 -0.02 0.00 0.00 35.03 32.91 1jxp n LYS 62 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1jxp s THR 63 N -2.27 4.56 -0.17 -0.18 -4.23 -1.26 -4.56 115.64 107.52 1jxp s THR 63 Ca 0.69 0.04 -0.03 0.00 -1.18 0.00 0.00 61.69 61.21 1jxp s THR 63 Cb -0.27 -3.74 -0.02 0.00 1.34 0.00 0.00 72.50 69.81 1jxp s THR 63 CO 0.55 -0.69 -0.06 -0.22 -0.54 0.00 0.00 174.62 173.65 1jxp s LEU 64 N -4.75 2.99 0.28 4.79 2.96 -0.90 -4.88 118.68 119.17 1jxp s LEU 64 Ca 0.48 -0.26 -0.30 0.00 -0.22 0.00 0.00 54.13 53.83 1jxp s LEU 64 Cb -0.10 -1.72 -0.12 0.00 0.50 0.00 0.00 46.19 44.75 1jxp s LEU 64 CO 0.44 0.11 1.55 0.00 -1.32 0.00 0.00 176.35 177.12 1jxp n ALA 65 N 3.91 2.21 -2.48 5.97 0.00 -1.26 -0.55 120.51 128.32 1jxp n ALA 65 Ca -0.18 0.38 -0.24 0.00 0.00 0.00 0.00 53.44 53.40 1jxp n ALA 65 Cb 0.52 -2.42 -0.09 0.00 0.00 0.00 0.00 19.45 17.46 1jxp n ALA 65 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1jxp s GLY 66 N 0.42 2.41 0.59 0.00 0.00 -0.10 -4.53 107.32 106.11 1jxp s GLY 66 Ca 0.64 -1.48 0.32 0.00 0.00 0.00 0.00 44.72 44.20 1jxp s GLY 66 CO 0.49 -1.79 2.23 -0.56 0.00 0.00 0.00 173.10 173.47 1jxp h PRO 67 N 1.92 0.00 0.00 2.90 0.13 -1.87 0.23 132.00 135.31 1jxp h PRO 67 Ca -0.36 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 1jxp h PRO 67 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1jxp h PRO 67 CO 0.59 0.03 0.00 1.63 -0.23 0.00 0.00 178.00 180.02 1jxp n LYS 68 N -3.66 2.81 0.00 0.86 5.02 -1.26 -4.71 118.16 117.21 1jxp n LYS 68 Ca -0.03 -1.44 0.00 0.00 -2.02 0.00 0.00 58.31 54.82 1jxp n LYS 68 Cb 0.12 -0.98 0.00 0.00 -0.02 0.00 0.00 35.03 34.15 1jxp n LYS 68 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1jxp n GLY 69 N -0.47 0.90 3.74 0.72 0.00 -0.98 -5.02 105.19 104.08 1jxp n GLY 69 Ca 0.00 -2.02 -0.41 0.00 0.00 0.00 0.00 46.02 43.59 1jxp n GLY 69 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1jxp s PRO 70 N -1.28 4.60 -0.04 1.61 0.04 -1.07 -0.92 135.00 137.93 1jxp s PRO 70 Ca 0.00 1.71 -0.14 0.00 0.04 0.00 0.00 61.00 62.60 1jxp s PRO 70 Cb 0.00 -3.28 -0.05 0.00 0.04 0.00 0.00 34.50 31.21 1jxp s PRO 70 CO 0.00 0.08 0.38 0.42 0.04 0.00 0.00 177.00 177.92 1jxp s ILE 71 N -0.22 5.12 0.19 0.56 1.01 0.28 -4.88 121.20 123.27 1jxp s ILE 71 Ca 0.49 0.77 -0.18 0.00 0.00 0.00 0.00 60.65 61.73 1jxp s ILE 71 Cb -0.29 -3.69 -0.08 0.00 0.01 0.00 0.00 42.46 38.41 1jxp s ILE 71 CO 0.35 0.53 0.67 -0.89 0.00 0.00 0.00 174.94 175.59 1jxp s THR 72 N -0.66 4.66 0.33 2.92 2.01 -1.26 -2.12 115.64 121.51 1jxp s THR 72 Ca 0.22 1.15 -0.29 0.00 0.31 0.00 0.00 61.69 63.08 1jxp s THR 72 Cb -0.16 -3.82 -0.11 0.00 0.01 0.00 0.00 72.50 68.42 1jxp s THR 72 CO 0.11 0.23 1.56 0.00 -0.69 0.00 0.00 174.62 175.83 1jxp n GLN 73 N 0.78 2.70 -0.00 4.92 6.02 -1.26 -4.60 117.38 125.94 1jxp n GLN 73 Ca -0.03 0.96 0.09 0.00 -0.01 0.00 0.00 57.00 58.00 1jxp n GLN 73 Cb 0.51 -2.72 -0.12 0.00 1.02 0.00 0.00 30.24 28.93 1jxp n GLN 73 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1jxp n MET 74 N 1.52 0.71 -3.98 -1.09 0.00 -0.25 -4.94 117.12 109.10 1jxp n MET 74 Ca 0.06 -0.07 -0.13 0.00 0.00 0.00 0.00 57.70 57.56 1jxp n MET 74 Cb 0.38 -1.42 -0.14 0.00 0.00 0.00 0.00 33.22 32.04 1jxp n MET 74 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 175.97 176.68 1jxp s TYR 75 N -3.00 0.18 -0.24 3.17 2.02 -0.97 -5.02 117.35 113.50 1jxp s TYR 75 Ca 0.02 -0.05 -0.14 0.00 -0.37 0.00 0.00 57.07 56.52 1jxp s TYR 75 Cb 0.13 -0.12 0.07 0.00 -0.40 0.00 0.00 41.96 41.65 1jxp s TYR 75 CO 0.79 -0.01 0.59 0.99 -1.57 0.00 0.00 175.55 176.33 1jxp s THR 76 N -0.11 -0.01 -0.36 -0.71 2.01 -1.26 -1.88 115.64 113.32 1jxp s THR 76 Ca 0.00 0.03 0.01 0.00 0.31 0.00 0.00 61.69 62.04 1jxp s THR 76 Cb -0.01 -0.86 0.14 0.00 0.01 0.00 0.00 72.50 71.78 1jxp s THR 76 CO -0.00 0.01 0.24 0.21 -0.69 0.00 0.00 174.62 174.39 1jxp s ASN 77 N 1.53 2.63 0.51 3.53 3.04 -0.50 -5.00 114.94 120.68 1jxp s ASN 77 Ca -0.10 -2.13 0.23 0.00 0.04 0.00 0.00 52.86 50.90 1jxp s ASN 77 Cb -0.06 -0.25 1.32 0.00 -1.54 0.00 0.00 41.25 40.72 1jxp s ASN 77 CO -0.17 -0.30 1.98 0.58 -3.04 0.00 0.00 177.10 176.15 1jxp h VAL 78 N 5.00 0.75 0.24 -5.21 2.07 -1.97 -2.54 116.25 114.60 1jxp h VAL 78 Ca 0.07 -0.03 -0.32 0.00 0.82 0.00 0.00 66.70 67.23 1jxp h VAL 78 Cb 0.98 0.65 0.03 0.00 -1.52 0.00 0.00 31.29 31.44 1jxp h VAL 78 CO 0.25 0.02 -1.44 -0.78 0.02 0.00 0.00 177.57 175.64 1jxp h ASP 79 N 0.09 0.78 -0.30 0.57 3.58 -1.94 -3.23 116.42 115.98 1jxp h ASP 79 Ca 0.27 -0.93 -0.02 0.00 0.42 0.00 0.00 57.03 56.77 1jxp h ASP 79 Cb 0.96 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.74 1jxp h ASP 79 CO -0.03 1.69 0.03 0.00 -2.88 0.00 0.00 179.24 178.05 1jxp n GLN 80 N -3.76 2.79 -3.97 0.28 10.64 -1.12 -4.94 117.38 117.30 1jxp n GLN 80 Ca -0.18 -1.53 -0.27 0.00 -1.83 0.00 0.00 57.00 53.19 1jxp n GLN 80 Cb 1.07 -1.85 -0.08 0.00 -0.86 0.00 0.00 30.24 28.52 1jxp n GLN 80 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 1jxp n ASP 81 N 0.25 0.25 -3.88 2.61 2.03 -0.97 -4.96 116.55 111.88 1jxp n ASP 81 Ca 0.15 -1.03 -0.12 0.00 0.52 0.00 0.00 54.79 54.31 1jxp n ASP 81 Cb 0.75 -1.29 -0.14 0.00 -0.72 0.00 0.00 41.12 39.72 1jxp n ASP 81 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1jxp s LEU 82 N -6.43 2.02 0.05 -2.67 2.96 -1.11 -1.35 118.68 112.16 1jxp s LEU 82 Ca 0.16 -0.05 -0.03 0.00 -0.22 0.00 0.00 54.13 53.99 1jxp s LEU 82 Cb -0.09 0.00 -0.03 0.00 0.50 0.00 0.00 46.19 46.57 1jxp s LEU 82 CO 0.81 -0.03 0.02 0.68 -1.32 0.00 0.00 176.35 176.52 1jxp s VAL 83 N -0.14 0.19 -0.02 1.68 -7.23 0.05 -1.41 120.40 113.53 1jxp s VAL 83 Ca -0.01 -1.60 -0.15 0.00 -1.81 0.00 0.00 61.98 58.41 1jxp s VAL 83 Cb -0.01 -1.38 0.02 0.00 0.56 0.00 0.00 36.38 35.57 1jxp s VAL 83 CO -0.00 -0.88 0.31 -0.83 -0.31 0.00 0.00 175.10 173.38 1jxp s GLY 84 N -2.78 -0.15 0.02 2.32 0.00 -0.79 -0.80 107.32 105.13 1jxp s GLY 84 Ca 0.05 0.33 0.08 0.00 0.00 0.00 0.00 44.72 45.18 1jxp s GLY 84 CO -0.09 0.12 -0.23 -0.98 0.00 0.00 0.00 173.10 171.92 1jxp s TRP 85 N -1.30 2.42 0.23 1.90 0.51 -0.97 -1.09 118.94 120.64 1jxp s TRP 85 Ca -0.13 -0.35 -0.31 0.00 -2.12 0.00 0.00 56.10 53.18 1jxp s TRP 85 Cb -0.05 -1.46 -0.13 0.00 -0.81 0.00 0.00 33.47 31.01 1jxp s TRP 85 CO 0.04 0.12 1.41 0.94 -0.51 0.00 0.00 176.95 178.95 1jxp n GLN 86 N 1.94 2.02 -2.05 4.98 -0.06 -1.26 -1.02 117.38 121.92 1jxp n GLN 86 Ca -0.17 0.72 -0.42 0.00 -2.00 0.00 0.00 57.00 55.13 1jxp n GLN 86 Cb 0.52 -2.38 -0.03 0.00 -4.06 0.00 0.00 30.24 24.29 1jxp n GLN 86 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1jxp s ALA 87 N -0.03 3.67 0.32 1.69 0.00 -0.41 -4.67 121.76 122.34 1jxp s ALA 87 Ca 0.69 1.25 -0.29 0.00 0.00 0.00 0.00 51.96 53.61 1jxp s ALA 87 Cb -0.66 -3.57 -0.12 0.00 0.00 0.00 0.00 23.12 18.77 1jxp s ALA 87 CO 0.49 -0.69 1.49 -0.35 0.00 0.00 0.00 175.76 176.70 1jxp n PRO 88 N 3.69 2.53 -1.64 0.00 -0.04 -1.26 -4.82 135.00 133.45 1jxp n PRO 88 Ca 0.12 0.89 -0.55 0.00 -0.04 0.00 0.00 63.50 63.92 1jxp n PRO 88 Cb 0.40 -2.62 -0.07 0.00 -0.04 0.00 0.00 33.50 31.18 1jxp n PRO 88 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 1jxp n PRO 89 N 1.34 1.30 -0.29 0.54 -0.02 -1.26 -2.73 135.00 133.88 1jxp n PRO 89 Ca 0.06 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 1jxp n PRO 89 Cb 0.37 -2.26 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 1jxp n PRO 89 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jxp n GLY 90 N 4.80 0.52 2.86 -1.23 0.00 -1.26 -5.02 105.19 105.86 1jxp n GLY 90 Ca 0.30 -0.11 -0.18 0.00 0.00 0.00 0.00 46.02 46.03 1jxp n GLY 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jxp s ALA 91 N -1.34 0.47 0.51 4.61 0.00 -1.11 -4.15 121.76 120.75 1jxp s ALA 91 Ca 0.00 0.06 -0.21 0.00 0.00 0.00 0.00 51.96 51.81 1jxp s ALA 91 Cb 0.00 -0.34 -0.06 0.00 0.00 0.00 0.00 23.12 22.71 1jxp s ALA 91 CO 0.00 -0.03 1.16 0.50 0.00 0.00 0.00 175.76 177.38 1jxp s ARG 92 N 0.90 3.49 -0.02 0.00 3.52 -1.26 -4.98 118.95 120.61 1jxp s ARG 92 Ca -0.10 1.71 -0.00 0.00 -0.13 0.00 0.00 55.73 57.20 1jxp s ARG 92 Cb -0.13 -2.17 0.02 0.00 -1.56 0.00 0.00 34.95 31.10 1jxp s ARG 92 CO -0.01 -0.76 0.03 -1.54 -0.81 0.00 0.00 175.30 172.21 1jxp s SER 93 N -1.57 0.04 0.58 -2.12 1.04 -1.26 -4.66 113.70 105.76 1jxp s SER 93 Ca 0.69 0.04 -0.19 0.00 0.48 0.00 0.00 55.95 56.97 1jxp s SER 93 Cb -0.27 -0.03 -0.04 0.00 0.10 0.00 0.00 66.02 65.78 1jxp s SER 93 CO 0.31 -0.09 1.22 -0.76 0.98 0.00 0.00 173.24 174.90 1jxp s LEU 94 N 0.72 3.70 -0.16 2.42 1.43 0.35 -4.75 118.68 122.37 1jxp s LEU 94 Ca -0.06 2.41 -0.08 0.00 -1.03 0.00 0.00 54.13 55.37 1jxp s LEU 94 Cb -0.09 -4.56 -0.04 0.00 0.03 0.00 0.00 46.19 41.53 1jxp s LEU 94 CO -0.02 -1.56 0.10 0.28 0.23 0.00 0.00 176.35 175.38 1jxp s THR 95 N -1.57 5.12 1.05 5.49 -1.32 -1.26 -3.13 115.64 120.02 1jxp s THR 95 Ca 0.76 0.08 -0.18 0.00 -1.21 0.00 0.00 61.69 61.14 1jxp s THR 95 Cb -0.31 -3.28 0.04 0.00 -1.51 0.00 0.00 72.50 67.43 1jxp s THR 95 CO 0.34 0.51 -0.09 -2.65 -2.21 0.00 0.00 174.62 170.52 1jxp n PRO 96 N 3.00 -0.94 0.00 7.08 -0.02 -1.26 -1.12 135.00 141.73 1jxp n PRO 96 Ca -0.17 -0.25 0.00 0.00 -2.02 0.00 0.00 63.50 61.05 1jxp n PRO 96 Cb 0.53 -1.63 0.00 0.00 -0.02 0.00 0.00 33.50 32.38 1jxp n PRO 96 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1jxp n THR 98 N -0.44 -4.88 -1.80 0.00 -1.04 -1.26 -4.90 114.28 99.96 1jxp n THR 98 Ca 0.00 0.13 0.00 0.00 -2.04 0.00 0.00 64.05 62.14 1jxp n THR 98 Cb 0.00 -3.97 0.00 0.00 -1.82 0.00 0.00 70.33 64.54 1jxp n THR 98 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1jxp n GLY 100 N 0.00 1.11 3.60 0.00 0.00 -1.26 -4.96 105.19 103.68 1jxp n GLY 100 Ca 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 46.02 45.45 1jxp n GLY 100 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1jxp n SER 101 N 0.00 1.17 0.02 1.61 3.41 -1.26 -4.87 113.62 113.70 1jxp n SER 101 Ca 0.00 1.13 0.11 0.00 -0.26 0.00 0.00 58.87 59.86 1jxp n SER 101 Cb 0.00 -1.06 0.09 0.00 -0.26 0.00 0.00 64.21 62.98 1jxp n SER 101 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1jxp n SER 102 N 2.79 0.64 -4.52 4.04 7.64 -1.26 -4.79 113.62 118.16 1jxp n SER 102 Ca 0.22 -0.33 -0.42 0.00 1.01 0.00 0.00 58.87 59.35 1jxp n SER 102 Cb 0.12 0.59 -0.03 0.00 -1.01 0.00 0.00 64.21 63.88 1jxp n SER 102 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1jxp s ASP 103 N -3.47 6.23 0.11 6.43 1.01 -1.26 0.50 116.67 126.22 1jxp s ASP 103 Ca 0.07 -0.83 0.08 0.00 0.71 0.00 0.00 52.55 52.58 1jxp s ASP 103 Cb 0.16 -2.51 -0.04 0.00 1.01 0.00 0.00 42.92 41.54 1jxp s ASP 103 CO 0.77 -1.64 -0.14 -0.76 0.21 0.00 0.00 175.17 173.61 1jxp s LEU 104 N 4.98 2.87 -0.07 1.23 1.43 0.29 -3.36 118.68 126.05 1jxp s LEU 104 Ca 0.33 -0.48 0.02 0.00 -1.03 0.00 0.00 54.13 52.97 1jxp s LEU 104 Cb -0.09 -1.69 0.01 0.00 0.03 0.00 0.00 46.19 44.45 1jxp s LEU 104 CO 0.09 0.18 -0.11 -0.31 0.23 0.00 0.00 176.35 176.42 1jxp s TYR 105 N -1.19 1.43 -0.09 0.29 2.02 -0.87 0.15 117.35 119.09 1jxp s TYR 105 Ca 0.20 -0.55 -0.01 0.00 -0.37 0.00 0.00 57.07 56.34 1jxp s TYR 105 Cb -0.11 -1.07 -0.03 0.00 -0.40 0.00 0.00 41.96 40.35 1jxp s TYR 105 CO 0.12 -0.30 -0.05 -0.48 -1.57 0.00 0.00 175.55 173.27 1jxp s LEU 106 N 0.78 3.25 -0.29 -1.29 0.05 -0.33 -0.14 118.68 120.70 1jxp s LEU 106 Ca -0.12 -0.02 -0.19 0.00 0.05 0.00 0.00 54.13 53.84 1jxp s LEU 106 Cb -0.15 -1.73 -0.02 0.00 -2.05 0.00 0.00 46.19 42.24 1jxp s LEU 106 CO 0.02 0.32 0.58 -0.69 -0.55 0.00 0.00 176.35 176.03 1jxp s VAL 107 N -0.53 5.00 0.77 1.48 1.01 -1.01 -2.03 120.40 125.09 1jxp s VAL 107 Ca 0.08 0.82 -0.12 0.00 0.00 0.00 0.00 61.98 62.76 1jxp s VAL 107 Cb -0.12 -3.93 0.18 0.00 0.00 0.00 0.00 36.38 32.50 1jxp s VAL 107 CO 0.02 -0.06 1.05 0.35 0.00 0.00 0.00 175.10 176.46 1jxp n THR 108 N 5.31 0.00 0.40 3.92 -2.24 -1.05 -4.51 114.28 116.11 1jxp n THR 108 Ca -0.03 -0.88 0.07 0.00 -2.27 0.00 0.00 64.05 60.94 1jxp n THR 108 Cb 0.49 -1.50 0.29 0.00 -2.10 0.00 0.00 70.33 67.51 1jxp n THR 108 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 1jxp n ARG 109 N -3.20 0.03 -0.16 -0.78 1.85 -1.26 -2.14 116.66 111.00 1jxp n ARG 109 Ca 0.14 0.32 0.05 0.00 -1.00 0.00 0.00 57.85 57.36 1jxp n ARG 109 Cb 0.48 -1.56 0.14 0.00 -1.05 0.00 0.00 32.46 30.47 1jxp n ARG 109 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1jxp n HIS 110 N -1.62 0.42 -2.04 2.89 8.25 -1.26 -4.89 115.22 116.97 1jxp n HIS 110 Ca 0.03 -0.46 -0.03 0.00 -0.26 0.00 0.00 57.72 57.00 1jxp n HIS 110 Cb 0.15 -0.02 -0.00 0.00 1.12 0.00 0.00 29.99 31.23 1jxp n HIS 110 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1jxp n ALA 111 N 0.51 -0.10 -2.56 -1.41 0.00 -0.91 -4.30 120.51 111.73 1jxp n ALA 111 Ca 0.11 0.03 -0.41 0.00 0.00 0.00 0.00 53.44 53.17 1jxp n ALA 111 Cb 0.41 -0.78 -0.08 0.00 0.00 0.00 0.00 19.45 19.00 1jxp n ALA 111 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1jxp s ASP 112 N -2.85 6.35 -1.09 0.00 1.01 -1.26 -4.25 116.67 114.58 1jxp s ASP 112 Ca 0.00 0.05 -0.20 0.00 0.71 0.00 0.00 52.55 53.11 1jxp s ASP 112 Cb 0.00 -2.28 0.08 0.00 1.01 0.00 0.00 42.92 41.73 1jxp s ASP 112 CO 0.00 -0.48 1.46 -0.69 0.21 0.00 0.00 175.17 175.67 1jxp s VAL 113 N 2.44 4.21 -0.19 -1.27 1.01 -1.26 -2.53 120.40 122.81 1jxp s VAL 113 Ca 0.20 -1.35 -0.17 0.00 0.00 0.00 0.00 61.98 60.67 1jxp s VAL 113 Cb -0.15 -5.03 -0.04 0.00 0.00 0.00 0.00 36.38 31.16 1jxp s VAL 113 CO 0.13 -1.85 0.43 0.27 0.00 0.00 0.00 175.10 174.07 1jxp s ILE 114 N 4.08 5.19 0.25 2.22 -4.36 -0.86 -4.85 121.20 122.86 1jxp s ILE 114 Ca 0.45 0.78 -0.30 0.00 -0.26 0.00 0.00 60.65 61.32 1jxp s ILE 114 Cb -0.00 -3.76 -0.10 0.00 1.25 0.00 0.00 42.46 39.85 1jxp s ILE 114 CO -0.05 0.25 1.44 -2.84 0.24 0.00 0.00 174.94 173.99 1jxp s PRO 115 N 1.24 4.27 -0.04 0.37 0.02 -1.26 -1.19 135.00 138.40 1jxp s PRO 115 Ca 0.21 2.30 -0.06 0.00 0.02 0.00 0.00 61.00 63.46 1jxp s PRO 115 Cb -0.15 -3.11 0.01 0.00 0.02 0.00 0.00 34.50 31.27 1jxp s PRO 115 CO 0.08 -0.42 0.16 0.08 -0.33 0.00 0.00 177.00 176.57 1jxp s VAL 116 N 0.02 0.03 -0.19 3.83 1.01 0.12 -3.20 120.40 122.02 1jxp s VAL 116 Ca 0.59 -0.21 -0.07 0.00 0.00 0.00 0.00 61.98 62.30 1jxp s VAL 116 Cb -0.42 -0.30 -0.04 0.00 0.00 0.00 0.00 36.38 35.62 1jxp s VAL 116 CO 0.43 -0.11 0.05 -0.60 0.00 0.00 0.00 175.10 174.86 1jxp s ARG 117 N -0.36 3.88 -0.12 2.72 3.52 0.14 -0.55 118.95 128.19 1jxp s ARG 117 Ca -0.04 -0.39 -0.29 0.00 -0.13 0.00 0.00 55.73 54.88 1jxp s ARG 117 Cb -0.03 -3.18 -0.06 0.00 -1.56 0.00 0.00 34.95 30.12 1jxp s ARG 117 CO 0.01 0.21 2.08 0.50 -0.81 0.00 0.00 175.30 177.28 1jxp s ARG 118 N 0.52 3.57 -0.54 5.12 3.52 0.18 0.25 118.95 131.58 1jxp s ARG 118 Ca 0.02 2.22 0.04 0.00 -0.13 0.00 0.00 55.73 57.88 1jxp s ARG 118 Cb -0.13 -4.27 0.40 0.00 -1.56 0.00 0.00 34.95 29.39 1jxp s ARG 118 CO 0.01 -1.61 1.26 -2.13 -0.81 0.00 0.00 175.30 172.02 1jxp n ARG 119 N 8.21 3.35 -0.61 5.12 3.00 -0.61 -4.75 116.66 130.38 1jxp n ARG 119 Ca 0.25 -4.40 0.00 0.00 -0.00 0.00 0.00 57.85 53.70 1jxp n ARG 119 Cb 0.44 -2.26 0.00 0.00 0.00 0.00 0.00 32.46 30.64 1jxp n ARG 119 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1jxp n GLY 120 N -0.45 0.75 0.10 5.14 0.00 -1.24 -4.47 105.19 105.02 1jxp n GLY 120 Ca 0.41 -1.77 0.01 0.00 0.00 0.00 0.00 46.02 44.67 1jxp n GLY 120 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1jxp h ASP 121 N 0.00 0.00 0.00 1.61 5.19 -1.99 -3.38 116.42 117.85 1jxp h ASP 121 Ca 0.00 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.40 1jxp h ASP 121 Cb 0.00 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.50 1jxp h ASP 121 CO 0.00 0.53 -0.38 -1.20 -3.12 0.00 0.00 179.24 175.07 1jxp n SER 122 N -2.92 0.02 -4.45 6.45 7.64 -1.26 -4.60 113.62 114.50 1jxp n SER 122 Ca -0.07 -1.73 -0.22 0.00 1.01 0.00 0.00 58.87 57.86 1jxp n SER 122 Cb 0.81 -0.14 -0.10 0.00 -1.01 0.00 0.00 64.21 63.76 1jxp n SER 122 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1jxp s ARG 123 N 0.00 1.59 -0.30 1.43 6.06 -1.26 -0.81 118.95 125.66 1jxp s ARG 123 Ca 0.01 -1.80 -0.10 0.00 -2.50 0.00 0.00 55.73 51.33 1jxp s ARG 123 Cb 0.01 -1.26 0.13 0.00 0.06 0.00 0.00 34.95 33.89 1jxp s ARG 123 CO -0.01 0.07 0.68 0.20 -2.50 0.00 0.00 175.30 173.74 1jxp s GLY 124 N -3.47 -0.69 0.29 8.12 0.00 -0.74 -1.58 107.32 109.26 1jxp s GLY 124 Ca 0.30 2.41 -0.30 0.00 0.00 0.00 0.00 44.72 47.12 1jxp s GLY 124 CO 0.13 3.08 1.61 -0.56 0.00 0.00 0.00 173.10 177.35 1jxp s SER 125 N 2.85 6.36 -0.32 1.64 0.01 0.70 -0.93 113.70 124.01 1jxp s SER 125 Ca -0.06 2.96 -0.17 0.00 1.31 0.00 0.00 55.95 60.00 1jxp s SER 125 Cb -0.11 -2.63 -0.02 0.00 0.21 0.00 0.00 66.02 63.46 1jxp s SER 125 CO -0.19 -0.93 0.45 -0.22 0.41 0.00 0.00 173.24 172.76 1jxp s LEU 126 N -0.46 4.25 0.07 2.44 2.96 -0.67 0.24 118.68 127.52 1jxp s LEU 126 Ca 0.64 0.09 -0.34 0.00 -0.22 0.00 0.00 54.13 54.29 1jxp s LEU 126 Cb -0.48 -2.51 -0.18 0.00 0.50 0.00 0.00 46.19 43.53 1jxp s LEU 126 CO 0.48 -0.35 1.53 -0.07 -1.32 0.00 0.00 176.35 176.61 1jxp h LEU 127 N 8.86 -1.22 -7.70 -0.68 3.38 -1.86 -3.33 115.31 112.76 1jxp h LEU 127 Ca -0.29 0.08 -0.79 0.00 0.09 0.00 0.00 57.88 56.96 1jxp h LEU 127 Cb 1.14 0.37 -0.27 0.00 0.09 0.00 0.00 40.66 41.99 1jxp h LEU 127 CO 0.72 -0.69 0.29 -0.44 0.09 0.00 0.00 178.44 178.41 1jxp s SER 128 N -4.08 7.05 -0.70 -0.43 0.01 -1.26 -5.00 113.70 109.30 1jxp s SER 128 Ca -0.17 -3.15 -0.11 0.00 1.31 0.00 0.00 55.95 53.83 1jxp s SER 128 Cb 0.03 -2.21 -0.21 0.00 0.21 0.00 0.00 66.02 63.84 1jxp s SER 128 CO 0.56 -0.43 1.88 -2.65 0.41 0.00 0.00 173.24 173.01 1jxp n PRO 129 N 3.35 0.10 -1.31 12.44 -0.02 -1.25 -4.89 135.00 143.42 1jxp n PRO 129 Ca 0.19 -0.30 -0.30 0.00 -2.02 0.00 0.00 63.50 61.07 1jxp n PRO 129 Cb 0.43 -1.71 0.11 0.00 -0.02 0.00 0.00 33.50 32.31 1jxp n PRO 129 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1jxp s ARG 130 N 6.91 1.89 0.62 -0.52 3.00 -1.26 -4.73 118.95 124.87 1jxp s ARG 130 Ca 0.85 0.93 -0.15 0.00 0.00 0.00 0.00 55.73 57.36 1jxp s ARG 130 Cb -0.43 -1.87 -0.02 0.00 0.00 0.00 0.00 34.95 32.63 1jxp s ARG 130 CO 0.30 -1.83 1.06 -1.25 0.00 0.00 0.00 175.30 173.58 1jxp s PRO 131 N -4.97 3.18 0.22 3.54 0.04 -1.26 -1.69 135.00 134.06 1jxp s PRO 131 Ca 0.62 1.18 -0.09 0.00 0.04 0.00 0.00 61.00 62.74 1jxp s PRO 131 Cb -0.17 -2.01 0.18 0.00 0.04 0.00 0.00 34.50 32.54 1jxp s PRO 131 CO 0.56 -0.92 1.89 -0.24 0.04 0.00 0.00 177.00 178.33 1jxp h VAL 132 N 0.16 1.22 -1.06 -0.36 3.04 -1.64 -1.92 116.25 115.68 1jxp h VAL 132 Ca -0.46 -0.41 0.29 0.00 -1.01 0.00 0.00 66.70 65.12 1jxp h VAL 132 Cb 1.22 0.01 -0.06 0.00 -2.01 0.00 0.00 31.29 30.45 1jxp h VAL 132 CO 0.57 0.21 0.73 0.77 -1.01 0.00 0.00 177.57 178.84 1jxp h SER 133 N 1.12 0.19 -0.93 3.17 4.64 -1.92 0.11 113.55 119.93 1jxp h SER 133 Ca 0.30 0.03 0.12 0.00 -0.47 0.00 0.00 61.79 61.77 1jxp h SER 133 Cb -0.11 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 61.91 1jxp h SER 133 CO -0.06 0.04 0.60 0.22 -0.87 0.00 0.00 176.83 176.75 1jxp h TYR 134 N 0.17 0.99 0.00 4.77 5.03 -1.71 -2.42 116.97 123.80 1jxp h TYR 134 Ca 0.55 0.03 -0.04 0.00 2.58 0.00 0.00 58.73 61.85 1jxp h TYR 134 Cb 1.83 -0.31 -0.01 0.00 1.55 0.00 0.00 36.73 39.79 1jxp h TYR 134 CO -0.00 0.41 -0.19 -0.07 -1.32 0.00 0.00 178.16 176.99 1jxp h LEU 135 N 0.87 0.00 -9.00 2.82 -0.00 -0.92 -3.48 115.31 105.61 1jxp h LEU 135 Ca 0.45 0.00 -0.88 0.00 -0.00 0.00 0.00 57.88 57.46 1jxp h LEU 135 Cb 0.53 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 41.20 1jxp h LEU 135 CO -0.22 0.19 0.68 0.29 -0.00 0.00 0.00 178.44 179.38 1jxp n LYS 136 N -3.16 0.01 -0.50 1.13 5.02 -0.91 -0.61 118.16 119.14 1jxp n LYS 136 Ca 0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 1jxp n LYS 136 Cb 0.59 -1.51 0.00 0.00 -0.02 0.00 0.00 35.03 34.09 1jxp n LYS 136 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1jxp n GLY 137 N 3.94 0.75 0.47 0.72 0.00 -1.26 -4.94 105.19 104.87 1jxp n GLY 137 Ca 0.31 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.40 1jxp n GLY 137 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1jxp n SER 138 N 0.00 1.88 -4.78 1.61 7.64 0.21 -4.06 113.62 116.13 1jxp n SER 138 Ca 0.00 -1.44 -0.41 0.00 1.01 0.00 0.00 58.87 58.03 1jxp n SER 138 Cb 0.00 0.27 -0.01 0.00 -1.01 0.00 0.00 64.21 63.46 1jxp n SER 138 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1jxp s SER 139 N -1.59 6.45 0.00 6.43 0.01 -1.26 -2.37 113.70 121.37 1jxp s SER 139 Ca 0.15 2.96 0.00 0.00 1.31 0.00 0.00 55.95 60.37 1jxp s SER 139 Cb 0.13 -2.66 0.00 0.00 0.21 0.00 0.00 66.02 63.69 1jxp s SER 139 CO 0.30 -0.79 0.00 0.61 0.41 0.00 0.00 173.24 173.76 1jxp n GLY 140 N 0.63 2.78 3.87 3.44 0.00 0.15 -1.87 105.19 114.20 1jxp n GLY 140 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 1jxp n GLY 140 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1jxp s GLY 141 N -2.58 1.64 0.71 -0.02 0.00 -1.00 -2.96 107.32 103.10 1jxp s GLY 141 Ca 0.00 -0.22 -0.09 0.00 0.00 0.00 0.00 44.72 44.41 1jxp s GLY 141 CO 0.00 0.12 1.05 2.56 0.00 0.00 0.00 173.10 176.82 1jxp s PRO 142 N -5.26 2.42 -0.07 2.90 0.04 -1.26 0.37 135.00 134.14 1jxp s PRO 142 Ca 0.57 0.03 -0.02 0.00 0.04 0.00 0.00 61.00 61.62 1jxp s PRO 142 Cb -0.11 -2.11 0.03 0.00 0.04 0.00 0.00 34.50 32.35 1jxp s PRO 142 CO 0.53 -1.17 0.03 -0.51 0.04 0.00 0.00 177.00 175.91 1jxp s LEU 143 N -5.29 0.45 0.29 -3.56 1.02 -1.20 -2.39 118.68 107.99 1jxp s LEU 143 Ca 0.59 -0.07 0.07 0.00 0.02 0.00 0.00 54.13 54.74 1jxp s LEU 143 Cb -0.11 -0.34 -0.03 0.00 0.02 0.00 0.00 46.19 45.73 1jxp s LEU 143 CO 0.47 -0.22 0.26 -0.76 0.02 0.00 0.00 176.35 176.12 1jxp s LEU 144 N 2.04 3.76 0.10 1.79 2.01 0.80 -1.29 118.68 127.90 1jxp s LEU 144 Ca 0.05 -0.33 0.01 0.00 0.01 0.00 0.00 54.13 53.87 1jxp s LEU 144 Cb -0.12 -2.34 -0.04 0.00 0.01 0.00 0.00 46.19 43.70 1jxp s LEU 144 CO -0.05 -0.18 0.24 0.00 1.01 0.00 0.00 176.35 177.37 1jxp n PRO 146 N -0.12 0.01 -0.07 0.00 -0.02 -1.22 0.17 135.00 133.76 1jxp n PRO 146 Ca -0.06 0.50 0.11 0.00 -2.02 0.00 0.00 63.50 62.03 1jxp n PRO 146 Cb 0.52 -1.28 0.38 0.00 -0.02 0.00 0.00 33.50 33.10 1jxp n PRO 146 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1jxp n SER 147 N -2.01 1.85 0.00 2.55 7.64 -1.26 -4.94 113.62 117.45 1jxp n SER 147 Ca 0.08 -1.70 0.00 0.00 1.01 0.00 0.00 58.87 58.25 1jxp n SER 147 Cb 0.68 -0.09 0.00 0.00 -1.01 0.00 0.00 64.21 63.79 1jxp n SER 147 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1jxp n GLY 148 N 1.18 0.81 3.86 0.23 0.00 0.45 -5.06 105.19 106.66 1jxp n GLY 148 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 1jxp n GLY 148 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1jxp s HIS 149 N -3.09 3.48 0.44 1.61 3.76 -1.24 -4.79 115.29 115.46 1jxp s HIS 149 Ca 0.00 1.29 -0.22 0.00 -0.15 0.00 0.00 55.06 55.99 1jxp s HIS 149 Cb 0.00 -2.66 -0.09 0.00 1.11 0.00 0.00 32.58 30.94 1jxp s HIS 149 CO 0.00 -0.31 1.02 0.00 -0.85 0.00 0.00 174.74 174.61 1jxp s ALA 150 N -2.60 2.98 0.00 -1.40 0.00 -0.28 -1.00 121.76 119.47 1jxp s ALA 150 Ca 0.56 0.60 0.00 0.00 0.00 0.00 0.00 51.96 53.12 1jxp s ALA 150 Cb -0.10 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 19.78 1jxp s ALA 150 CO 0.34 -0.20 0.00 1.33 0.00 0.00 0.00 175.76 177.23 1jxp n VAL 151 N -0.57 0.00 -1.24 0.00 0.24 -0.41 -0.74 118.33 115.61 1jxp n VAL 151 Ca 0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.37 1jxp n VAL 151 Cb 0.52 0.20 0.00 0.00 -1.47 0.00 0.00 33.84 33.09 1jxp n VAL 151 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1jxp n GLY 152 N 1.31 -1.47 3.14 7.63 0.00 -1.24 0.15 105.19 114.71 1jxp n GLY 152 Ca 0.00 -1.03 -0.32 0.00 0.00 0.00 0.00 46.02 44.67 1jxp n GLY 152 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jxp s ILE 153 N -2.38 2.01 -0.25 -0.61 -1.09 -0.62 -3.21 121.20 115.05 1jxp s ILE 153 Ca 0.00 -0.93 -0.31 0.00 -2.23 0.00 0.00 60.65 57.17 1jxp s ILE 153 Cb 0.00 -1.79 -0.08 0.00 -1.58 0.00 0.00 42.46 39.01 1jxp s ILE 153 CO 0.00 0.54 2.17 0.33 -1.23 0.00 0.00 174.94 176.75 1jxp n PHE 154 N 4.26 1.87 -0.08 3.97 7.35 0.16 -1.11 117.46 133.87 1jxp n PHE 154 Ca -0.20 0.03 -0.23 0.00 -0.76 0.00 0.00 57.45 56.30 1jxp n PHE 154 Cb 0.51 -2.65 -0.12 0.00 0.35 0.00 0.00 39.48 37.57 1jxp n PHE 154 CO 0.00 0.00 0.00 -2.13 -0.76 0.00 0.00 176.76 173.87 1jxp n ARG 155 N 8.31 0.62 -2.79 -4.13 0.63 0.44 0.33 116.66 120.07 1jxp n ARG 155 Ca 0.33 0.42 -0.05 0.00 -0.92 0.00 0.00 57.85 57.63 1jxp n ARG 155 Cb 0.35 -1.68 0.02 0.00 0.45 0.00 0.00 32.46 31.59 1jxp n ARG 155 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1jxp n ALA 156 N -3.43 -1.20 -3.09 5.13 0.00 -1.03 -4.80 120.51 112.09 1jxp n ALA 156 Ca -0.36 -0.79 -0.32 0.00 0.00 0.00 0.00 53.44 51.96 1jxp n ALA 156 Cb 0.83 0.62 -0.15 0.00 0.00 0.00 0.00 19.45 20.74 1jxp n ALA 156 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jxp s ALA 157 N -1.69 2.43 -0.95 0.00 0.00 -1.26 -2.44 121.76 117.85 1jxp s ALA 157 Ca 0.11 -0.93 -0.19 0.00 0.00 0.00 0.00 51.96 50.95 1jxp s ALA 157 Cb -0.03 -1.03 0.12 0.00 0.00 0.00 0.00 23.12 22.18 1jxp s ALA 157 CO 0.07 0.29 1.18 0.14 0.00 0.00 0.00 175.76 177.44 1jxp s VAL 158 N 0.28 4.63 -0.10 0.00 -7.23 -0.89 -4.95 120.40 112.13 1jxp s VAL 158 Ca -0.13 -1.50 -0.06 0.00 -1.81 0.00 0.00 61.98 58.48 1jxp s VAL 158 Cb -0.16 -4.82 -0.04 0.00 0.56 0.00 0.00 36.38 31.91 1jxp s VAL 158 CO 0.07 -1.57 0.14 0.00 -0.31 0.00 0.00 175.10 173.43 1jxp s THR 160 N -1.07 2.77 -0.51 0.00 2.01 0.53 -4.86 115.64 114.51 1jxp s THR 160 Ca 0.17 -2.71 -0.07 0.00 0.31 0.00 0.00 61.69 59.38 1jxp s THR 160 Cb -0.12 -2.93 0.01 0.00 0.01 0.00 0.00 72.50 69.47 1jxp s THR 160 CO 0.06 -0.72 0.33 -2.11 -0.69 0.00 0.00 174.62 171.49 1jxp n ARG 161 N 3.82 -0.74 0.00 4.92 1.85 -1.26 -2.69 116.66 122.56 1jxp n ARG 161 Ca 0.04 0.16 0.00 0.00 -1.00 0.00 0.00 57.85 57.05 1jxp n ARG 161 Cb 0.38 -1.03 0.00 0.00 -1.05 0.00 0.00 32.46 30.76 1jxp n ARG 161 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1jxp n GLY 162 N -1.27 2.21 3.78 2.89 0.00 -1.26 -5.09 105.19 106.45 1jxp n GLY 162 Ca -0.13 -0.66 -0.39 0.00 0.00 0.00 0.00 46.02 44.83 1jxp n GLY 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jxp s VAL 163 N 0.00 4.38 -0.98 1.61 0.11 -1.09 -1.71 120.40 122.72 1jxp s VAL 163 Ca 0.00 1.68 -0.12 0.00 -2.93 0.00 0.00 61.98 60.61 1jxp s VAL 163 Cb 0.00 -4.12 0.24 0.00 -1.53 0.00 0.00 36.38 30.97 1jxp s VAL 163 CO 0.00 0.51 0.96 0.00 -3.33 0.00 0.00 175.10 173.24 1jxp s ALA 164 N -1.17 4.35 -1.09 1.54 0.00 -0.68 -0.35 121.76 124.36 1jxp s ALA 164 Ca 0.36 -3.54 0.06 0.00 0.00 0.00 0.00 51.96 48.84 1jxp s ALA 164 Cb -0.23 -3.59 0.29 0.00 0.00 0.00 0.00 23.12 19.60 1jxp s ALA 164 CO 0.26 -2.29 1.04 0.36 0.00 0.00 0.00 175.76 175.13 1jxp n LYS 165 N 3.56 2.24 -3.62 0.00 2.85 -1.21 -4.05 118.16 117.92 1jxp n LYS 165 Ca 0.20 -1.14 -0.01 0.00 -1.05 0.00 0.00 58.31 56.30 1jxp n LYS 165 Cb 0.43 -1.62 -0.02 0.00 -0.65 0.00 0.00 35.03 33.17 1jxp n LYS 165 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1jxp s ALA 166 N -1.66 -2.24 0.13 0.58 0.00 -1.25 -1.66 121.76 115.66 1jxp s ALA 166 Ca 0.20 1.61 0.05 0.00 0.00 0.00 0.00 51.96 53.82 1jxp s ALA 166 Cb 0.14 -0.19 -0.04 0.00 0.00 0.00 0.00 23.12 23.03 1jxp s ALA 166 CO 0.08 -0.68 -0.11 0.14 0.00 0.00 0.00 175.76 175.19 1jxp s VAL 167 N -2.13 1.15 -0.14 0.00 -7.23 -0.11 -2.10 120.40 109.84 1jxp s VAL 167 Ca 0.12 -1.86 -0.03 0.00 -1.81 0.00 0.00 61.98 58.40 1jxp s VAL 167 Cb 0.01 -1.64 -0.03 0.00 0.56 0.00 0.00 36.38 35.28 1jxp s VAL 167 CO -0.04 -0.61 -0.03 -1.81 -0.31 0.00 0.00 175.10 172.30 1jxp s ASP 168 N -2.80 4.88 0.05 4.85 1.01 -1.02 -1.79 116.67 121.86 1jxp s ASP 168 Ca 0.12 -0.07 -0.01 0.00 0.71 0.00 0.00 52.55 53.30 1jxp s ASP 168 Cb -0.01 -1.70 -0.04 0.00 1.01 0.00 0.00 42.92 42.18 1jxp s ASP 168 CO 0.01 0.21 -0.03 0.72 0.21 0.00 0.00 175.17 176.29 1jxp s PHE 169 N 0.11 0.52 -0.34 4.23 -0.71 0.01 -0.42 117.98 121.37 1jxp s PHE 169 Ca -0.00 -1.00 -0.26 0.00 -1.04 0.00 0.00 56.93 54.63 1jxp s PHE 169 Cb -0.13 -0.38 0.01 0.00 -1.21 0.00 0.00 43.02 41.31 1jxp s PHE 169 CO 0.03 -0.34 0.94 0.08 -1.34 0.00 0.00 175.22 174.59 1jxp s VAL 170 N -3.63 4.60 0.49 -2.49 1.01 -0.27 -4.60 120.40 115.51 1jxp s VAL 170 Ca 0.05 1.34 -0.23 0.00 0.00 0.00 0.00 61.98 63.13 1jxp s VAL 170 Cb 0.06 -4.32 -0.07 0.00 0.00 0.00 0.00 36.38 32.04 1jxp s VAL 170 CO -0.09 -0.47 1.28 -2.65 0.00 0.00 0.00 175.10 173.17 1jxp n PRO 171 N 6.71 1.76 0.30 2.72 -0.02 -1.26 -1.58 135.00 143.61 1jxp n PRO 171 Ca 0.08 0.64 0.16 0.00 -2.02 0.00 0.00 63.50 62.35 1jxp n PRO 171 Cb 0.48 -2.44 0.92 0.00 -0.02 0.00 0.00 33.50 32.44 1jxp n PRO 171 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 1jxp h VAL 172 N 1.70 0.43 -0.32 -1.45 3.04 -0.65 -1.14 116.25 117.87 1jxp h VAL 172 Ca -0.49 -0.14 -0.07 0.00 -1.01 0.00 0.00 66.70 64.99 1jxp h VAL 172 Cb 1.30 1.09 -0.02 0.00 -2.01 0.00 0.00 31.29 31.66 1jxp h VAL 172 CO 0.58 0.03 -0.09 -0.33 -1.01 0.00 0.00 177.57 176.75 1jxp h GLU 173 N 0.00 0.53 -0.00 4.17 3.07 -1.88 -0.73 114.58 119.74 1jxp h GLU 173 Ca -0.00 -0.15 0.00 0.00 -0.50 0.00 0.00 59.36 58.71 1jxp h GLU 173 Cb 0.09 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 27.94 1jxp h GLU 173 CO 0.00 0.63 0.00 0.43 -1.40 0.00 0.00 179.01 178.67 1jxp n SER 174 N -4.22 0.30 -0.00 1.42 7.64 -0.44 -1.97 113.62 116.36 1jxp n SER 174 Ca 0.01 -1.10 0.08 0.00 1.01 0.00 0.00 58.87 58.87 1jxp n SER 174 Cb 0.31 -0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.37 1jxp n SER 174 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 1jxp n MET 175 N -0.76 0.65 -0.04 1.43 2.81 -0.32 -4.11 117.12 116.77 1jxp n MET 175 Ca 0.23 -0.11 -0.08 0.00 -1.81 0.00 0.00 57.70 55.92 1jxp n MET 175 Cb 0.16 -1.58 -0.14 0.00 -0.71 0.00 0.00 33.22 30.95 1jxp n MET 175 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1jxp n GLU 176 N -2.40 0.65 0.28 0.03 1.02 -0.96 -3.80 120.64 115.47 1jxp n GLU 176 Ca -0.07 0.19 0.17 0.00 -0.02 0.00 0.00 57.16 57.43 1jxp n GLU 176 Cb 0.64 -1.70 0.76 0.00 -0.02 0.00 0.00 31.44 31.12 1jxp n GLU 176 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 1jxp h THR 177 N 0.00 0.09 -0.54 2.62 1.35 -1.57 -1.27 112.91 113.58 1jxp h THR 177 Ca -0.36 -0.48 0.00 0.00 -0.55 0.00 0.00 66.41 65.02 1jxp h THR 177 Cb 2.05 1.43 0.00 0.00 -1.73 0.00 0.00 68.15 69.90 1jxp h THR 177 CO 0.06 0.03 0.00 0.41 -0.25 0.00 0.00 175.52 175.77 1jxp n THR 178 N -3.16 0.73 -0.15 6.82 -1.04 -1.25 -5.12 114.28 111.11 1jxp n THR 178 Ca -0.00 -0.74 0.00 0.00 -2.04 0.00 0.00 64.05 61.27 1jxp n THR 178 Cb 0.27 0.39 0.00 0.00 -1.82 0.00 0.00 70.33 69.17 1jxp n THR 178 CO 0.00 0.00 0.00 0.23 -0.64 0.00 0.00 175.07 174.66