#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jz4 n ARG 14 N 0.00 3.81 0.33 5.56 1.74 -1.26 -4.77 116.66 122.06 1jz4 n ARG 14 Ca 0.00 -4.40 0.19 0.00 -0.77 0.00 0.00 57.85 52.87 1jz4 n ARG 14 Cb 0.00 -2.59 1.03 0.00 -1.02 0.00 0.00 32.46 29.88 1jz4 n ARG 14 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1jz4 h ASP 15 N 6.29 0.00 -0.07 0.55 3.32 -1.95 -0.13 116.42 124.43 1jz4 h ASP 15 Ca 0.21 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.26 1jz4 h ASP 15 Cb 0.79 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.34 1jz4 h ASP 15 CO 1.16 0.00 0.00 -2.67 -1.72 0.00 0.00 179.24 176.01 1jz4 n TRP 16 N -2.95 0.09 -2.41 4.55 2.14 -1.26 -3.23 117.44 114.37 1jz4 n TRP 16 Ca -0.03 -0.04 -0.13 0.00 2.07 0.00 0.00 57.50 59.37 1jz4 n TRP 16 Cb 0.18 0.00 0.03 0.00 -0.81 0.00 0.00 31.31 30.72 1jz4 n TRP 16 CO 0.00 0.00 0.00 0.39 2.07 0.00 0.00 177.69 180.15 1jz4 n GLU 17 N -0.29 2.72 -3.22 -2.67 1.02 -0.06 -0.48 120.64 117.66 1jz4 n GLU 17 Ca 0.15 -3.86 -0.01 0.00 -0.02 0.00 0.00 57.16 53.43 1jz4 n GLU 17 Cb 0.19 -1.96 -0.03 0.00 -0.02 0.00 0.00 31.44 29.62 1jz4 n GLU 17 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1jz4 s ASN 18 N -3.69 -0.85 0.03 1.62 3.84 -1.20 -4.70 114.94 109.99 1jz4 s ASN 18 Ca 0.40 0.45 0.14 0.00 0.21 0.00 0.00 52.86 54.06 1jz4 s ASN 18 Cb 0.37 1.77 0.60 0.00 -0.55 0.00 0.00 41.25 43.44 1jz4 s ASN 18 CO 0.00 -0.29 1.44 -0.81 -2.79 0.00 0.00 177.10 174.66 1jz4 n PRO 19 N 5.40 0.02 0.05 0.43 -0.04 -1.26 -1.01 135.00 138.59 1jz4 n PRO 19 Ca -0.00 0.29 0.13 0.00 -0.04 0.00 0.00 63.50 63.88 1jz4 n PRO 19 Cb 0.51 -1.54 0.34 0.00 -0.04 0.00 0.00 33.50 32.78 1jz4 n PRO 19 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1jz4 n GLY 20 N -0.16 -1.48 3.11 0.55 0.00 -1.26 -4.42 105.19 101.51 1jz4 n GLY 20 Ca 0.03 -0.17 -0.33 0.00 0.00 0.00 0.00 46.02 45.55 1jz4 n GLY 20 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jz4 s VAL 21 N -3.08 2.43 -0.74 1.61 1.01 -0.18 -4.93 120.40 116.51 1jz4 s VAL 21 Ca 0.10 -1.52 0.07 0.00 0.00 0.00 0.00 61.98 60.63 1jz4 s VAL 21 Cb 0.15 -2.40 0.02 0.00 0.00 0.00 0.00 36.38 34.15 1jz4 s VAL 21 CO 0.64 -0.02 0.60 0.35 0.00 0.00 0.00 175.10 176.67 1jz4 n THR 22 N 4.50 0.00 -3.60 3.92 -2.24 -1.26 -4.78 114.28 110.82 1jz4 n THR 22 Ca -0.14 -0.46 -0.04 0.00 -2.27 0.00 0.00 64.05 61.14 1jz4 n THR 22 Cb 0.43 1.11 -0.02 0.00 -2.10 0.00 0.00 70.33 69.75 1jz4 n THR 22 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1jz4 s GLN 23 N -0.88 0.34 -0.01 -0.78 1.03 -1.26 -1.17 119.66 116.92 1jz4 s GLN 23 Ca 0.07 -0.14 0.00 0.00 0.04 0.00 0.00 55.36 55.33 1jz4 s GLN 23 Cb 0.06 0.15 0.02 0.00 0.03 0.00 0.00 33.01 33.27 1jz4 s GLN 23 CO 0.14 -0.15 0.02 -0.51 -2.54 0.00 0.00 175.29 172.25 1jz4 s LEU 24 N -2.31 1.37 -1.43 2.60 1.43 0.40 -4.82 118.68 115.92 1jz4 s LEU 24 Ca 0.10 0.02 0.00 0.00 -1.03 0.00 0.00 54.13 53.22 1jz4 s LEU 24 Cb -0.00 -0.06 0.00 0.00 0.03 0.00 0.00 46.19 46.16 1jz4 s LEU 24 CO -0.05 -0.09 0.00 0.59 0.23 0.00 0.00 176.35 177.04 1jz4 n ASN 25 N 3.83 -5.27 -4.74 2.29 3.02 -1.26 -1.71 115.26 111.42 1jz4 n ASN 25 Ca -0.23 0.33 -0.41 0.00 -0.03 0.00 0.00 54.58 54.24 1jz4 n ASN 25 Cb 0.53 -4.17 -0.03 0.00 -0.61 0.00 0.00 39.78 35.50 1jz4 n ASN 25 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1jz4 s ARG 26 N -3.09 4.45 0.79 3.52 3.52 -1.26 -4.62 118.95 122.26 1jz4 s ARG 26 Ca 0.00 1.98 -0.11 0.00 -0.13 0.00 0.00 55.73 57.47 1jz4 s ARG 26 Cb 0.00 -3.19 0.07 0.00 -1.56 0.00 0.00 34.95 30.26 1jz4 s ARG 26 CO 0.00 -0.13 1.10 -0.51 -0.81 0.00 0.00 175.30 174.94 1jz4 s LEU 27 N -0.52 2.62 0.52 -0.88 1.43 0.88 -5.00 118.68 117.73 1jz4 s LEU 27 Ca 0.53 1.32 -0.21 0.00 -1.03 0.00 0.00 54.13 54.73 1jz4 s LEU 27 Cb -0.35 -3.94 -0.06 0.00 0.03 0.00 0.00 46.19 41.87 1jz4 s LEU 27 CO 0.40 -1.95 1.19 0.00 0.23 0.00 0.00 176.35 176.22 1jz4 s ALA 28 N -3.15 2.80 0.81 4.21 0.00 -1.26 -4.70 121.76 120.47 1jz4 s ALA 28 Ca 0.61 0.98 -0.12 0.00 0.00 0.00 0.00 51.96 53.43 1jz4 s ALA 28 Cb -0.14 -3.42 0.08 0.00 0.00 0.00 0.00 23.12 19.64 1jz4 s ALA 28 CO 0.54 -0.88 1.10 0.00 0.00 0.00 0.00 175.76 176.52 1jz4 s ALA 29 N -1.57 2.21 -0.04 0.00 0.00 -1.26 -5.01 121.76 116.08 1jz4 s ALA 29 Ca 0.69 -0.24 -0.31 0.00 0.00 0.00 0.00 51.96 52.11 1jz4 s ALA 29 Cb -0.29 -3.10 0.13 0.00 0.00 0.00 0.00 23.12 19.86 1jz4 s ALA 29 CO 0.34 -1.77 1.34 -3.38 0.00 0.00 0.00 175.76 172.29 1jz4 s HIS 30 N -3.17 -0.03 0.89 0.00 -3.43 -1.26 -4.88 115.29 103.41 1jz4 s HIS 30 Ca 0.61 -0.04 -0.12 0.00 -0.80 0.00 0.00 55.06 54.71 1jz4 s HIS 30 Cb -0.14 0.53 0.12 0.00 -1.43 0.00 0.00 32.58 31.66 1jz4 s HIS 30 CO 0.54 -0.19 1.09 -2.14 -2.00 0.00 0.00 174.74 172.05 1jz4 s PRO 31 N -2.29 1.33 0.14 -0.38 0.02 -1.08 -4.20 135.00 128.54 1jz4 s PRO 31 Ca 0.14 0.75 -0.34 0.00 0.02 0.00 0.00 61.00 61.57 1jz4 s PRO 31 Cb 0.06 -1.82 -0.14 0.00 0.02 0.00 0.00 34.50 32.61 1jz4 s PRO 31 CO -0.05 -2.17 1.55 -2.30 -0.33 0.00 0.00 177.00 173.70 1jz4 n PRO 32 N -3.83 1.99 -4.40 5.54 -0.02 -1.26 -4.99 135.00 128.03 1jz4 n PRO 32 Ca 0.07 0.72 -0.25 0.00 -2.02 0.00 0.00 63.50 62.01 1jz4 n PRO 32 Cb 0.56 -2.47 -0.12 0.00 -0.02 0.00 0.00 33.50 31.45 1jz4 n PRO 32 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1jz4 s PHE 33 N 0.98 2.16 0.00 6.00 2.99 -1.26 -4.78 117.98 124.08 1jz4 s PHE 33 Ca 0.80 -0.39 0.00 0.00 0.00 0.00 0.00 56.93 57.35 1jz4 s PHE 33 Cb -0.72 -1.07 0.00 0.00 0.00 0.00 0.00 43.02 41.22 1jz4 s PHE 33 CO 0.40 0.45 0.00 0.00 -0.00 0.00 0.00 175.22 176.07 1jz4 n ALA 34 N 0.28 0.52 -3.86 5.36 0.00 -1.26 -5.05 120.51 116.51 1jz4 n ALA 34 Ca -0.13 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.02 1jz4 n ALA 34 Cb 0.56 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.02 1jz4 n ALA 34 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1jz4 n SER 35 N -0.28 -2.62 -4.77 0.00 2.88 -1.26 -4.23 113.62 103.34 1jz4 n SER 35 Ca 0.00 -1.04 -0.37 0.00 -1.33 0.00 0.00 58.87 56.13 1jz4 n SER 35 Cb 0.00 -3.06 -0.02 0.00 -0.75 0.00 0.00 64.21 60.38 1jz4 n SER 35 CO 0.00 0.00 0.00 0.26 -1.23 0.00 0.00 175.04 174.07 1jz4 s TRP 36 N -3.73 3.09 -0.46 0.66 0.51 -0.78 -4.55 118.94 113.68 1jz4 s TRP 36 Ca 0.23 1.58 0.12 0.00 -2.12 0.00 0.00 56.10 55.92 1jz4 s TRP 36 Cb -0.09 -3.29 0.35 0.00 -0.81 0.00 0.00 33.47 29.62 1jz4 s TRP 36 CO 0.89 -1.12 1.27 0.54 -0.51 0.00 0.00 176.95 178.02 1jz4 n ARG 37 N -0.12 2.76 -3.65 4.98 5.12 -1.26 -1.52 116.66 122.96 1jz4 n ARG 37 Ca 0.05 -2.32 -0.20 0.00 -1.93 0.00 0.00 57.85 53.45 1jz4 n ARG 37 Cb 0.48 -1.47 -0.17 0.00 -1.16 0.00 0.00 32.46 30.14 1jz4 n ARG 37 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 1jz4 s ASN 38 N -1.52 1.27 0.22 0.55 3.84 -1.26 -4.96 114.94 113.08 1jz4 s ASN 38 Ca 0.28 0.01 -0.09 0.00 0.21 0.00 0.00 52.86 53.27 1jz4 s ASN 38 Cb 0.20 -0.06 0.22 0.00 -0.55 0.00 0.00 41.25 41.06 1jz4 s ASN 38 CO 0.10 -0.27 1.87 0.28 -2.79 0.00 0.00 177.10 176.29 1jz4 h SER 39 N 8.42 0.84 -0.33 -4.21 0.02 -1.98 -1.89 113.55 114.42 1jz4 h SER 39 Ca -0.13 -0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 60.74 1jz4 h SER 39 Cb 1.13 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 63.46 1jz4 h SER 39 CO 0.18 0.58 -0.04 -0.08 -1.14 0.00 0.00 176.83 176.33 1jz4 h GLU 40 N 0.99 0.72 -0.37 3.45 4.57 -1.98 0.20 114.58 122.17 1jz4 h GLU 40 Ca 0.31 -0.20 -0.15 0.00 -1.18 0.00 0.00 59.36 58.14 1jz4 h GLU 40 Cb -0.01 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.49 1jz4 h GLU 40 CO -0.10 0.76 -0.37 0.93 -1.18 0.00 0.00 179.01 179.05 1jz4 h GLU 41 N 0.67 0.87 -0.66 1.92 4.39 -1.81 -1.40 114.58 118.56 1jz4 h GLU 41 Ca 0.13 -0.44 -0.00 0.00 0.34 0.00 0.00 59.36 59.38 1jz4 h GLU 41 Cb 0.48 0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 29.10 1jz4 h GLU 41 CO 0.02 1.08 0.40 0.00 -1.16 0.00 0.00 179.01 179.35 1jz4 h ALA 42 N 0.86 0.84 0.13 3.43 0.00 -1.17 -0.02 119.26 123.33 1jz4 h ALA 42 Ca 0.06 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1jz4 h ALA 42 Cb 0.94 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 1jz4 h ALA 42 CO 0.09 0.31 -0.20 -0.09 0.00 0.00 0.00 179.25 179.36 1jz4 h ARG 43 N 0.89 -0.37 0.00 0.00 2.43 -0.33 -2.76 114.38 114.24 1jz4 h ARG 43 Ca 0.24 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.43 1jz4 h ARG 43 Cb -0.03 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 1jz4 h ARG 43 CO -0.04 -0.25 0.00 0.25 -1.51 0.00 0.00 179.97 178.42 1jz4 n THR 44 N -5.32 0.07 -1.81 0.20 -2.24 -0.55 -4.88 114.28 99.75 1jz4 n THR 44 Ca -0.07 0.02 -0.10 0.00 -2.27 0.00 0.00 64.05 61.63 1jz4 n THR 44 Cb 0.24 -0.57 -0.02 0.00 -2.10 0.00 0.00 70.33 67.87 1jz4 n THR 44 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1jz4 n ASP 45 N -1.17 -3.64 -4.91 3.42 2.03 -0.20 -5.00 116.55 107.09 1jz4 n ASP 45 Ca 0.16 0.09 -0.28 0.00 0.52 0.00 0.00 54.79 55.29 1jz4 n ASP 45 Cb 0.17 -2.54 0.04 0.00 -0.72 0.00 0.00 41.12 38.07 1jz4 n ASP 45 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1jz4 s ARG 46 N -3.80 2.76 0.58 -0.67 0.52 -0.20 -5.02 118.95 113.12 1jz4 s ARG 46 Ca 0.00 0.09 -0.19 0.00 -0.52 0.00 0.00 55.73 55.11 1jz4 s ARG 46 Cb 0.00 -2.18 -0.06 0.00 0.52 0.00 0.00 34.95 33.24 1jz4 s ARG 46 CO 0.00 -0.90 0.92 -2.30 0.02 0.00 0.00 175.30 173.04 1jz4 n PRO 47 N -2.77 0.90 -4.28 3.54 -0.02 -1.26 -4.76 135.00 126.35 1jz4 n PRO 47 Ca 0.06 0.35 -0.34 0.00 -2.02 0.00 0.00 63.50 61.54 1jz4 n PRO 47 Cb 0.58 -2.11 -0.11 0.00 -0.02 0.00 0.00 33.50 31.83 1jz4 n PRO 47 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1jz4 s SER 48 N -1.20 5.03 0.05 2.55 0.15 -1.26 -4.99 113.70 114.03 1jz4 s SER 48 Ca 0.74 -0.07 0.20 0.00 0.70 0.00 0.00 55.95 57.51 1jz4 s SER 48 Cb -0.43 -1.83 0.82 0.00 -1.71 0.00 0.00 66.02 62.87 1jz4 s SER 48 CO 0.49 0.17 1.62 0.00 1.20 0.00 0.00 173.24 176.71 1jz4 n GLN 49 N 3.56 0.04 0.00 5.44 6.02 -1.26 -1.98 117.38 129.21 1jz4 n GLN 49 Ca -0.17 0.22 0.13 0.00 -0.01 0.00 0.00 57.00 57.17 1jz4 n GLN 49 Cb 0.52 -1.57 0.57 0.00 1.02 0.00 0.00 30.24 30.78 1jz4 n GLN 49 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1jz4 n GLN 50 N -1.66 0.03 -4.06 -1.09 1.13 -1.26 -4.70 117.38 105.77 1jz4 n GLN 50 Ca 0.04 0.05 -0.34 0.00 -1.94 0.00 0.00 57.00 54.81 1jz4 n GLN 50 Cb 0.23 -1.50 -0.15 0.00 0.11 0.00 0.00 30.24 28.93 1jz4 n GLN 50 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 1jz4 s LEU 51 N -2.97 2.36 0.02 1.08 2.96 -0.84 -1.08 118.68 120.21 1jz4 s LEU 51 Ca 0.14 -0.57 0.05 0.00 -0.22 0.00 0.00 54.13 53.52 1jz4 s LEU 51 Cb 0.17 -1.56 -0.02 0.00 0.50 0.00 0.00 46.19 45.29 1jz4 s LEU 51 CO 0.48 -0.00 -0.15 -0.13 -1.32 0.00 0.00 176.35 175.22 1jz4 s ARG 52 N 1.34 1.08 0.10 1.98 0.52 -0.19 -4.68 118.95 119.11 1jz4 s ARG 52 Ca 0.05 -0.67 -0.17 0.00 -0.52 0.00 0.00 55.73 54.42 1jz4 s ARG 52 Cb -0.13 -1.08 -0.07 0.00 0.52 0.00 0.00 34.95 34.19 1jz4 s ARG 52 CO -0.10 0.28 0.56 0.45 0.02 0.00 0.00 175.30 176.51 1jz4 s SER 53 N -0.79 6.97 -0.12 0.23 0.15 -1.26 -0.65 113.70 118.22 1jz4 s SER 53 Ca 0.04 1.19 0.15 0.00 0.70 0.00 0.00 55.95 58.03 1jz4 s SER 53 Cb -0.07 -2.33 0.47 0.00 -1.71 0.00 0.00 66.02 62.38 1jz4 s SER 53 CO 0.01 0.21 1.38 0.18 1.20 0.00 0.00 173.24 176.21 1jz4 n LEU 54 N 1.37 3.64 -4.72 3.45 4.77 0.49 -4.92 117.00 121.07 1jz4 n LEU 54 Ca -0.08 -2.70 -0.34 0.00 -0.03 0.00 0.00 56.01 52.85 1jz4 n LEU 54 Cb 0.51 -0.45 0.09 0.00 -2.33 0.00 0.00 43.42 41.24 1jz4 n LEU 54 CO 0.41 0.69 0.79 0.20 -1.33 0.00 0.00 177.39 178.15 1jz4 s ASN 55 N -1.62 4.23 0.00 -1.43 -0.87 -1.24 -4.83 114.94 109.18 1jz4 s ASN 55 Ca 0.37 2.31 0.00 0.00 -1.57 0.00 0.00 52.86 53.96 1jz4 s ASN 55 Cb 0.28 -2.58 0.00 0.00 -0.02 0.00 0.00 41.25 38.92 1jz4 s ASN 55 CO 0.11 -2.24 0.00 0.61 -2.57 0.00 0.00 177.10 173.02 1jz4 n GLY 56 N 0.27 0.59 3.66 0.66 0.00 -0.33 -5.01 105.19 105.04 1jz4 n GLY 56 Ca 0.13 -1.68 -0.43 0.00 0.00 0.00 0.00 46.02 44.04 1jz4 n GLY 56 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1jz4 s GLU 57 N -1.50 4.28 0.53 1.61 2.02 -1.26 -0.85 118.70 123.53 1jz4 s GLU 57 Ca 0.00 1.40 0.00 0.00 0.02 0.00 0.00 54.97 56.39 1jz4 s GLU 57 Cb 0.00 -3.63 -0.00 0.00 0.10 0.00 0.00 34.13 30.59 1jz4 s GLU 57 CO 0.00 -0.59 0.02 -1.58 0.02 0.00 0.00 175.26 173.13 1jz4 s TRP 58 N 3.03 1.76 -0.14 1.61 0.52 0.97 -4.93 118.94 121.76 1jz4 s TRP 58 Ca 0.46 -0.99 -0.03 0.00 0.02 0.00 0.00 56.10 55.55 1jz4 s TRP 58 Cb -0.16 -1.60 -0.03 0.00 -1.15 0.00 0.00 33.47 30.53 1jz4 s TRP 58 CO 0.09 0.17 -0.03 1.03 0.02 0.00 0.00 176.95 178.23 1jz4 s ARG 59 N -3.92 3.52 0.02 4.98 1.81 0.53 -1.42 118.95 124.48 1jz4 s ARG 59 Ca 0.02 -0.50 0.01 0.00 -1.72 0.00 0.00 55.73 53.54 1jz4 s ARG 59 Cb 0.00 -2.88 -0.02 0.00 -0.45 0.00 0.00 34.95 31.60 1jz4 s ARG 59 CO 0.01 0.34 -0.04 0.12 -0.68 0.00 0.00 175.30 175.05 1jz4 s PHE 60 N 0.10 0.38 -0.07 -0.53 5.36 0.13 0.61 117.98 123.97 1jz4 s PHE 60 Ca -0.00 -0.41 -0.11 0.00 -0.96 0.00 0.00 56.93 55.44 1jz4 s PHE 60 Cb -0.13 -0.25 0.02 0.00 -0.34 0.00 0.00 43.02 42.32 1jz4 s PHE 60 CO 0.03 -0.11 0.27 0.00 -1.46 0.00 0.00 175.22 173.94 1jz4 s ALA 61 N -1.13 -0.68 -0.08 11.12 0.00 0.00 -1.13 121.76 129.87 1jz4 s ALA 61 Ca -0.10 0.56 -0.01 0.00 0.00 0.00 0.00 51.96 52.41 1jz4 s ALA 61 Cb -0.08 -0.25 -0.03 0.00 0.00 0.00 0.00 23.12 22.76 1jz4 s ALA 61 CO -0.00 -0.18 -0.03 -0.46 0.00 0.00 0.00 175.76 175.09 1jz4 s TRP 62 N -0.43 3.07 0.11 0.00 -0.00 -1.26 0.04 118.94 120.47 1jz4 s TRP 62 Ca -0.05 0.11 0.04 0.00 -0.00 0.00 0.00 56.10 56.19 1jz4 s TRP 62 Cb -0.04 -1.76 -0.04 0.00 -0.00 0.00 0.00 33.47 31.63 1jz4 s TRP 62 CO 0.02 0.40 -0.10 -0.06 -0.00 0.00 0.00 176.95 177.20 1jz4 s PHE 63 N -0.81 1.11 0.16 5.86 0.40 0.98 -5.00 117.98 120.69 1jz4 s PHE 63 Ca 0.12 -0.69 0.24 0.00 -0.60 0.00 0.00 56.93 56.01 1jz4 s PHE 63 Cb -0.11 -0.60 0.95 0.00 0.51 0.00 0.00 43.02 43.76 1jz4 s PHE 63 CO 0.02 0.02 1.84 -1.00 0.70 0.00 0.00 175.22 176.79 1jz4 h PRO 64 N 3.37 0.00 -2.75 0.24 0.13 -1.85 0.51 132.00 131.65 1jz4 h PRO 64 Ca -0.37 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.74 1jz4 h PRO 64 Cb 1.19 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.18 1jz4 h PRO 64 CO 0.56 0.23 0.24 0.00 -0.23 0.00 0.00 178.00 178.79 1jz4 s ALA 65 N -3.70 -1.65 0.22 -0.56 0.00 -1.21 -0.86 121.76 114.00 1jz4 s ALA 65 Ca 0.00 0.69 -0.06 0.00 0.00 0.00 0.00 51.96 52.59 1jz4 s ALA 65 Cb 0.11 0.68 0.19 0.00 0.00 0.00 0.00 23.12 24.09 1jz4 s ALA 65 CO 0.64 -0.69 1.74 -1.00 0.00 0.00 0.00 175.76 176.45 1jz4 h PRO 66 N 2.17 1.07 0.00 0.00 0.13 -1.87 -0.95 132.00 132.55 1jz4 h PRO 66 Ca -0.32 -0.25 0.00 0.00 -0.87 0.00 0.00 66.00 64.57 1jz4 h PRO 66 Cb 1.27 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1jz4 h PRO 66 CO 0.37 0.94 0.16 0.39 -0.23 0.00 0.00 178.00 179.64 1jz4 n GLU 67 N -4.24 0.06 0.00 0.86 4.71 -1.26 -1.86 120.64 118.91 1jz4 n GLU 67 Ca 0.05 0.49 0.12 0.00 -0.01 0.00 0.00 57.16 57.81 1jz4 n GLU 67 Cb 0.25 -1.85 0.19 0.00 -1.01 0.00 0.00 31.44 29.03 1jz4 n GLU 67 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1jz4 n ALA 68 N -1.52 3.22 -2.69 0.62 0.00 -0.36 -4.89 120.51 114.90 1jz4 n ALA 68 Ca -0.01 -0.54 -0.41 0.00 0.00 0.00 0.00 53.44 52.49 1jz4 n ALA 68 Cb 0.17 -0.95 -0.04 0.00 0.00 0.00 0.00 19.45 18.63 1jz4 n ALA 68 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1jz4 s VAL 69 N -2.42 4.95 0.14 0.00 1.01 -0.78 -5.00 120.40 118.31 1jz4 s VAL 69 Ca 0.23 1.54 -0.31 0.00 0.00 0.00 0.00 61.98 63.44 1jz4 s VAL 69 Cb 0.19 -4.09 -0.08 0.00 0.00 0.00 0.00 36.38 32.40 1jz4 s VAL 69 CO 0.51 0.12 1.33 -2.16 0.00 0.00 0.00 175.10 174.90 1jz4 s PRO 70 N 1.63 4.36 0.52 2.72 0.05 -1.26 -4.91 135.00 138.11 1jz4 s PRO 70 Ca 0.38 2.02 0.25 0.00 0.05 0.00 0.00 61.00 63.70 1jz4 s PRO 70 Cb -0.17 -3.24 1.38 0.00 0.05 0.00 0.00 34.50 32.52 1jz4 s PRO 70 CO 0.15 -0.34 1.99 0.93 0.05 0.00 0.00 177.00 179.78 1jz4 h GLU 71 N 6.23 0.02 0.00 4.56 3.07 -2.00 0.35 114.58 126.81 1jz4 h GLU 71 Ca -0.43 -0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.42 1jz4 h GLU 71 Cb 1.21 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 29.12 1jz4 h GLU 71 CO 0.82 0.01 -0.02 0.66 -1.40 0.00 0.00 179.01 179.09 1jz4 h SER 72 N 0.02 0.00 0.47 1.42 4.64 -1.92 -1.71 113.55 116.47 1jz4 h SER 72 Ca 0.26 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.57 1jz4 h SER 72 Cb 1.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.09 1jz4 h SER 72 CO -0.01 0.02 -0.02 -0.25 -0.87 0.00 0.00 176.83 175.69 1jz4 h TRP 73 N 0.00 0.00 -0.35 4.77 7.01 -0.46 0.13 115.95 127.06 1jz4 h TRP 73 Ca -0.00 0.00 -0.08 0.00 2.11 0.00 0.00 58.89 60.92 1jz4 h TRP 73 Cb 0.06 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.11 1jz4 h TRP 73 CO 0.00 0.02 -0.09 -0.07 -2.79 0.00 0.00 178.44 175.51 1jz4 h LEU 74 N 0.00 0.68 0.16 0.65 3.38 -1.48 -3.31 115.31 115.39 1jz4 h LEU 74 Ca -0.00 -0.37 -0.27 0.00 0.09 0.00 0.00 57.88 57.33 1jz4 h LEU 74 Cb 0.27 -0.19 0.01 0.00 0.09 0.00 0.00 40.66 40.84 1jz4 h LEU 74 CO 0.00 0.90 -1.26 -0.08 0.09 0.00 0.00 178.44 178.08 1jz4 h GLU 75 N 0.46 0.34 -3.12 1.13 4.57 -1.55 -3.31 114.58 113.10 1jz4 h GLU 75 Ca 0.09 -0.58 -0.08 0.00 -1.18 0.00 0.00 59.36 57.61 1jz4 h GLU 75 Cb 0.60 0.21 -0.16 0.00 -0.16 0.00 0.00 28.75 29.24 1jz4 h GLU 75 CO 0.04 1.28 -0.13 0.00 -1.18 0.00 0.00 179.01 179.01 1jz4 n ASP 77 N 0.45 1.40 -4.71 0.00 2.03 -1.26 -4.15 116.55 110.31 1jz4 n ASP 77 Ca -0.18 1.13 -0.42 0.00 0.52 0.00 0.00 54.79 55.84 1jz4 n ASP 77 Cb 0.60 -1.20 -0.03 0.00 -0.72 0.00 0.00 41.12 39.77 1jz4 n ASP 77 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1jz4 s LEU 78 N 0.60 4.39 0.48 -2.67 1.43 -1.26 -4.91 118.68 116.75 1jz4 s LEU 78 Ca 0.78 1.83 0.19 0.00 -1.03 0.00 0.00 54.13 55.90 1jz4 s LEU 78 Cb -0.90 -3.58 1.20 0.00 0.03 0.00 0.00 46.19 42.94 1jz4 s LEU 78 CO 0.50 -0.31 2.04 -0.65 0.23 0.00 0.00 176.35 178.16 1jz4 h PRO 79 N 6.57 0.00 -0.00 1.29 0.11 -2.02 -1.21 132.00 136.74 1jz4 h PRO 79 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1jz4 h PRO 79 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1jz4 h PRO 79 CO 0.77 0.15 -0.10 0.39 -0.21 0.00 0.00 178.00 179.00 1jz4 n GLU 80 N -4.10 0.33 -0.93 1.05 4.71 -1.26 -4.85 120.64 115.59 1jz4 n GLU 80 Ca -0.02 -0.07 -0.30 0.00 -0.01 0.00 0.00 57.16 56.76 1jz4 n GLU 80 Cb 0.23 -1.50 0.17 0.00 -1.01 0.00 0.00 31.44 29.32 1jz4 n GLU 80 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1jz4 s ALA 81 N -2.72 1.10 0.33 0.62 0.00 -0.46 -4.93 121.76 115.71 1jz4 s ALA 81 Ca 0.22 0.11 0.09 0.00 0.00 0.00 0.00 51.96 52.39 1jz4 s ALA 81 Cb 0.19 -3.27 -0.05 0.00 0.00 0.00 0.00 23.12 19.99 1jz4 s ALA 81 CO 0.52 -2.77 -0.03 -0.51 0.00 0.00 0.00 175.76 172.97 1jz4 s ASP 82 N -3.02 4.09 -0.33 0.00 1.01 -0.28 -4.88 116.67 113.26 1jz4 s ASP 82 Ca 0.65 -0.99 -0.13 0.00 0.71 0.00 0.00 52.55 52.80 1jz4 s ASP 82 Cb -0.21 -0.52 -0.02 0.00 1.01 0.00 0.00 42.92 43.19 1jz4 s ASP 82 CO 0.59 -0.18 0.27 -0.89 0.21 0.00 0.00 175.17 175.17 1jz4 s THR 83 N -2.51 5.26 0.25 -1.27 2.01 -1.26 0.21 115.64 118.33 1jz4 s THR 83 Ca 0.34 -0.08 0.06 0.00 0.31 0.00 0.00 61.69 62.32 1jz4 s THR 83 Cb -0.01 -3.71 -0.05 0.00 0.01 0.00 0.00 72.50 68.73 1jz4 s THR 83 CO 0.19 0.01 -0.05 0.68 -0.69 0.00 0.00 174.62 174.75 1jz4 s VAL 84 N 1.81 1.47 0.17 3.82 -7.23 -0.50 -4.95 120.40 114.98 1jz4 s VAL 84 Ca 0.08 -2.11 -0.28 0.00 -1.81 0.00 0.00 61.98 57.87 1jz4 s VAL 84 Cb -0.17 -2.35 -0.08 0.00 0.56 0.00 0.00 36.38 34.34 1jz4 s VAL 84 CO 0.11 -0.36 0.86 -0.69 -0.31 0.00 0.00 175.10 174.71 1jz4 s VAL 85 N -3.13 4.32 -0.02 1.32 1.01 -1.26 -0.02 120.40 122.61 1jz4 s VAL 85 Ca 0.28 1.88 0.04 0.00 0.00 0.00 0.00 61.98 64.18 1jz4 s VAL 85 Cb 0.04 -4.23 -0.01 0.00 0.00 0.00 0.00 36.38 32.18 1jz4 s VAL 85 CO 0.10 0.47 -0.15 -0.69 0.00 0.00 0.00 175.10 174.83 1jz4 s VAL 86 N -0.89 1.19 0.54 2.92 1.01 -0.03 -4.02 120.40 121.12 1jz4 s VAL 86 Ca 0.39 -0.61 -0.19 0.00 0.00 0.00 0.00 61.98 61.57 1jz4 s VAL 86 Cb -0.24 -1.01 -0.06 0.00 0.00 0.00 0.00 36.38 35.07 1jz4 s VAL 86 CO 0.28 0.34 1.10 -2.16 0.00 0.00 0.00 175.10 174.66 1jz4 s PRO 87 N -0.13 3.43 -0.07 2.72 0.04 -1.26 -1.19 135.00 138.55 1jz4 s PRO 87 Ca 0.01 1.49 -0.31 0.00 0.04 0.00 0.00 61.00 62.24 1jz4 s PRO 87 Cb -0.08 -2.03 0.11 0.00 0.04 0.00 0.00 34.50 32.55 1jz4 s PRO 87 CO 0.00 -0.76 1.03 -1.54 0.04 0.00 0.00 177.00 175.78 1jz4 s SER 88 N -1.97 -0.25 -0.25 6.66 1.04 0.45 -4.95 113.70 114.44 1jz4 s SER 88 Ca 0.70 -0.03 -0.10 0.00 0.48 0.00 0.00 55.95 57.01 1jz4 s SER 88 Cb -0.21 0.29 -0.04 0.00 0.10 0.00 0.00 66.02 66.15 1jz4 s SER 88 CO 0.27 -0.47 0.14 0.20 0.98 0.00 0.00 173.24 174.36 1jz4 s ASN 89 N -2.41 5.84 0.47 7.02 -0.87 -1.26 -2.90 114.94 120.84 1jz4 s ASN 89 Ca 0.07 0.01 0.25 0.00 -1.57 0.00 0.00 52.86 51.62 1jz4 s ASN 89 Cb -0.01 -2.06 1.28 0.00 -0.02 0.00 0.00 41.25 40.45 1jz4 s ASN 89 CO -0.07 0.02 1.84 4.11 -2.57 0.00 0.00 177.10 180.44 1jz4 h TRP 90 N 7.81 0.31 0.00 2.20 0.09 -1.23 0.17 115.95 125.31 1jz4 h TRP 90 Ca -0.37 0.01 -0.01 0.00 0.09 0.00 0.00 58.89 58.61 1jz4 h TRP 90 Cb 1.18 -0.09 -0.00 0.00 0.08 0.00 0.00 29.16 30.32 1jz4 h TRP 90 CO 0.68 0.06 -0.06 1.96 0.09 0.00 0.00 178.44 181.18 1jz4 h GLN 91 N 0.21 0.00 0.00 0.12 7.50 -1.79 0.11 115.11 121.26 1jz4 h GLN 91 Ca 0.49 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.64 1jz4 h GLN 91 Cb 1.57 0.00 0.00 0.00 0.05 0.00 0.00 27.48 29.10 1jz4 h GLN 91 CO -0.12 0.06 0.00 -1.33 -1.50 0.00 0.00 178.83 175.93 1jz4 n MET 92 N -4.30 0.17 -0.07 1.46 2.81 0.60 -0.50 117.12 117.29 1jz4 n MET 92 Ca -0.03 0.34 0.12 0.00 -1.81 0.00 0.00 57.70 56.32 1jz4 n MET 92 Cb 0.14 -1.79 0.21 0.00 -0.71 0.00 0.00 33.22 31.06 1jz4 n MET 92 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 1jz4 n HIS 93 N -2.11 0.19 -1.03 2.03 8.25 0.00 -4.94 115.22 117.61 1jz4 n HIS 93 Ca 0.03 -0.10 -0.01 0.00 -0.26 0.00 0.00 57.72 57.39 1jz4 n HIS 93 Cb 0.27 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.37 1jz4 n HIS 93 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1jz4 n GLY 94 N 1.37 0.48 0.12 -1.41 0.00 0.34 -4.92 105.19 101.16 1jz4 n GLY 94 Ca 0.17 -0.75 -0.02 0.00 0.00 0.00 0.00 46.02 45.41 1jz4 n GLY 94 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1jz4 h TYR 95 N 0.00 0.00 -3.02 1.61 -1.99 -1.70 -3.47 116.97 108.40 1jz4 h TYR 95 Ca -0.02 0.00 0.01 0.00 2.00 0.00 0.00 58.73 60.72 1jz4 h TYR 95 Cb 0.08 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.79 1jz4 h TYR 95 CO 0.04 0.71 0.25 0.16 -0.00 0.00 0.00 178.16 179.32 1jz4 s ASP 96 N -6.72 -0.08 0.04 3.88 1.47 -1.26 -5.03 116.67 108.96 1jz4 s ASP 96 Ca 0.00 -0.95 -0.15 0.00 1.18 0.00 0.00 52.55 52.64 1jz4 s ASP 96 Cb 0.11 0.80 -0.06 0.00 -0.34 0.00 0.00 42.92 43.43 1jz4 s ASP 96 CO 0.77 -1.55 0.45 0.00 0.68 0.00 0.00 175.17 175.52 1jz4 s ALA 97 N -2.94 3.67 0.44 2.11 0.00 -1.26 -4.40 121.76 119.38 1jz4 s ALA 97 Ca 0.14 -0.19 -0.22 0.00 0.00 0.00 0.00 51.96 51.69 1jz4 s ALA 97 Cb -0.05 -2.42 -0.09 0.00 0.00 0.00 0.00 23.12 20.55 1jz4 s ALA 97 CO 0.10 0.48 1.05 -1.25 0.00 0.00 0.00 175.76 176.13 1jz4 s PRO 98 N -1.30 3.99 -0.12 0.00 0.04 -1.26 -4.99 135.00 131.35 1jz4 s PRO 98 Ca 0.27 1.45 0.00 0.00 0.04 0.00 0.00 61.00 62.77 1jz4 s PRO 98 Cb -0.17 -2.34 -0.02 0.00 0.04 0.00 0.00 34.50 32.02 1jz4 s PRO 98 CO 0.16 -0.28 -0.14 0.42 0.04 0.00 0.00 177.00 177.20 1jz4 s ILE 99 N -1.80 3.01 -0.68 0.56 1.01 -1.00 -4.68 121.20 117.63 1jz4 s ILE 99 Ca 0.62 -0.68 -0.09 0.00 0.00 0.00 0.00 60.65 60.50 1jz4 s ILE 99 Cb -0.20 -2.25 0.18 0.00 0.01 0.00 0.00 42.46 40.20 1jz4 s ILE 99 CO 0.24 0.53 0.55 -0.47 0.00 0.00 0.00 174.94 175.80 1jz4 s TYR 100 N 0.23 3.55 -0.01 3.97 5.04 -1.26 0.13 117.35 129.00 1jz4 s TYR 100 Ca -0.09 -2.26 0.06 0.00 -2.44 0.00 0.00 57.07 52.34 1jz4 s TYR 100 Cb -0.15 -3.51 -0.03 0.00 0.35 0.00 0.00 41.96 38.62 1jz4 s TYR 100 CO 0.05 -0.93 -0.19 -0.08 -1.34 0.00 0.00 175.55 173.06 1jz4 s THR 101 N 0.30 2.68 0.00 4.34 -1.32 -1.26 -0.97 115.64 119.41 1jz4 s THR 101 Ca 0.15 -1.02 0.00 0.00 -1.21 0.00 0.00 61.69 59.62 1jz4 s THR 101 Cb -0.18 -2.05 0.00 0.00 -1.51 0.00 0.00 72.50 68.76 1jz4 s THR 101 CO -0.05 0.49 0.00 -3.20 -2.21 0.00 0.00 174.62 169.65 1jz4 n ASN 102 N 2.04 0.00 -0.12 8.08 2.85 -1.26 -3.78 115.26 123.08 1jz4 n ASN 102 Ca -0.16 0.00 -0.24 0.00 -0.11 0.00 0.00 54.58 54.06 1jz4 n ASN 102 Cb 0.52 0.00 -0.10 0.00 1.24 0.00 0.00 39.78 41.44 1jz4 n ASN 102 CO 0.00 0.00 0.00 0.52 -2.11 0.00 0.00 177.26 175.67 1jz4 n VAL 103 N -1.13 1.53 -1.67 3.44 0.31 -1.26 -4.03 118.33 115.51 1jz4 n VAL 103 Ca 0.00 -0.17 -0.47 0.00 -0.01 0.00 0.00 64.34 63.69 1jz4 n VAL 103 Cb 0.00 -1.99 -0.04 0.00 -0.91 0.00 0.00 33.84 30.89 1jz4 n VAL 103 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1jz4 n THR 104 N -4.36 0.28 -1.63 2.52 -1.04 -1.26 -3.67 114.28 105.11 1jz4 n THR 104 Ca -0.41 -0.05 -0.43 0.00 -2.04 0.00 0.00 64.05 61.13 1jz4 n THR 104 Cb 0.75 -1.72 -0.00 0.00 -1.82 0.00 0.00 70.33 67.54 1jz4 n THR 104 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1jz4 n TYR 105 N 4.96 1.53 1.12 -1.42 4.02 -1.26 -4.81 117.16 121.29 1jz4 n TYR 105 Ca 0.19 0.60 0.10 0.00 -0.01 0.00 0.00 57.90 58.79 1jz4 n TYR 105 Cb 0.30 -2.29 0.56 0.00 -0.02 0.00 0.00 39.34 37.89 1jz4 n TYR 105 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1jz4 n PRO 106 N 0.43 0.46 -4.29 -0.72 -0.04 -1.26 -4.68 135.00 124.89 1jz4 n PRO 106 Ca 0.08 0.05 -0.15 0.00 -0.04 0.00 0.00 63.50 63.44 1jz4 n PRO 106 Cb 0.36 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.22 1jz4 n PRO 106 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 1jz4 s ILE 107 N -2.32 0.83 0.21 0.52 -4.36 -1.26 -5.06 121.20 109.77 1jz4 s ILE 107 Ca 0.25 -2.01 -0.32 0.00 -0.26 0.00 0.00 60.65 58.31 1jz4 s ILE 107 Cb 0.14 -2.25 -0.12 0.00 1.25 0.00 0.00 42.46 41.48 1jz4 s ILE 107 CO 0.28 -0.38 1.72 0.41 0.24 0.00 0.00 174.94 177.21 1jz4 n THR 108 N -0.33 0.05 -2.56 8.37 -1.04 -1.26 -4.88 114.28 112.62 1jz4 n THR 108 Ca -0.05 -0.01 -0.42 0.00 -2.04 0.00 0.00 64.05 61.52 1jz4 n THR 108 Cb 0.64 -1.99 -0.03 0.00 -1.82 0.00 0.00 70.33 67.13 1jz4 n THR 108 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1jz4 s VAL 109 N 1.12 3.94 -0.44 12.58 1.01 -1.26 -4.75 120.40 132.59 1jz4 s VAL 109 Ca 0.75 0.78 0.08 0.00 0.00 0.00 0.00 61.98 63.58 1jz4 s VAL 109 Cb -0.50 -4.75 0.32 0.00 0.00 0.00 0.00 36.38 31.45 1jz4 s VAL 109 CO 0.33 -1.44 1.00 -3.20 0.00 0.00 0.00 175.10 171.79 1jz4 n ASN 110 N 8.73 -1.55 -4.61 3.32 5.15 -1.26 -5.12 115.26 119.92 1jz4 n ASN 110 Ca 0.08 -3.50 -0.46 0.00 -0.60 0.00 0.00 54.58 50.09 1jz4 n ASN 110 Cb 0.49 1.26 -0.03 0.00 -0.53 0.00 0.00 39.78 40.98 1jz4 n ASN 110 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1jz4 n PRO 111 N 0.41 1.48 -0.38 1.20 -0.04 -1.26 -0.63 135.00 135.78 1jz4 n PRO 111 Ca 0.11 0.52 0.09 0.00 -0.04 0.00 0.00 63.50 64.19 1jz4 n PRO 111 Cb 0.68 -2.01 0.28 0.00 -0.04 0.00 0.00 33.50 32.41 1jz4 n PRO 111 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1jz4 n PRO 112 N 1.39 2.70 -2.03 0.54 -0.04 -1.26 -5.11 135.00 131.19 1jz4 n PRO 112 Ca 0.12 -2.29 -0.33 0.00 -0.04 0.00 0.00 63.50 60.95 1jz4 n PRO 112 Cb 0.29 -1.58 0.02 0.00 -0.04 0.00 0.00 33.50 32.19 1jz4 n PRO 112 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1jz4 s PHE 113 N -1.36 2.82 0.38 0.54 0.40 0.20 -4.39 117.98 116.57 1jz4 s PHE 113 Ca 0.42 1.54 0.06 0.00 -0.60 0.00 0.00 56.93 58.35 1jz4 s PHE 113 Cb 0.24 -3.11 -0.07 0.00 0.51 0.00 0.00 43.02 40.58 1jz4 s PHE 113 CO 0.26 -1.34 0.01 0.14 0.70 0.00 0.00 175.22 175.00 1jz4 s VAL 114 N -2.27 1.81 0.49 -0.44 -7.23 -1.26 -4.48 120.40 107.01 1jz4 s VAL 114 Ca 0.66 -2.02 -0.23 0.00 -1.81 0.00 0.00 61.98 58.59 1jz4 s VAL 114 Cb -0.19 -2.91 -0.06 0.00 0.56 0.00 0.00 36.38 33.78 1jz4 s VAL 114 CO 0.35 -0.02 1.32 -2.84 -0.31 0.00 0.00 175.10 173.60 1jz4 s PRO 115 N -3.75 3.48 0.33 4.82 0.02 -1.26 -4.90 135.00 133.74 1jz4 s PRO 115 Ca 0.35 2.16 0.06 0.00 0.02 0.00 0.00 61.00 63.59 1jz4 s PRO 115 Cb 0.09 -2.43 0.58 0.00 0.02 0.00 0.00 34.50 32.76 1jz4 s PRO 115 CO 0.17 -0.89 1.82 1.79 -0.33 0.00 0.00 177.00 179.56 1jz4 h THR 116 N 1.83 1.23 -2.48 0.99 1.35 -2.00 -3.28 112.91 110.55 1jz4 h THR 116 Ca -0.50 -1.02 -0.60 0.00 -0.55 0.00 0.00 66.41 63.73 1jz4 h THR 116 Cb 1.28 1.23 -0.12 0.00 -1.73 0.00 0.00 68.15 68.81 1jz4 h THR 116 CO 0.59 0.32 0.77 -1.61 -0.25 0.00 0.00 175.52 175.34 1jz4 s GLU 117 N -4.65 3.18 -0.29 4.72 2.02 -1.26 -4.69 118.70 117.72 1jz4 s GLU 117 Ca -0.06 -0.70 -0.02 0.00 0.02 0.00 0.00 54.97 54.21 1jz4 s GLU 117 Cb 0.15 -4.29 0.09 0.00 0.10 0.00 0.00 34.13 30.18 1jz4 s GLU 117 CO 0.76 -1.94 0.10 1.21 0.02 0.00 0.00 175.26 175.41 1jz4 s ASN 118 N 3.75 3.75 0.10 -0.19 2.47 -0.04 -4.97 114.94 119.80 1jz4 s ASN 118 Ca 0.28 -1.43 -0.36 0.00 0.42 0.00 0.00 52.86 51.77 1jz4 s ASN 118 Cb -0.13 -0.70 -0.17 0.00 -1.45 0.00 0.00 41.25 38.81 1jz4 s ASN 118 CO 0.10 -0.40 1.29 -2.65 -3.72 0.00 0.00 177.10 171.71 1jz4 n PRO 119 N 4.98 1.09 -4.19 0.43 -0.02 -1.14 -3.34 135.00 132.81 1jz4 n PRO 119 Ca -0.04 0.39 -0.33 0.00 -2.02 0.00 0.00 63.50 61.50 1jz4 n PRO 119 Cb 0.43 -2.00 -0.16 0.00 -0.02 0.00 0.00 33.50 31.75 1jz4 n PRO 119 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1jz4 s THR 120 N 0.32 2.36 -0.34 3.45 2.01 0.18 -0.53 115.64 123.09 1jz4 s THR 120 Ca 0.82 -0.85 -0.12 0.00 0.31 0.00 0.00 61.69 61.86 1jz4 s THR 120 Cb -0.95 -2.00 -0.01 0.00 0.01 0.00 0.00 72.50 69.55 1jz4 s THR 120 CO 0.48 0.52 0.22 -0.83 -0.69 0.00 0.00 174.62 174.32 1jz4 s GLY 121 N 1.22 1.94 -0.40 4.40 0.00 -0.11 -0.01 107.32 114.36 1jz4 s GLY 121 Ca 0.03 -1.44 -0.11 0.00 0.00 0.00 0.00 44.72 43.20 1jz4 s GLY 121 CO -0.09 0.77 0.24 0.00 0.00 0.00 0.00 173.10 174.03 1jz4 s TYR 123 N 1.52 2.98 0.13 0.00 1.51 -0.20 -0.82 117.35 122.47 1jz4 s TYR 123 Ca 0.02 0.05 -0.12 0.00 -1.01 0.00 0.00 57.07 56.02 1jz4 s TYR 123 Cb -0.21 -1.72 0.01 0.00 -0.11 0.00 0.00 41.96 39.93 1jz4 s TYR 123 CO 0.05 0.36 0.31 -1.54 -1.11 0.00 0.00 175.55 173.62 1jz4 s SER 124 N -0.86 -0.05 -0.24 2.29 1.04 0.20 -0.36 113.70 115.72 1jz4 s SER 124 Ca 0.13 -0.59 -0.22 0.00 0.48 0.00 0.00 55.95 55.75 1jz4 s SER 124 Cb -0.11 0.43 0.06 0.00 0.10 0.00 0.00 66.02 66.50 1jz4 s SER 124 CO 0.02 -0.84 0.64 -0.22 0.98 0.00 0.00 173.24 173.81 1jz4 s LEU 125 N -2.87 -0.44 -0.17 2.42 2.96 -0.95 -0.35 118.68 119.29 1jz4 s LEU 125 Ca 0.08 1.28 -0.08 0.00 -0.22 0.00 0.00 54.13 55.19 1jz4 s LEU 125 Cb 0.03 2.18 -0.05 0.00 0.50 0.00 0.00 46.19 48.86 1jz4 s LEU 125 CO -0.08 -0.22 0.12 -0.89 -1.32 0.00 0.00 176.35 173.97 1jz4 s THR 126 N 0.36 5.36 0.34 3.68 2.01 -1.26 -0.61 115.64 125.52 1jz4 s THR 126 Ca -0.00 0.16 -0.02 0.00 0.31 0.00 0.00 61.69 62.15 1jz4 s THR 126 Cb -0.04 -3.40 0.00 0.00 0.01 0.00 0.00 72.50 69.07 1jz4 s THR 126 CO 0.01 0.51 0.46 0.72 -0.69 0.00 0.00 174.62 175.63 1jz4 s PHE 127 N -0.16 1.12 0.22 4.92 -0.12 0.21 -4.89 117.98 119.28 1jz4 s PHE 127 Ca 0.10 -1.32 -0.11 0.00 -0.05 0.00 0.00 56.93 55.55 1jz4 s PHE 127 Cb -0.11 -0.12 -0.01 0.00 -0.63 0.00 0.00 43.02 42.14 1jz4 s PHE 127 CO 0.00 -1.12 0.40 0.54 -0.05 0.00 0.00 175.22 174.99 1jz4 s ASN 128 N -3.25 -0.05 0.32 1.98 2.20 -1.26 0.21 114.94 115.09 1jz4 s ASN 128 Ca 0.31 -0.93 0.07 0.00 -0.94 0.00 0.00 52.86 51.37 1jz4 s ASN 128 Cb -0.00 0.53 -0.06 0.00 -2.00 0.00 0.00 41.25 39.71 1jz4 s ASN 128 CO 0.21 -1.04 -0.05 0.68 -2.94 0.00 0.00 177.10 173.96 1jz4 s VAL 129 N -4.01 1.81 0.28 3.54 -7.23 -1.26 -5.03 120.40 108.49 1jz4 s VAL 129 Ca 0.22 -2.12 -0.30 0.00 -1.81 0.00 0.00 61.98 57.97 1jz4 s VAL 129 Cb 0.01 -2.62 -0.12 0.00 0.56 0.00 0.00 36.38 34.20 1jz4 s VAL 129 CO 0.06 -0.19 1.48 -0.67 -0.31 0.00 0.00 175.10 175.47 1jz4 n ASP 130 N -0.71 3.25 -0.32 4.85 -0.08 -1.26 -4.82 116.55 117.46 1jz4 n ASP 130 Ca -0.05 1.15 0.19 0.00 -1.51 0.00 0.00 54.79 54.58 1jz4 n ASP 130 Cb 0.64 -1.51 0.39 0.00 2.34 0.00 0.00 41.12 42.98 1jz4 n ASP 130 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 1jz4 h GLU 131 N 4.26 0.20 0.00 -0.67 4.57 -2.00 0.28 114.58 121.22 1jz4 h GLU 131 Ca -0.46 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 57.69 1jz4 h GLU 131 Cb 1.25 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 29.80 1jz4 h GLU 131 CO 0.76 0.13 -0.08 0.66 -1.18 0.00 0.00 179.01 179.30 1jz4 h SER 132 N 0.20 0.00 0.90 1.04 4.64 -1.96 -0.38 113.55 117.98 1jz4 h SER 132 Ca 0.65 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.88 1jz4 h SER 132 Cb 1.45 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.52 1jz4 h SER 132 CO -0.68 0.08 -0.46 -0.50 -0.87 0.00 0.00 176.83 174.40 1jz4 h TRP 133 N 0.00 0.00 -0.04 4.77 4.06 -0.67 -1.77 115.95 122.30 1jz4 h TRP 133 Ca -0.00 0.00 -0.21 0.00 2.06 0.00 0.00 58.89 60.74 1jz4 h TRP 133 Cb 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.38 1jz4 h TRP 133 CO 0.00 0.46 -0.86 -0.07 -3.56 0.00 0.00 178.44 174.41 1jz4 h LEU 134 N 0.00 0.57 0.77 -4.49 3.38 -0.97 -3.31 115.31 111.27 1jz4 h LEU 134 Ca -0.00 -0.42 -0.04 0.00 0.09 0.00 0.00 57.88 57.51 1jz4 h LEU 134 Cb 1.03 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.62 1jz4 h LEU 134 CO 0.06 1.20 -0.41 1.56 0.09 0.00 0.00 178.44 180.93 1jz4 h GLN 135 N 0.28 -1.05 -3.81 1.13 4.20 -0.89 -3.48 115.11 111.50 1jz4 h GLN 135 Ca -0.06 0.07 -0.19 0.00 0.06 0.00 0.00 58.65 58.53 1jz4 h GLN 135 Cb 1.47 0.24 -0.06 0.00 0.30 0.00 0.00 27.48 29.43 1jz4 h GLN 135 CO 0.15 -0.70 -0.07 -1.21 -0.67 0.00 0.00 178.83 176.33 1jz4 s GLU 136 N -5.47 1.96 0.00 1.46 0.41 -0.70 -5.11 118.70 111.25 1jz4 s GLU 136 Ca -0.16 -1.63 0.00 0.00 -0.41 0.00 0.00 54.97 52.76 1jz4 s GLU 136 Cb 0.02 0.49 0.00 0.00 -1.78 0.00 0.00 34.13 32.86 1jz4 s GLU 136 CO 0.50 -0.84 0.00 0.41 -0.49 0.00 0.00 175.26 174.84 1jz4 n GLY 137 N -0.54 -0.99 3.53 -1.39 0.00 -1.26 -4.54 105.19 100.00 1jz4 n GLY 137 Ca -0.02 -1.65 -0.34 0.00 0.00 0.00 0.00 46.02 44.01 1jz4 n GLY 137 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1jz4 s GLN 138 N -1.33 3.76 -0.24 1.61 0.74 0.10 -4.91 119.66 119.39 1jz4 s GLN 138 Ca 0.00 -0.47 -0.02 0.00 0.05 0.00 0.00 55.36 54.93 1jz4 s GLN 138 Cb 0.00 -3.04 0.02 0.00 1.10 0.00 0.00 33.01 31.09 1jz4 s GLN 138 CO 0.00 0.21 -0.07 0.99 -0.55 0.00 0.00 175.29 175.87 1jz4 s THR 139 N 0.49 2.87 0.28 -0.34 2.01 -1.26 0.23 115.64 119.92 1jz4 s THR 139 Ca -0.01 -0.95 0.11 0.00 0.31 0.00 0.00 61.69 61.15 1jz4 s THR 139 Cb -0.14 -2.42 -0.05 0.00 0.01 0.00 0.00 72.50 69.90 1jz4 s THR 139 CO 0.02 0.25 -0.12 0.00 -0.69 0.00 0.00 174.62 174.08 1jz4 s ARG 140 N 1.34 1.90 -0.09 4.92 1.70 0.42 0.92 118.95 130.06 1jz4 s ARG 140 Ca 0.01 -1.67 -0.01 0.00 -0.47 0.00 0.00 55.73 53.59 1jz4 s ARG 140 Cb -0.16 -1.89 -0.03 0.00 -0.57 0.00 0.00 34.95 32.30 1jz4 s ARG 140 CO -0.05 0.32 -0.04 -1.50 -1.08 0.00 0.00 175.30 172.95 1jz4 s ILE 141 N -2.46 3.95 -0.17 4.99 2.07 0.04 -1.29 121.20 128.33 1jz4 s ILE 141 Ca 0.31 -0.38 0.01 0.00 -1.41 0.00 0.00 60.65 59.18 1jz4 s ILE 141 Cb -0.05 -2.65 0.02 0.00 0.13 0.00 0.00 42.46 39.91 1jz4 s ILE 141 CO 0.17 0.59 -0.19 -0.63 -1.91 0.00 0.00 174.94 172.96 1jz4 s ILE 142 N -0.66 1.94 -0.38 2.00 1.01 0.76 -1.70 121.20 124.17 1jz4 s ILE 142 Ca 0.10 -0.87 -0.06 0.00 0.00 0.00 0.00 60.65 59.82 1jz4 s ILE 142 Cb -0.12 -1.76 0.07 0.00 0.01 0.00 0.00 42.46 40.66 1jz4 s ILE 142 CO 0.02 0.52 0.18 -0.36 0.00 0.00 0.00 174.94 175.30 1jz4 s PHE 143 N 1.26 3.36 0.34 3.97 0.40 -0.37 -1.10 117.98 125.84 1jz4 s PHE 143 Ca 0.03 -1.73 0.07 0.00 -0.60 0.00 0.00 56.93 54.70 1jz4 s PHE 143 Cb -0.13 -2.74 0.61 0.00 0.51 0.00 0.00 43.02 41.27 1jz4 s PHE 143 CO -0.11 -0.84 1.82 -0.44 0.70 0.00 0.00 175.22 176.35 1jz4 h ASP 144 N 8.23 0.29 -1.67 1.36 3.32 -1.26 0.48 116.42 127.17 1jz4 h ASP 144 Ca -0.21 -0.08 0.07 0.00 0.02 0.00 0.00 57.03 56.84 1jz4 h ASP 144 Cb 1.07 -0.08 -0.21 0.00 0.22 0.00 0.00 39.33 40.34 1jz4 h ASP 144 CO 0.68 0.53 -0.19 -0.83 -1.72 0.00 0.00 179.24 177.70 1jz4 s GLY 145 N -4.08 -0.81 -0.06 2.75 0.00 -1.26 -3.09 107.32 100.78 1jz4 s GLY 145 Ca -0.05 2.13 0.02 0.00 0.00 0.00 0.00 44.72 46.82 1jz4 s GLY 145 CO 0.76 3.15 -0.10 0.14 0.00 0.00 0.00 173.10 177.05 1jz4 s VAL 146 N 2.87 0.97 -0.14 1.40 1.01 -1.25 -0.91 120.40 124.36 1jz4 s VAL 146 Ca 0.04 -0.38 0.02 0.00 0.00 0.00 0.00 61.98 61.66 1jz4 s VAL 146 Cb -0.13 -0.91 0.01 0.00 0.00 0.00 0.00 36.38 35.35 1jz4 s VAL 146 CO -0.19 0.32 -0.20 0.21 0.00 0.00 0.00 175.10 175.24 1jz4 s ASN 147 N 0.77 2.93 -0.04 3.32 3.84 0.80 -4.08 114.94 122.49 1jz4 s ASN 147 Ca -0.13 -0.56 0.17 0.00 0.21 0.00 0.00 52.86 52.55 1jz4 s ASN 147 Cb -0.15 -1.35 -0.26 0.00 -0.55 0.00 0.00 41.25 38.93 1jz4 s ASN 147 CO 0.02 0.05 0.35 -1.54 -2.79 0.00 0.00 177.10 173.19 1jz4 n SER 148 N 4.19 1.03 -3.67 -4.21 3.41 -0.23 -1.36 113.62 112.78 1jz4 n SER 148 Ca -0.20 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.29 1jz4 n SER 148 Cb 0.51 1.71 -0.06 0.00 -0.26 0.00 0.00 64.21 66.11 1jz4 n SER 148 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1jz4 s ALA 149 N -3.13 -0.94 0.13 7.33 0.00 -1.19 -3.84 121.76 120.12 1jz4 s ALA 149 Ca -0.07 0.17 -0.23 0.00 0.00 0.00 0.00 51.96 51.84 1jz4 s ALA 149 Cb 0.10 0.44 0.06 0.00 0.00 0.00 0.00 23.12 23.72 1jz4 s ALA 149 CO 0.72 -0.50 0.57 -0.59 0.00 0.00 0.00 175.76 175.96 1jz4 s PHE 150 N -2.85 -0.49 -0.04 0.00 -0.12 -0.49 -1.60 117.98 112.38 1jz4 s PHE 150 Ca -0.03 0.33 0.01 0.00 -0.05 0.00 0.00 56.93 57.19 1jz4 s PHE 150 Cb 0.00 0.49 -0.03 0.00 -0.63 0.00 0.00 43.02 42.85 1jz4 s PHE 150 CO -0.05 -0.80 -0.04 -1.01 -0.05 0.00 0.00 175.22 173.27 1jz4 s HIS 151 N -3.49 3.01 -0.04 3.49 3.76 -0.55 -1.57 115.29 119.90 1jz4 s HIS 151 Ca 0.00 0.06 0.03 0.00 -0.15 0.00 0.00 55.06 55.00 1jz4 s HIS 151 Cb -0.00 -1.70 0.00 0.00 1.11 0.00 0.00 32.58 31.99 1jz4 s HIS 151 CO -0.10 0.40 -0.12 -1.17 -0.85 0.00 0.00 174.74 172.89 1jz4 s LEU 152 N -1.10 1.81 0.06 0.89 2.96 -0.24 0.15 118.68 123.21 1jz4 s LEU 152 Ca 0.15 -0.25 0.05 0.00 -0.22 0.00 0.00 54.13 53.86 1jz4 s LEU 152 Cb -0.11 -0.72 -0.03 0.00 0.50 0.00 0.00 46.19 45.84 1jz4 s LEU 152 CO 0.05 0.09 -0.15 0.26 -1.32 0.00 0.00 176.35 175.28 1jz4 s TRP 153 N 0.19 1.27 -0.02 5.38 0.51 -0.08 0.10 118.94 126.30 1jz4 s TRP 153 Ca -0.04 -0.40 0.02 0.00 -2.12 0.00 0.00 56.10 53.55 1jz4 s TRP 153 Cb -0.10 -0.73 0.01 0.00 -0.81 0.00 0.00 33.47 31.83 1jz4 s TRP 153 CO 0.01 0.06 -0.06 0.00 -0.51 0.00 0.00 176.95 176.45 1jz4 n ASN 155 N 3.39 -1.22 0.00 0.00 3.02 -0.13 0.94 115.26 121.26 1jz4 n ASN 155 Ca -0.19 -1.19 0.00 0.00 -0.03 0.00 0.00 54.58 53.18 1jz4 n ASN 155 Cb 0.55 -1.98 0.00 0.00 -0.61 0.00 0.00 39.78 37.74 1jz4 n ASN 155 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1jz4 n GLY 156 N -1.64 2.88 3.77 7.41 0.00 -1.25 -5.00 105.19 111.36 1jz4 n GLY 156 Ca -0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.60 1jz4 n GLY 156 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1jz4 s ARG 157 N -0.05 4.05 0.16 1.61 0.52 0.27 -4.94 118.95 120.57 1jz4 s ARG 157 Ca 0.00 0.10 -0.31 0.00 -0.52 0.00 0.00 55.73 55.00 1jz4 s ARG 157 Cb 0.00 -3.35 -0.09 0.00 0.52 0.00 0.00 34.95 32.03 1jz4 s ARG 157 CO 0.00 0.41 1.40 -0.46 0.02 0.00 0.00 175.30 176.68 1jz4 s TRP 158 N -0.07 3.19 -0.15 -0.53 -0.00 -1.26 -0.62 118.94 119.51 1jz4 s TRP 158 Ca 0.17 0.98 -0.14 0.00 -0.00 0.00 0.00 56.10 57.11 1jz4 s TRP 158 Cb -0.13 -3.72 -0.06 0.00 -0.00 0.00 0.00 33.47 29.56 1jz4 s TRP 158 CO 0.05 -2.44 -0.28 0.28 -0.00 0.00 0.00 176.95 174.55 1jz4 n VAL 159 N 3.42 1.40 -3.41 5.86 0.31 0.29 -4.91 118.33 121.30 1jz4 n VAL 159 Ca 0.10 0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.51 1jz4 n VAL 159 Cb 0.42 -2.12 0.00 0.00 -0.91 0.00 0.00 33.84 31.23 1jz4 n VAL 159 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1jz4 n GLY 160 N 1.80 1.13 3.27 2.92 0.00 -1.06 -4.73 105.19 108.53 1jz4 n GLY 160 Ca -0.18 -0.83 -0.14 0.00 0.00 0.00 0.00 46.02 44.87 1jz4 n GLY 160 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1jz4 s TYR 161 N -4.21 -0.26 0.01 1.61 5.04 -0.69 -1.08 117.35 117.77 1jz4 s TYR 161 Ca 0.00 0.45 -0.13 0.00 -2.44 0.00 0.00 57.07 54.94 1jz4 s TYR 161 Cb 0.00 0.13 0.02 0.00 0.35 0.00 0.00 41.96 42.46 1jz4 s TYR 161 CO 0.00 -0.39 0.28 0.20 -1.34 0.00 0.00 175.55 174.30 1jz4 s GLY 162 N -1.12 -0.10 0.33 8.97 0.00 -0.61 0.15 107.32 114.94 1jz4 s GLY 162 Ca -0.12 0.12 0.03 0.00 0.00 0.00 0.00 44.72 44.76 1jz4 s GLY 162 CO 0.04 -0.08 0.07 1.20 0.00 0.00 0.00 173.10 174.33 1jz4 s GLN 163 N -1.79 1.67 0.00 2.90 -0.21 -0.32 -1.39 119.66 120.52 1jz4 s GLN 163 Ca -0.11 -1.94 0.00 0.00 0.02 0.00 0.00 55.36 53.33 1jz4 s GLN 163 Cb -0.04 -0.79 0.00 0.00 1.00 0.00 0.00 33.01 33.18 1jz4 s GLN 163 CO 0.01 -0.24 0.00 -3.47 -2.12 0.00 0.00 175.29 169.47 1jz4 n ASP 164 N -0.75 -1.62 0.00 5.90 -0.08 -1.25 -4.90 116.55 113.85 1jz4 n ASP 164 Ca -0.03 0.00 0.04 0.00 -1.51 0.00 0.00 54.79 53.30 1jz4 n ASP 164 Cb 0.66 -0.81 0.20 0.00 2.34 0.00 0.00 41.12 43.51 1jz4 n ASP 164 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1jz4 n SER 165 N 0.00 0.00 -0.35 1.67 7.64 -1.26 -3.52 113.62 117.80 1jz4 n SER 165 Ca 0.00 0.38 0.03 0.00 1.01 0.00 0.00 58.87 60.30 1jz4 n SER 165 Cb 0.00 -0.43 0.07 0.00 -1.01 0.00 0.00 64.21 62.85 1jz4 n SER 165 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1jz4 n ARG 166 N -1.43 2.10 -4.11 1.43 5.12 -1.26 -3.90 116.66 114.62 1jz4 n ARG 166 Ca 0.03 -1.57 -0.15 0.00 -1.93 0.00 0.00 57.85 54.23 1jz4 n ARG 166 Cb 0.09 -1.15 -0.12 0.00 -1.16 0.00 0.00 32.46 30.13 1jz4 n ARG 166 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1jz4 s LEU 167 N -0.88 2.26 0.37 0.55 1.43 -1.23 -4.54 118.68 116.64 1jz4 s LEU 167 Ca 0.12 -0.56 -0.27 0.00 -1.03 0.00 0.00 54.13 52.39 1jz4 s LEU 167 Cb 0.07 -0.29 -0.09 0.00 0.03 0.00 0.00 46.19 45.90 1jz4 s LEU 167 CO 0.09 -0.15 1.28 -2.16 0.23 0.00 0.00 176.35 175.64 1jz4 s PRO 168 N -1.60 4.16 -0.20 1.29 0.04 -1.18 -4.59 135.00 132.92 1jz4 s PRO 168 Ca -0.07 2.14 -0.02 0.00 0.04 0.00 0.00 61.00 63.09 1jz4 s PRO 168 Cb -0.10 -2.89 -0.00 0.00 0.04 0.00 0.00 34.50 31.55 1jz4 s PRO 168 CO 0.01 -0.33 -0.09 -1.12 0.04 0.00 0.00 177.00 175.51 1jz4 s SER 169 N -0.68 3.98 -0.02 6.66 0.01 0.17 -4.95 113.70 118.87 1jz4 s SER 169 Ca 0.53 -0.44 0.07 0.00 1.31 0.00 0.00 55.95 57.42 1jz4 s SER 169 Cb -0.38 -1.66 -0.02 0.00 0.21 0.00 0.00 66.02 64.17 1jz4 s SER 169 CO 0.49 0.01 -0.22 -1.61 0.41 0.00 0.00 173.24 172.33 1jz4 s GLU 170 N 1.25 2.20 -0.00 12.44 2.02 -1.26 -1.24 118.70 134.11 1jz4 s GLU 170 Ca 0.03 -0.88 0.02 0.00 0.02 0.00 0.00 54.97 54.16 1jz4 s GLU 170 Cb -0.14 -2.14 -0.00 0.00 0.10 0.00 0.00 34.13 31.94 1jz4 s GLU 170 CO -0.04 0.57 -0.06 -0.06 0.02 0.00 0.00 175.26 175.70 1jz4 s PHE 171 N -0.68 0.50 -0.28 1.61 0.40 -0.69 -0.08 117.98 118.77 1jz4 s PHE 171 Ca 0.11 -0.10 -0.29 0.00 -0.60 0.00 0.00 56.93 56.05 1jz4 s PHE 171 Cb -0.10 -0.32 0.01 0.00 0.51 0.00 0.00 43.02 43.12 1jz4 s PHE 171 CO -0.00 -0.01 1.06 0.34 0.70 0.00 0.00 175.22 177.31 1jz4 s ASP 172 N -0.14 7.00 0.00 1.36 -1.08 -1.26 -0.78 116.67 121.77 1jz4 s ASP 172 Ca 0.02 1.18 0.23 0.00 -0.52 0.00 0.00 52.55 53.47 1jz4 s ASP 172 Cb -0.02 -2.54 0.13 0.00 -1.46 0.00 0.00 42.92 39.03 1jz4 s ASP 172 CO -0.00 -0.80 1.20 0.18 0.52 0.00 0.00 175.17 176.27 1jz4 n LEU 173 N 6.65 2.71 -0.33 -1.34 4.77 0.26 -4.60 117.00 125.13 1jz4 n LEU 173 Ca 0.12 -0.94 0.04 0.00 -0.03 0.00 0.00 56.01 55.21 1jz4 n LEU 173 Cb 0.47 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.67 1jz4 n LEU 173 CO 0.56 0.46 0.58 -1.20 -1.33 0.00 0.00 177.39 176.47 1jz4 n SER 174 N 0.97 -0.37 -0.05 -1.43 7.64 -0.95 0.64 113.62 120.08 1jz4 n SER 174 Ca 0.13 1.55 0.14 0.00 1.01 0.00 0.00 58.87 61.70 1jz4 n SER 174 Cb 0.56 -0.45 0.79 0.00 -1.01 0.00 0.00 64.21 64.09 1jz4 n SER 174 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1jz4 n ALA 175 N -3.64 2.65 0.14 -0.43 0.00 -1.26 -3.40 120.51 114.57 1jz4 n ALA 175 Ca 0.14 -0.20 0.07 0.00 0.00 0.00 0.00 53.44 53.44 1jz4 n ALA 175 Cb 0.44 -1.42 -0.10 0.00 0.00 0.00 0.00 19.45 18.36 1jz4 n ALA 175 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1jz4 n PHE 176 N -0.82 0.00 -2.12 0.00 3.01 0.21 -4.99 117.46 112.74 1jz4 n PHE 176 Ca 0.21 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 58.27 1jz4 n PHE 176 Cb 0.12 -0.25 -0.01 0.00 -0.01 0.00 0.00 39.48 39.33 1jz4 n PHE 176 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1jz4 s LEU 177 N -3.70 4.22 0.12 4.37 1.43 -1.05 -4.80 118.68 119.27 1jz4 s LEU 177 Ca -0.03 2.57 0.03 0.00 -1.03 0.00 0.00 54.13 55.67 1jz4 s LEU 177 Cb 0.09 -3.92 -0.04 0.00 0.03 0.00 0.00 46.19 42.36 1jz4 s LEU 177 CO 0.59 -0.78 -0.08 0.00 0.23 0.00 0.00 176.35 176.30 1jz4 s ARG 178 N -2.22 0.92 0.49 1.70 1.70 -1.26 -5.07 118.95 115.21 1jz4 s ARG 178 Ca 0.56 -1.36 -0.24 0.00 -0.47 0.00 0.00 55.73 54.23 1jz4 s ARG 178 Cb -0.36 -0.40 -0.07 0.00 -0.57 0.00 0.00 34.95 33.55 1jz4 s ARG 178 CO 0.46 0.03 1.36 0.00 -1.08 0.00 0.00 175.30 176.07 1jz4 s ALA 179 N -3.36 3.04 0.00 7.88 0.00 -1.26 -4.71 121.76 123.35 1jz4 s ALA 179 Ca 0.13 1.34 0.00 0.00 0.00 0.00 0.00 51.96 53.43 1jz4 s ALA 179 Cb 0.03 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.60 1jz4 s ALA 179 CO -0.02 -1.19 0.00 0.41 0.00 0.00 0.00 175.76 174.96 1jz4 n GLY 180 N 0.64 -0.62 3.74 0.00 0.00 -1.26 -4.89 105.19 102.80 1jz4 n GLY 180 Ca 0.07 -1.15 -0.41 0.00 0.00 0.00 0.00 46.02 44.53 1jz4 n GLY 180 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1jz4 s GLU 181 N 0.00 4.27 0.19 1.61 2.02 -1.26 -4.47 118.70 121.06 1jz4 s GLU 181 Ca 0.00 2.28 0.09 0.00 0.02 0.00 0.00 54.97 57.36 1jz4 s GLU 181 Cb 0.00 -3.12 -0.04 0.00 0.10 0.00 0.00 34.13 31.06 1jz4 s GLU 181 CO 0.00 -0.42 -0.19 -0.80 0.02 0.00 0.00 175.26 173.87 1jz4 s ASN 182 N 0.43 2.87 -0.11 -0.19 0.01 0.55 -4.93 114.94 113.58 1jz4 s ASN 182 Ca 0.60 -0.90 0.00 0.00 -0.71 0.00 0.00 52.86 51.85 1jz4 s ASN 182 Cb -0.41 -0.18 0.02 0.00 0.41 0.00 0.00 41.25 41.08 1jz4 s ASN 182 CO 0.42 -0.02 -0.10 -0.60 -1.51 0.00 0.00 177.10 175.29 1jz4 s ARG 183 N -2.95 1.70 0.22 -0.60 3.52 -1.26 0.64 118.95 120.22 1jz4 s ARG 183 Ca 0.19 -0.34 -0.08 0.00 -0.13 0.00 0.00 55.73 55.37 1jz4 s ARG 183 Cb -0.05 -1.64 -0.07 0.00 -1.56 0.00 0.00 34.95 31.63 1jz4 s ARG 183 CO 0.08 -0.20 0.52 -0.51 -0.81 0.00 0.00 175.30 174.38 1jz4 s LEU 184 N 1.45 4.17 -0.05 -0.88 1.43 0.22 -0.96 118.68 124.07 1jz4 s LEU 184 Ca 0.01 0.84 -0.02 0.00 -1.03 0.00 0.00 54.13 53.93 1jz4 s LEU 184 Cb -0.13 -3.60 0.03 0.00 0.03 0.00 0.00 46.19 42.52 1jz4 s LEU 184 CO -0.06 -0.06 0.09 0.00 0.23 0.00 0.00 176.35 176.54 1jz4 s ALA 185 N -1.82 0.03 -0.13 4.21 0.00 -0.77 -2.25 121.76 121.04 1jz4 s ALA 185 Ca 0.46 0.37 0.00 0.00 0.00 0.00 0.00 51.96 52.80 1jz4 s ALA 185 Cb -0.11 -0.53 0.02 0.00 0.00 0.00 0.00 23.12 22.50 1jz4 s ALA 185 CO 0.23 -0.35 -0.11 0.08 0.00 0.00 0.00 175.76 175.61 1jz4 s VAL 186 N 1.73 1.31 -0.41 0.00 1.01 0.51 -0.90 120.40 123.66 1jz4 s VAL 186 Ca -0.02 -0.47 -0.15 0.00 0.00 0.00 0.00 61.98 61.34 1jz4 s VAL 186 Cb -0.12 -1.26 0.02 0.00 0.00 0.00 0.00 36.38 35.02 1jz4 s VAL 186 CO -0.04 0.41 0.29 -0.32 0.00 0.00 0.00 175.10 175.45 1jz4 s MET 187 N 1.51 2.95 -0.25 2.72 1.75 0.12 -1.03 119.30 127.07 1jz4 s MET 187 Ca 0.03 -1.04 -0.10 0.00 -1.25 0.00 0.00 55.69 53.33 1jz4 s MET 187 Cb -0.13 -3.96 -0.05 0.00 2.84 0.00 0.00 34.83 33.53 1jz4 s MET 187 CO -0.08 -0.76 0.16 0.08 -0.65 0.00 0.00 175.02 173.77 1jz4 s VAL 188 N 1.67 5.26 -0.15 10.11 1.01 0.13 -1.48 120.40 136.93 1jz4 s VAL 188 Ca 0.05 0.15 -0.16 0.00 0.00 0.00 0.00 61.98 62.01 1jz4 s VAL 188 Cb -0.19 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.67 1jz4 s VAL 188 CO 0.10 0.31 0.40 -0.76 0.00 0.00 0.00 175.10 175.15 1jz4 s LEU 189 N 1.35 4.24 0.04 3.92 1.43 -0.62 -0.93 118.68 128.10 1jz4 s LEU 189 Ca 0.07 0.65 -0.28 0.00 -1.03 0.00 0.00 54.13 53.53 1jz4 s LEU 189 Cb -0.15 -2.55 -0.17 0.00 0.03 0.00 0.00 46.19 43.35 1jz4 s LEU 189 CO 0.07 0.01 1.45 -0.09 0.23 0.00 0.00 176.35 178.02 1jz4 h ARG 190 N 6.87 -0.59 -6.07 1.70 2.43 -1.06 -0.58 114.38 117.07 1jz4 h ARG 190 Ca -0.40 0.04 -0.65 0.00 -0.81 0.00 0.00 59.98 58.16 1jz4 h ARG 190 Cb 1.17 0.13 -0.10 0.00 -0.42 0.00 0.00 29.97 30.75 1jz4 h ARG 190 CO 0.75 -0.32 -0.59 -1.58 -1.51 0.00 0.00 179.97 176.71 1jz4 s TRP 191 N -5.44 3.23 0.33 2.20 0.52 -1.26 -3.54 118.94 114.97 1jz4 s TRP 191 Ca -0.16 0.16 -0.06 0.00 0.02 0.00 0.00 56.10 56.07 1jz4 s TRP 191 Cb 0.03 -1.70 0.01 0.00 -1.15 0.00 0.00 33.47 30.65 1jz4 s TRP 191 CO 0.58 0.53 0.50 -1.54 0.02 0.00 0.00 176.95 177.04 1jz4 s SER 192 N -1.83 0.62 0.27 2.95 1.04 -1.26 -4.87 113.70 110.60 1jz4 s SER 192 Ca 0.23 -1.35 0.21 0.00 0.48 0.00 0.00 55.95 55.53 1jz4 s SER 192 Cb -0.12 0.66 1.01 0.00 0.10 0.00 0.00 66.02 67.67 1jz4 s SER 192 CO 0.15 -1.30 1.65 -0.90 0.98 0.00 0.00 173.24 173.82 1jz4 n ASP 193 N -1.19 0.57 0.25 7.02 5.68 0.36 -0.67 116.55 128.58 1jz4 n ASP 193 Ca -0.00 0.70 0.13 0.00 -0.50 0.00 0.00 54.79 55.11 1jz4 n ASP 193 Cb 0.62 -0.80 0.59 0.00 -1.14 0.00 0.00 41.12 40.39 1jz4 n ASP 193 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1jz4 h GLY 194 N 1.20 0.00 2.00 6.12 0.00 -1.91 -2.71 103.07 107.77 1jz4 h GLY 194 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1jz4 h GLY 194 CO 0.00 0.00 -0.10 1.76 0.00 0.00 0.00 176.54 178.20 1jz4 h SER 195 N 0.00 0.00 0.35 0.19 0.02 -1.26 0.75 113.55 113.61 1jz4 h SER 195 Ca -0.00 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.91 1jz4 h SER 195 Cb 0.60 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.13 1jz4 h SER 195 CO 0.02 0.10 -0.19 1.88 -1.14 0.00 0.00 176.83 177.49 1jz4 h TYR 196 N 0.00 0.00 -0.61 3.45 -1.99 -1.62 -1.44 116.97 114.76 1jz4 h TYR 196 Ca -0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1jz4 h TYR 196 Cb 0.23 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.96 1jz4 h TYR 196 CO 0.00 0.19 0.00 1.28 -0.00 0.00 0.00 178.16 179.63 1jz4 n LEU 197 N -3.87 4.97 -2.57 3.88 4.77 0.25 -4.45 117.00 119.98 1jz4 n LEU 197 Ca -0.02 -2.60 -0.19 0.00 -0.03 0.00 0.00 56.01 53.18 1jz4 n LEU 197 Cb 0.28 -0.60 0.01 0.00 -2.33 0.00 0.00 43.42 40.78 1jz4 n LEU 197 CO 0.33 0.76 0.05 -0.62 -1.33 0.00 0.00 177.39 176.58 1jz4 n GLU 198 N 0.90 2.36 -0.80 3.23 1.02 -0.54 -0.35 120.64 126.47 1jz4 n GLU 198 Ca 0.26 -3.92 -0.15 0.00 -0.02 0.00 0.00 57.16 53.33 1jz4 n GLU 198 Cb 0.97 -1.78 0.12 0.00 -0.02 0.00 0.00 31.44 30.73 1jz4 n GLU 198 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1jz4 n ASP 199 N -0.28 3.51 -4.77 1.62 2.03 0.31 -4.96 116.55 114.01 1jz4 n ASP 199 Ca 0.25 -3.04 -0.41 0.00 0.52 0.00 0.00 54.79 52.12 1jz4 n ASP 199 Cb 0.73 -0.72 -0.01 0.00 -0.72 0.00 0.00 41.12 40.41 1jz4 n ASP 199 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 1jz4 s GLN 200 N -2.16 4.17 -1.12 -0.67 1.11 -1.26 -4.61 119.66 115.12 1jz4 s GLN 200 Ca 0.37 2.48 -0.24 0.00 0.01 0.00 0.00 55.36 57.98 1jz4 s GLN 200 Cb 0.31 -3.00 -0.15 0.00 -1.01 0.00 0.00 33.01 29.17 1jz4 s GLN 200 CO 0.07 -0.46 1.99 -3.47 0.01 0.00 0.00 175.29 173.43 1jz4 n ASP 201 N 0.74 2.46 -3.66 5.90 2.03 -1.26 -4.78 116.55 117.99 1jz4 n ASP 201 Ca 0.01 -2.63 -0.04 0.00 0.52 0.00 0.00 54.79 52.66 1jz4 n ASP 201 Cb 0.40 -1.70 -0.01 0.00 -0.72 0.00 0.00 41.12 39.09 1jz4 n ASP 201 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1jz4 s MET 202 N 7.11 1.31 0.26 -0.67 0.23 -1.25 -4.97 119.30 121.33 1jz4 s MET 202 Ca 0.72 -0.75 -0.31 0.00 -1.03 0.00 0.00 55.69 54.32 1jz4 s MET 202 Cb -0.01 0.43 -0.12 0.00 -1.53 0.00 0.00 34.83 33.59 1jz4 s MET 202 CO 0.16 -0.60 1.53 0.91 -2.03 0.00 0.00 175.02 174.98 1jz4 n TRP 203 N -0.51 2.54 -3.12 3.16 7.02 -1.26 -4.19 117.44 121.09 1jz4 n TRP 203 Ca -0.06 0.31 -0.44 0.00 -1.02 0.00 0.00 57.50 56.30 1jz4 n TRP 203 Cb 0.60 -2.55 -0.06 0.00 -2.42 0.00 0.00 31.31 26.89 1jz4 n TRP 203 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 1jz4 s ARG 204 N -0.27 3.15 0.00 -0.99 1.81 0.35 -4.92 118.95 118.08 1jz4 s ARG 204 Ca 0.67 -0.79 0.00 0.00 -1.72 0.00 0.00 55.73 53.89 1jz4 s ARG 204 Cb -0.57 -4.09 0.00 0.00 -0.45 0.00 0.00 34.95 29.85 1jz4 s ARG 204 CO 0.47 -1.25 0.00 -1.33 -0.68 0.00 0.00 175.30 172.52 1jz4 n MET 205 N 6.33 1.54 -3.53 3.54 2.81 -1.26 -2.37 117.12 124.19 1jz4 n MET 205 Ca -0.05 0.00 -0.11 0.00 -1.81 0.00 0.00 57.70 55.73 1jz4 n MET 205 Cb 0.46 0.00 -0.02 0.00 -0.71 0.00 0.00 33.22 32.95 1jz4 n MET 205 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1jz4 s SER 206 N -0.89 -0.48 0.00 7.83 1.04 -1.26 -4.84 113.70 115.09 1jz4 s SER 206 Ca 0.00 -0.14 0.00 0.00 0.48 0.00 0.00 55.95 56.29 1jz4 s SER 206 Cb 0.00 0.62 0.00 0.00 0.10 0.00 0.00 66.02 66.74 1jz4 s SER 206 CO 0.00 -1.04 0.00 0.61 0.98 0.00 0.00 173.24 173.79 1jz4 n GLY 207 N -0.39 0.78 3.26 7.32 0.00 -0.46 -0.58 105.19 115.11 1jz4 n GLY 207 Ca -0.14 -2.03 -0.44 0.00 0.00 0.00 0.00 46.02 43.42 1jz4 n GLY 207 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jz4 s ILE 208 N -1.57 5.00 -2.16 -0.61 1.01 -1.14 -0.14 121.20 121.59 1jz4 s ILE 208 Ca 0.00 -2.43 0.18 0.00 0.00 0.00 0.00 60.65 58.39 1jz4 s ILE 208 Cb 0.00 -4.15 0.13 0.00 0.01 0.00 0.00 42.46 38.45 1jz4 s ILE 208 CO 0.00 -0.96 1.05 2.22 0.00 0.00 0.00 174.94 177.25 1jz4 n PHE 209 N 4.06 0.00 -4.47 3.97 1.16 -0.09 -0.41 117.46 121.69 1jz4 n PHE 209 Ca 0.08 0.00 -0.22 0.00 -1.87 0.00 0.00 57.45 55.43 1jz4 n PHE 209 Cb 0.44 0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 38.20 1jz4 n PHE 209 CO 0.00 0.00 0.00 1.03 -1.87 0.00 0.00 176.76 175.92 1jz4 s ARG 210 N -1.48 1.70 0.71 3.97 0.52 -1.04 -4.47 118.95 118.86 1jz4 s ARG 210 Ca 0.20 -1.96 -0.16 0.00 -0.52 0.00 0.00 55.73 53.29 1jz4 s ARG 210 Cb 0.15 -0.88 0.00 0.00 0.52 0.00 0.00 34.95 34.73 1jz4 s ARG 210 CO 0.23 -0.21 0.98 -0.25 0.02 0.00 0.00 175.30 176.06 1jz4 n ASP 211 N -0.76 0.56 -4.30 0.23 8.00 -1.26 -4.32 116.55 114.69 1jz4 n ASP 211 Ca -0.03 0.69 -0.32 0.00 0.71 0.00 0.00 54.79 55.84 1jz4 n ASP 211 Cb 0.66 -1.41 -0.16 0.00 -0.02 0.00 0.00 41.12 40.20 1jz4 n ASP 211 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1jz4 s VAL 212 N -1.77 2.36 0.17 2.53 1.01 -1.26 -0.89 120.40 122.55 1jz4 s VAL 212 Ca 0.74 -0.95 -0.08 0.00 0.00 0.00 0.00 61.98 61.69 1jz4 s VAL 212 Cb -0.35 -1.90 -0.01 0.00 0.00 0.00 0.00 36.38 34.12 1jz4 s VAL 212 CO 0.50 0.56 0.28 -0.94 0.00 0.00 0.00 175.10 175.50 1jz4 s SER 213 N -0.06 0.05 -0.07 3.32 1.04 -0.26 -0.38 113.70 117.34 1jz4 s SER 213 Ca -0.06 -0.91 0.05 0.00 0.48 0.00 0.00 55.95 55.51 1jz4 s SER 213 Cb -0.14 0.44 -0.01 0.00 0.10 0.00 0.00 66.02 66.40 1jz4 s SER 213 CO 0.05 -0.90 -0.22 -0.76 0.98 0.00 0.00 173.24 172.38 1jz4 s LEU 214 N -2.98 2.24 -0.10 2.42 1.43 0.17 -0.17 118.68 121.69 1jz4 s LEU 214 Ca 0.19 -0.45 -0.00 0.00 -1.03 0.00 0.00 54.13 52.84 1jz4 s LEU 214 Cb 0.03 -1.43 0.02 0.00 0.03 0.00 0.00 46.19 44.85 1jz4 s LEU 214 CO 0.01 0.25 -0.07 -0.22 0.23 0.00 0.00 176.35 176.55 1jz4 s LEU 215 N -0.16 1.16 -0.37 1.79 2.96 -0.41 -1.02 118.68 122.64 1jz4 s LEU 215 Ca -0.03 -0.27 -0.12 0.00 -0.22 0.00 0.00 54.13 53.49 1jz4 s LEU 215 Cb -0.14 -0.79 0.02 0.00 0.50 0.00 0.00 46.19 45.78 1jz4 s LEU 215 CO 0.04 -0.11 0.22 -2.28 -1.32 0.00 0.00 176.35 172.89 1jz4 s HIS 216 N 1.63 3.23 0.28 5.38 5.65 -0.24 -0.43 115.29 130.79 1jz4 s HIS 216 Ca 0.03 -0.76 0.11 0.00 0.25 0.00 0.00 55.06 54.70 1jz4 s HIS 216 Cb -0.13 -2.45 -0.05 0.00 -1.18 0.00 0.00 32.58 28.77 1jz4 s HIS 216 CO -0.07 -0.58 -0.14 0.15 -0.65 0.00 0.00 174.74 173.46 1jz4 s LYS 217 N 1.60 1.85 0.79 2.88 -0.14 0.14 -4.84 119.74 122.02 1jz4 s LYS 217 Ca 0.03 -1.69 -0.11 0.00 -1.36 0.00 0.00 55.97 52.85 1jz4 s LYS 217 Cb -0.19 -1.87 0.07 0.00 -1.68 0.00 0.00 37.83 34.17 1jz4 s LYS 217 CO 0.07 0.32 1.09 -1.25 -0.76 0.00 0.00 175.35 174.83 1jz4 s PRO 218 N -3.56 2.08 0.12 -1.68 0.04 -1.26 0.02 135.00 130.75 1jz4 s PRO 218 Ca 0.31 1.11 -0.17 0.00 0.04 0.00 0.00 61.00 62.29 1jz4 s PRO 218 Cb -0.05 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.58 1jz4 s PRO 218 CO 0.16 -1.75 1.66 1.79 0.04 0.00 0.00 177.00 178.90 1jz4 h THR 219 N -1.21 1.19 -3.53 1.26 1.35 -1.92 -3.35 112.91 106.70 1jz4 h THR 219 Ca -0.45 -0.58 -0.67 0.00 -0.55 0.00 0.00 66.41 64.17 1jz4 h THR 219 Cb 1.24 0.94 -0.16 0.00 -1.73 0.00 0.00 68.15 68.44 1jz4 h THR 219 CO 0.52 0.20 0.05 -0.89 -0.25 0.00 0.00 175.52 175.15 1jz4 s THR 220 N -5.54 4.88 0.24 6.82 2.01 -1.25 -3.34 115.64 119.46 1jz4 s THR 220 Ca -0.13 -0.06 -0.06 0.00 0.31 0.00 0.00 61.69 61.74 1jz4 s THR 220 Cb 0.09 -4.19 -0.02 0.00 0.01 0.00 0.00 72.50 68.40 1jz4 s THR 220 CO 0.74 -0.60 0.33 0.00 -0.69 0.00 0.00 174.62 174.41 1jz4 s GLN 221 N 2.66 1.46 -0.36 4.92 -2.07 0.55 -4.91 119.66 121.92 1jz4 s GLN 221 Ca 0.19 -1.48 -0.28 0.00 -1.82 0.00 0.00 55.36 51.97 1jz4 s GLN 221 Cb -0.15 0.38 0.02 0.00 -1.09 0.00 0.00 33.01 32.17 1jz4 s GLN 221 CO 0.17 -0.56 1.03 0.42 -1.32 0.00 0.00 175.29 175.03 1jz4 s ILE 222 N -3.95 4.50 -0.09 3.63 1.01 -1.26 -1.43 121.20 123.62 1jz4 s ILE 222 Ca 0.31 1.48 0.19 0.00 0.00 0.00 0.00 60.65 62.62 1jz4 s ILE 222 Cb 0.03 -4.41 -0.29 0.00 0.01 0.00 0.00 42.46 37.80 1jz4 s ILE 222 CO 0.12 -0.57 0.44 -1.54 0.00 0.00 0.00 174.94 173.40 1jz4 n SER 223 N 6.96 0.68 -3.58 3.58 3.41 0.06 -4.91 113.62 119.82 1jz4 n SER 223 Ca 0.10 -0.07 -0.05 0.00 -0.26 0.00 0.00 58.87 58.59 1jz4 n SER 223 Cb 0.48 1.81 -0.02 0.00 -0.26 0.00 0.00 64.21 66.22 1jz4 n SER 223 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1jz4 s ASP 224 N -4.08 -0.22 -0.18 4.04 2.15 -1.07 -4.90 116.67 112.40 1jz4 s ASP 224 Ca -0.06 -0.06 -0.24 0.00 0.43 0.00 0.00 52.55 52.62 1jz4 s ASP 224 Cb 0.12 0.28 0.06 0.00 -0.30 0.00 0.00 42.92 43.08 1jz4 s ASP 224 CO 0.79 -0.47 0.64 0.72 -0.17 0.00 0.00 175.17 176.68 1jz4 s PHE 225 N -2.79 -0.67 -0.05 -5.34 -0.12 -1.26 -0.19 117.98 107.55 1jz4 s PHE 225 Ca 0.08 1.52 0.04 0.00 -0.05 0.00 0.00 56.93 58.52 1jz4 s PHE 225 Cb -0.00 0.28 0.00 0.00 -0.63 0.00 0.00 43.02 42.67 1jz4 s PHE 225 CO -0.06 -0.42 -0.15 -1.01 -0.05 0.00 0.00 175.22 173.54 1jz4 s HIS 226 N -0.14 1.57 -0.15 3.49 3.76 -0.05 -4.83 115.29 118.95 1jz4 s HIS 226 Ca -0.04 -0.47 0.01 0.00 -0.15 0.00 0.00 55.06 54.41 1jz4 s HIS 226 Cb -0.03 -1.08 0.00 0.00 1.11 0.00 0.00 32.58 32.58 1jz4 s HIS 226 CO 0.03 -0.18 -0.17 0.08 -0.85 0.00 0.00 174.74 173.65 1jz4 s VAL 227 N 0.17 2.49 0.02 -0.90 1.01 -1.26 -1.55 120.40 120.38 1jz4 s VAL 227 Ca -0.06 -0.83 0.07 0.00 0.00 0.00 0.00 61.98 61.16 1jz4 s VAL 227 Cb -0.12 -2.03 -0.02 0.00 0.00 0.00 0.00 36.38 34.20 1jz4 s VAL 227 CO 0.02 0.53 -0.21 0.00 0.00 0.00 0.00 175.10 175.43 1jz4 s ALA 228 N 0.78 1.81 -0.21 5.51 0.00 -0.50 -4.83 121.76 124.31 1jz4 s ALA 228 Ca -0.06 -1.03 -0.01 0.00 0.00 0.00 0.00 51.96 50.86 1jz4 s ALA 228 Cb -0.15 -0.39 0.06 0.00 0.00 0.00 0.00 23.12 22.63 1jz4 s ALA 228 CO -0.00 0.42 -0.01 0.95 0.00 0.00 0.00 175.76 177.12 1jz4 s THR 229 N -0.69 1.05 0.22 0.00 -4.23 -1.26 0.82 115.64 111.55 1jz4 s THR 229 Ca 0.08 -0.90 0.06 0.00 -1.18 0.00 0.00 61.69 59.75 1jz4 s THR 229 Cb -0.09 -1.43 -0.04 0.00 1.34 0.00 0.00 72.50 72.29 1jz4 s THR 229 CO 0.01 -0.15 0.20 -0.13 -0.54 0.00 0.00 174.62 174.01 1jz4 s ARG 230 N 1.62 2.98 0.22 3.99 0.52 0.49 -4.81 118.95 123.97 1jz4 s ARG 230 Ca -0.03 -0.96 0.02 0.00 -0.52 0.00 0.00 55.73 54.23 1jz4 s ARG 230 Cb -0.18 -2.63 -0.05 0.00 0.52 0.00 0.00 34.95 32.61 1jz4 s ARG 230 CO -0.07 0.43 0.05 -0.06 0.02 0.00 0.00 175.30 175.67 1jz4 s PHE 231 N -2.01 1.40 0.78 -0.53 0.40 -1.26 -1.10 117.98 115.67 1jz4 s PHE 231 Ca 0.32 -1.10 -0.07 0.00 -0.60 0.00 0.00 56.93 55.49 1jz4 s PHE 231 Cb -0.09 -0.81 0.13 0.00 0.51 0.00 0.00 43.02 42.76 1jz4 s PHE 231 CO 0.25 -0.27 1.09 0.54 0.70 0.00 0.00 175.22 177.53 1jz4 s ASN 232 N -3.25 4.11 0.39 1.36 4.22 -0.10 -4.90 114.94 116.76 1jz4 s ASN 232 Ca 0.32 0.03 0.16 0.00 -2.14 0.00 0.00 52.86 51.22 1jz4 s ASN 232 Cb 0.07 -0.39 1.03 0.00 1.28 0.00 0.00 41.25 43.24 1jz4 s ASN 232 CO 0.09 -2.04 1.82 -2.24 -2.04 0.00 0.00 177.10 172.69 1jz4 h ASP 233 N -0.86 0.49 -0.33 3.54 2.03 -2.02 -1.59 116.42 117.67 1jz4 h ASP 233 Ca -0.41 0.06 0.00 0.00 -0.73 0.00 0.00 57.03 55.95 1jz4 h ASP 233 Cb 1.27 -0.02 0.00 0.00 -0.83 0.00 0.00 39.33 39.74 1jz4 h ASP 233 CO 0.45 0.17 0.00 -0.90 -1.03 0.00 0.00 179.24 177.92 1jz4 n ASP 234 N -4.58 3.40 -0.60 4.15 5.68 -1.26 -4.97 116.55 118.37 1jz4 n ASP 234 Ca 0.22 -2.41 -0.08 0.00 -0.50 0.00 0.00 54.79 52.02 1jz4 n ASP 234 Cb 0.72 -0.37 -0.03 0.00 -1.14 0.00 0.00 41.12 40.30 1jz4 n ASP 234 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 1jz4 n PHE 235 N 0.17 0.00 0.69 2.11 3.01 -0.60 -4.84 117.46 118.00 1jz4 n PHE 235 Ca 0.16 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.74 1jz4 n PHE 235 Cb 0.63 -1.96 0.23 0.00 -0.01 0.00 0.00 39.48 38.37 1jz4 n PHE 235 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1jz4 n SER 236 N -0.39 0.63 -4.07 4.37 3.41 -1.26 -4.42 113.62 111.88 1jz4 n SER 236 Ca -0.08 0.10 -0.19 0.00 -0.26 0.00 0.00 58.87 58.44 1jz4 n SER 236 Cb 0.40 0.08 -0.14 0.00 -0.26 0.00 0.00 64.21 64.29 1jz4 n SER 236 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1jz4 s ARG 237 N -3.12 0.80 0.04 4.33 0.52 -1.26 0.18 118.95 120.43 1jz4 s ARG 237 Ca 0.08 -0.52 0.01 0.00 -0.52 0.00 0.00 55.73 54.78 1jz4 s ARG 237 Cb 0.14 -0.76 -0.03 0.00 0.52 0.00 0.00 34.95 34.83 1jz4 s ARG 237 CO 0.70 0.20 -0.05 0.00 0.02 0.00 0.00 175.30 176.17 1jz4 s ALA 238 N -0.54 0.41 -0.19 2.13 0.00 -0.44 -0.93 121.76 122.20 1jz4 s ALA 238 Ca 0.02 -0.81 0.01 0.00 0.00 0.00 0.00 51.96 51.18 1jz4 s ALA 238 Cb -0.06 0.13 0.02 0.00 0.00 0.00 0.00 23.12 23.22 1jz4 s ALA 238 CO 0.00 -0.15 -0.18 0.08 0.00 0.00 0.00 175.76 175.52 1jz4 s VAL 239 N -1.97 2.19 -0.24 0.00 1.01 -0.26 -0.10 120.40 121.04 1jz4 s VAL 239 Ca -0.08 -0.97 -0.15 0.00 0.00 0.00 0.00 61.98 60.77 1jz4 s VAL 239 Cb -0.06 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 1jz4 s VAL 239 CO -0.02 0.47 0.39 -0.22 0.00 0.00 0.00 175.10 175.72 1jz4 s LEU 240 N 1.29 4.08 -0.17 3.92 0.20 -0.42 -0.38 118.68 127.21 1jz4 s LEU 240 Ca 0.04 0.38 0.01 0.00 0.69 0.00 0.00 54.13 55.25 1jz4 s LEU 240 Cb -0.14 -2.47 0.02 0.00 -0.43 0.00 0.00 46.19 43.17 1jz4 s LEU 240 CO -0.11 -0.15 -0.20 -0.70 -0.29 0.00 0.00 176.35 174.90 1jz4 s GLU 241 N 1.79 2.90 -0.21 1.98 2.12 0.24 -0.65 118.70 126.88 1jz4 s GLU 241 Ca 0.17 -0.80 0.02 0.00 0.36 0.00 0.00 54.97 54.71 1jz4 s GLU 241 Cb -0.15 -2.47 0.04 0.00 0.26 0.00 0.00 34.13 31.80 1jz4 s GLU 241 CO 0.09 -0.17 -0.15 0.00 -0.54 0.00 0.00 175.26 174.49 1jz4 s ALA 242 N 1.20 2.33 -0.06 6.30 0.00 0.08 -1.41 121.76 130.19 1jz4 s ALA 242 Ca 0.02 -1.38 -0.22 0.00 0.00 0.00 0.00 51.96 50.38 1jz4 s ALA 242 Cb -0.14 -1.32 -0.04 0.00 0.00 0.00 0.00 23.12 21.62 1jz4 s ALA 242 CO -0.10 -0.70 0.65 -2.00 0.00 0.00 0.00 175.76 173.61 1jz4 s GLU 243 N 1.26 4.41 -0.11 0.00 2.12 -0.60 -0.76 118.70 125.02 1jz4 s GLU 243 Ca -0.00 0.79 0.03 0.00 0.36 0.00 0.00 54.97 56.15 1jz4 s GLU 243 Cb -0.16 -3.43 -0.00 0.00 0.26 0.00 0.00 34.13 30.80 1jz4 s GLU 243 CO -0.10 0.13 -0.22 0.08 -0.54 0.00 0.00 175.26 174.62 1jz4 s VAL 244 N 0.59 2.20 0.04 3.70 1.01 0.12 -0.87 120.40 127.19 1jz4 s VAL 244 Ca 0.35 -0.97 0.03 0.00 0.00 0.00 0.00 61.98 61.39 1jz4 s VAL 244 Cb -0.17 -1.85 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 1jz4 s VAL 244 CO 0.17 0.55 -0.02 -1.10 0.00 0.00 0.00 175.10 174.71 1jz4 s GLN 245 N 0.40 2.61 0.32 2.72 -0.21 0.73 -1.73 119.66 124.49 1jz4 s GLN 245 Ca -0.17 -0.75 0.08 0.00 0.02 0.00 0.00 55.36 54.55 1jz4 s GLN 245 Cb -0.17 -2.57 -0.06 0.00 1.00 0.00 0.00 33.01 31.20 1jz4 s GLN 245 CO 0.07 0.58 -0.08 0.00 -2.12 0.00 0.00 175.29 173.74 1jz4 s MET 246 N -1.88 1.73 0.12 2.91 0.23 0.27 -0.76 119.30 121.92 1jz4 s MET 246 Ca 0.22 -1.89 0.07 0.00 -1.03 0.00 0.00 55.69 53.06 1jz4 s MET 246 Cb -0.11 -1.50 -0.04 0.00 -1.53 0.00 0.00 34.83 31.64 1jz4 s MET 246 CO 0.13 0.10 -0.18 0.00 -2.03 0.00 0.00 175.02 173.05 1jz4 n GLY 248 N 0.71 -1.56 3.69 0.00 0.00 -1.21 -0.33 105.19 106.49 1jz4 n GLY 248 Ca -0.17 -2.12 -0.42 0.00 0.00 0.00 0.00 46.02 43.32 1jz4 n GLY 248 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1jz4 s GLU 249 N -0.14 4.42 0.19 1.61 2.12 -1.26 -4.94 118.70 120.69 1jz4 s GLU 249 Ca 0.00 1.21 -0.30 0.00 0.36 0.00 0.00 54.97 56.25 1jz4 s GLU 249 Cb 0.00 -3.52 -0.08 0.00 0.26 0.00 0.00 34.13 30.79 1jz4 s GLU 249 CO 0.00 -0.20 1.13 -0.51 -0.54 0.00 0.00 175.26 175.14 1jz4 s LEU 250 N 1.65 4.48 0.00 2.70 1.43 -1.26 -4.95 118.68 122.74 1jz4 s LEU 250 Ca 0.45 2.15 -0.01 0.00 -1.03 0.00 0.00 54.13 55.69 1jz4 s LEU 250 Cb -0.18 -3.61 -0.01 0.00 0.03 0.00 0.00 46.19 42.42 1jz4 s LEU 250 CO 0.19 -0.27 0.01 -0.13 0.23 0.00 0.00 176.35 176.38 1jz4 s ARG 251 N -0.40 0.19 0.60 1.70 1.81 -1.26 -5.01 118.95 116.58 1jz4 s ARG 251 Ca 0.50 -0.29 0.31 0.00 -1.72 0.00 0.00 55.73 54.53 1jz4 s ARG 251 Cb -0.31 0.07 1.86 0.00 -0.45 0.00 0.00 34.95 36.12 1jz4 s ARG 251 CO 0.36 -0.03 2.25 -0.44 -0.68 0.00 0.00 175.30 176.76 1jz4 h ASP 252 N 5.30 0.00 0.36 0.23 3.32 -2.02 -2.30 116.42 121.32 1jz4 h ASP 252 Ca -0.28 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.77 1jz4 h ASP 252 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 1jz4 h ASP 252 CO 0.45 0.00 -0.08 0.00 -1.72 0.00 0.00 179.24 177.89 1jz4 n TYR 253 N -3.79 0.00 -2.55 4.55 0.18 -1.26 -4.88 117.16 109.41 1jz4 n TYR 253 Ca -0.03 0.00 -0.36 0.00 1.88 0.00 0.00 57.90 59.39 1jz4 n TYR 253 Cb 0.10 -0.18 -0.04 0.00 -0.38 0.00 0.00 39.34 38.84 1jz4 n TYR 253 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 1jz4 s LEU 254 N -2.45 4.14 0.06 -3.48 1.43 -0.87 0.11 118.68 117.64 1jz4 s LEU 254 Ca 0.30 2.03 -0.02 0.00 -1.03 0.00 0.00 54.13 55.41 1jz4 s LEU 254 Cb 0.20 -4.18 -0.03 0.00 0.03 0.00 0.00 46.19 42.21 1jz4 s LEU 254 CO 0.46 -0.48 0.02 -0.13 0.23 0.00 0.00 176.35 176.45 1jz4 s ARG 255 N -2.49 0.68 -0.09 1.70 1.81 -0.49 -3.93 118.95 116.14 1jz4 s ARG 255 Ca 0.58 -1.19 0.03 0.00 -1.72 0.00 0.00 55.73 53.42 1jz4 s ARG 255 Cb -0.22 0.24 0.01 0.00 -0.45 0.00 0.00 34.95 34.52 1jz4 s ARG 255 CO 0.27 -0.15 -0.19 0.08 -0.68 0.00 0.00 175.30 174.63 1jz4 s VAL 256 N -3.92 1.68 -0.06 3.52 1.01 -0.43 -1.24 120.40 120.96 1jz4 s VAL 256 Ca 0.08 -0.79 0.05 0.00 0.00 0.00 0.00 61.98 61.32 1jz4 s VAL 256 Cb 0.07 -1.48 -0.01 0.00 0.00 0.00 0.00 36.38 34.96 1jz4 s VAL 256 CO -0.09 0.48 -0.22 -0.89 0.00 0.00 0.00 175.10 174.37 1jz4 s THR 257 N 0.51 2.31 -0.11 3.92 2.01 -0.89 -1.35 115.64 122.03 1jz4 s THR 257 Ca -0.16 -0.98 0.03 0.00 0.31 0.00 0.00 61.69 60.89 1jz4 s THR 257 Cb -0.17 -1.86 0.01 0.00 0.01 0.00 0.00 72.50 70.49 1jz4 s THR 257 CO 0.06 0.57 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.65 1jz4 s VAL 258 N -0.27 1.97 -0.02 3.82 1.01 0.17 -1.73 120.40 125.35 1jz4 s VAL 258 Ca 0.00 -0.95 0.07 0.00 0.00 0.00 0.00 61.98 61.11 1jz4 s VAL 258 Cb -0.13 -1.73 -0.02 0.00 0.00 0.00 0.00 36.38 34.51 1jz4 s VAL 258 CO 0.03 0.54 -0.24 -0.44 0.00 0.00 0.00 175.10 174.98 1jz4 s SER 259 N 0.59 2.88 -0.16 3.32 0.01 -0.57 -0.25 113.70 119.51 1jz4 s SER 259 Ca -0.13 -0.45 -0.03 0.00 1.31 0.00 0.00 55.95 56.65 1jz4 s SER 259 Cb -0.17 -0.35 -0.02 0.00 0.21 0.00 0.00 66.02 65.69 1jz4 s SER 259 CO 0.04 0.30 -0.06 -0.22 0.41 0.00 0.00 173.24 173.70 1jz4 s LEU 260 N -0.55 3.04 -0.02 2.44 2.96 0.96 -0.84 118.68 126.67 1jz4 s LEU 260 Ca 0.09 -0.24 0.07 0.00 -0.22 0.00 0.00 54.13 53.83 1jz4 s LEU 260 Cb -0.10 -1.73 -0.02 0.00 0.50 0.00 0.00 46.19 44.84 1jz4 s LEU 260 CO -0.01 0.13 -0.24 0.26 -1.32 0.00 0.00 176.35 175.17 1jz4 s TRP 261 N 0.61 2.16 -0.48 5.38 0.52 0.19 -0.17 118.94 127.14 1jz4 s TRP 261 Ca -0.04 -0.41 -0.00 0.00 0.02 0.00 0.00 56.10 55.67 1jz4 s TRP 261 Cb -0.15 -1.39 0.13 0.00 -1.15 0.00 0.00 33.47 30.91 1jz4 s TRP 261 CO 0.03 -0.03 0.26 -1.14 0.02 0.00 0.00 176.95 176.08 1jz4 s GLN 262 N -0.58 2.08 6.64 4.98 0.74 0.22 -0.29 119.66 133.44 1jz4 s GLN 262 Ca 0.09 -2.20 0.00 0.00 0.05 0.00 0.00 55.36 53.30 1jz4 s GLN 262 Cb -0.09 -3.51 0.00 0.00 1.10 0.00 0.00 33.01 30.50 1jz4 s GLN 262 CO -0.01 -1.09 0.00 0.41 -0.55 0.00 0.00 175.29 174.05 1jz4 n GLY 263 N 3.92 2.61 0.73 2.59 0.00 -1.26 -1.25 105.19 112.52 1jz4 n GLY 263 Ca 0.03 -0.36 0.05 0.00 0.00 0.00 0.00 46.02 45.74 1jz4 n GLY 263 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1jz4 n GLU 264 N 13.51 1.99 -4.70 1.61 1.02 -1.26 -4.81 120.64 128.00 1jz4 n GLU 264 Ca 0.00 -1.23 -0.33 0.00 -0.02 0.00 0.00 57.16 55.58 1jz4 n GLU 264 Cb 0.00 -1.40 -0.14 0.00 -0.02 0.00 0.00 31.44 29.88 1jz4 n GLU 264 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1jz4 s THR 265 N -1.62 3.05 -0.40 2.62 2.01 -0.38 -5.06 115.64 115.87 1jz4 s THR 265 Ca 0.22 -0.66 -0.28 0.00 0.31 0.00 0.00 61.69 61.29 1jz4 s THR 265 Cb 0.13 -2.29 0.02 0.00 0.01 0.00 0.00 72.50 70.37 1jz4 s THR 265 CO 0.13 0.52 1.03 -1.58 -0.69 0.00 0.00 174.62 174.02 1jz4 s GLN 266 N 0.45 3.83 0.10 4.92 0.74 -1.26 0.70 119.66 129.14 1jz4 s GLN 266 Ca -0.09 0.65 0.23 0.00 0.05 0.00 0.00 55.36 56.20 1jz4 s GLN 266 Cb -0.16 -3.83 0.13 0.00 1.10 0.00 0.00 33.01 30.25 1jz4 s GLN 266 CO 0.05 -1.10 1.11 1.33 -0.55 0.00 0.00 175.29 176.13 1jz4 n VAL 267 N 6.26 0.33 -3.57 1.34 0.24 0.76 -4.97 118.33 118.72 1jz4 n VAL 267 Ca 0.10 -0.33 -0.06 0.00 -2.04 0.00 0.00 64.34 62.00 1jz4 n VAL 267 Cb 0.48 -0.04 -0.03 0.00 -1.47 0.00 0.00 33.84 32.79 1jz4 n VAL 267 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1jz4 s ALA 268 N -3.24 -1.98 0.04 2.33 0.00 -1.08 -4.98 121.76 112.85 1jz4 s ALA 268 Ca 0.03 1.44 -0.27 0.00 0.00 0.00 0.00 51.96 53.16 1jz4 s ALA 268 Cb 0.13 -0.12 0.08 0.00 0.00 0.00 0.00 23.12 23.21 1jz4 s ALA 268 CO 0.77 -0.56 0.71 0.45 0.00 0.00 0.00 175.76 177.13 1jz4 s SER 269 N -2.06 -0.54 -0.13 0.00 0.15 -1.26 -0.03 113.70 109.83 1jz4 s SER 269 Ca 0.07 0.24 -0.11 0.00 0.70 0.00 0.00 55.95 56.85 1jz4 s SER 269 Cb -0.01 0.52 0.03 0.00 -1.71 0.00 0.00 66.02 64.85 1jz4 s SER 269 CO -0.05 -0.75 0.33 -0.83 1.20 0.00 0.00 173.24 173.14 1jz4 s GLY 270 N -2.10 -0.25 0.03 9.45 0.00 0.66 -4.92 107.32 110.18 1jz4 s GLY 270 Ca -0.02 0.96 0.05 0.00 0.00 0.00 0.00 44.72 45.70 1jz4 s GLY 270 CO -0.04 0.84 -0.14 -1.59 0.00 0.00 0.00 173.10 172.17 1jz4 s THR 271 N 0.22 1.08 0.06 0.90 2.01 -1.26 0.43 115.64 119.08 1jz4 s THR 271 Ca -0.00 -0.94 -0.27 0.00 0.31 0.00 0.00 61.69 60.79 1jz4 s THR 271 Cb -0.03 -0.97 0.09 0.00 0.01 0.00 0.00 72.50 71.60 1jz4 s THR 271 CO 0.00 0.03 0.76 0.00 -0.69 0.00 0.00 174.62 174.71 1jz4 s ALA 272 N -0.80 -1.73 0.80 7.40 0.00 -0.46 -5.01 121.76 121.97 1jz4 s ALA 272 Ca 0.02 0.84 -0.12 0.00 0.00 0.00 0.00 51.96 52.69 1jz4 s ALA 272 Cb -0.08 0.54 0.08 0.00 0.00 0.00 0.00 23.12 23.66 1jz4 s ALA 272 CO 0.01 -0.68 1.17 -1.25 0.00 0.00 0.00 175.76 175.01 1jz4 s PRO 273 N -3.17 2.01 0.67 0.00 0.04 -1.26 -1.32 135.00 131.97 1jz4 s PRO 273 Ca 0.02 0.15 -0.12 0.00 0.04 0.00 0.00 61.00 61.08 1jz4 s PRO 273 Cb -0.01 -1.95 -0.00 0.00 0.04 0.00 0.00 34.50 32.57 1jz4 s PRO 273 CO -0.09 -1.57 1.06 -0.06 0.04 0.00 0.00 177.00 176.38 1jz4 s PHE 274 N -3.55 3.07 0.00 0.56 0.40 -1.25 -4.81 117.98 112.39 1jz4 s PHE 274 Ca 0.62 1.45 0.00 0.00 -0.60 0.00 0.00 56.93 58.40 1jz4 s PHE 274 Cb -0.11 -2.92 0.00 0.00 0.51 0.00 0.00 43.02 40.50 1jz4 s PHE 274 CO 0.49 -1.20 0.00 0.41 0.70 0.00 0.00 175.22 175.62 1jz4 n GLY 275 N -1.69 1.79 3.94 4.36 0.00 0.17 -4.96 105.19 108.79 1jz4 n GLY 275 Ca 0.08 -0.46 -0.29 0.00 0.00 0.00 0.00 46.02 45.35 1jz4 n GLY 275 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1jz4 s GLY 276 N 0.00 1.75 0.64 -0.02 0.00 -0.22 -4.84 107.32 104.62 1jz4 s GLY 276 Ca 0.00 -1.19 -0.17 0.00 0.00 0.00 0.00 44.72 43.36 1jz4 s GLY 276 CO 0.00 -0.50 0.69 -1.84 0.00 0.00 0.00 173.10 171.45 1jz4 n GLU 277 N -3.54 0.55 -1.97 2.90 0.00 -1.26 -4.51 120.64 112.80 1jz4 n GLU 277 Ca 0.14 0.22 -0.41 0.00 0.00 0.00 0.00 57.16 57.11 1jz4 n GLU 277 Cb 0.60 -1.92 -0.02 0.00 0.00 0.00 0.00 31.44 30.10 1jz4 n GLU 277 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 1jz4 s ILE 278 N -1.73 2.51 -0.05 3.84 1.01 -1.26 -4.16 121.20 121.36 1jz4 s ILE 278 Ca 0.71 0.45 0.07 0.00 0.00 0.00 0.00 60.65 61.87 1jz4 s ILE 278 Cb -0.40 -3.29 -0.10 0.00 0.01 0.00 0.00 42.46 38.69 1jz4 s ILE 278 CO 0.53 0.08 0.06 2.30 0.00 0.00 0.00 174.94 177.91 1jz4 n ILE 279 N 1.90 0.36 -3.13 2.92 -5.35 0.21 -4.87 119.36 111.40 1jz4 n ILE 279 Ca 0.05 -0.27 0.00 0.00 -0.27 0.00 0.00 62.75 62.27 1jz4 n ILE 279 Cb 0.40 -0.52 0.00 0.00 -1.74 0.00 0.00 39.64 37.78 1jz4 n ILE 279 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 1jz4 n ASP 280 N -2.13 0.00 0.11 7.28 5.68 -0.93 -5.01 116.55 121.54 1jz4 n ASP 280 Ca -0.09 -0.99 0.20 0.00 -0.50 0.00 0.00 54.79 53.41 1jz4 n ASP 280 Cb 0.59 0.00 0.72 0.00 -1.14 0.00 0.00 41.12 41.29 1jz4 n ASP 280 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1jz4 h GLU 281 N 0.00 0.00 -0.63 0.11 3.07 -2.05 -1.58 114.58 113.50 1jz4 h GLU 281 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1jz4 h GLU 281 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1jz4 h GLU 281 CO 0.00 0.00 0.00 0.54 -1.40 0.00 0.00 179.01 178.15 1jz4 n ARG 282 N -3.52 2.57 0.00 2.33 5.12 -1.26 -5.08 116.66 116.82 1jz4 n ARG 282 Ca 0.07 -2.43 0.00 0.00 -1.93 0.00 0.00 57.85 53.56 1jz4 n ARG 282 Cb 0.67 -1.53 0.00 0.00 -1.16 0.00 0.00 32.46 30.43 1jz4 n ARG 282 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1jz4 n GLY 283 N 1.58 0.67 0.00 -0.13 0.00 -0.60 -5.05 105.19 101.67 1jz4 n GLY 283 Ca 0.22 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.56 1jz4 n GLY 283 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jz4 n GLY 284 N 0.00 4.98 3.49 -0.02 0.00 -1.26 0.63 105.19 113.02 1jz4 n GLY 284 Ca 0.00 -1.83 -0.43 0.00 0.00 0.00 0.00 46.02 43.76 1jz4 n GLY 284 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1jz4 s TYR 285 N -0.99 3.10 -0.80 1.61 1.51 -1.26 -4.92 117.35 115.59 1jz4 s TYR 285 Ca 0.00 -0.29 0.25 0.00 -1.01 0.00 0.00 57.07 56.02 1jz4 s TYR 285 Cb 0.00 -3.24 0.94 0.00 -0.11 0.00 0.00 41.96 39.55 1jz4 s TYR 285 CO 0.00 -0.85 1.77 0.00 -1.11 0.00 0.00 175.55 175.35 1jz4 n ALA 286 N 6.01 2.09 -0.69 3.71 0.00 -1.26 -1.06 120.51 129.32 1jz4 n ALA 286 Ca -0.05 -0.03 0.09 0.00 0.00 0.00 0.00 53.44 53.45 1jz4 n ALA 286 Cb 0.47 -1.42 0.34 0.00 0.00 0.00 0.00 19.45 18.84 1jz4 n ALA 286 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1jz4 n ASP 287 N -1.92 4.72 -4.24 0.00 5.75 -1.26 -3.40 116.55 116.19 1jz4 n ASP 287 Ca 0.05 -2.57 -0.13 0.00 -0.01 0.00 0.00 54.79 52.13 1jz4 n ASP 287 Cb 0.33 -0.57 -0.10 0.00 -1.03 0.00 0.00 41.12 39.75 1jz4 n ASP 287 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1jz4 s ARG 288 N -2.06 1.11 -0.07 0.11 0.52 -1.19 -0.57 118.95 116.80 1jz4 s ARG 288 Ca 0.49 -1.54 -0.28 0.00 -0.52 0.00 0.00 55.73 53.88 1jz4 s ARG 288 Cb 0.33 -0.25 0.06 0.00 0.52 0.00 0.00 34.95 35.62 1jz4 s ARG 288 CO 0.21 -0.14 0.64 0.54 0.02 0.00 0.00 175.30 176.57 1jz4 s VAL 289 N -3.67 0.01 -0.13 3.52 0.11 -0.71 0.43 120.40 119.96 1jz4 s VAL 289 Ca 0.24 -0.05 0.02 0.00 -2.93 0.00 0.00 61.98 59.27 1jz4 s VAL 289 Cb 0.06 -0.95 0.01 0.00 -1.53 0.00 0.00 36.38 33.97 1jz4 s VAL 289 CO 0.04 -0.03 -0.20 -0.89 -3.33 0.00 0.00 175.10 170.70 1jz4 s THR 290 N -1.01 1.87 0.01 5.04 2.01 -1.26 0.14 115.64 122.43 1jz4 s THR 290 Ca -0.10 -0.87 -0.02 0.00 0.31 0.00 0.00 61.69 61.02 1jz4 s THR 290 Cb -0.01 -1.66 -0.04 0.00 0.01 0.00 0.00 72.50 70.80 1jz4 s THR 290 CO 0.08 0.51 0.19 -0.76 -0.69 0.00 0.00 174.62 173.95 1jz4 s LEU 291 N 0.84 4.35 -0.13 4.42 2.01 0.06 -4.93 118.68 125.29 1jz4 s LEU 291 Ca -0.08 0.32 0.01 0.00 0.01 0.00 0.00 54.13 54.38 1jz4 s LEU 291 Cb -0.15 -2.70 0.02 0.00 0.01 0.00 0.00 46.19 43.37 1jz4 s LEU 291 CO -0.01 0.24 -0.13 -0.13 1.01 0.00 0.00 176.35 177.33 1jz4 s ARG 292 N -2.09 2.11 -0.13 1.70 0.52 -1.26 -0.74 118.95 119.06 1jz4 s ARG 292 Ca 0.29 -0.49 0.02 0.00 -0.52 0.00 0.00 55.73 55.03 1jz4 s ARG 292 Cb -0.13 -1.93 -0.00 0.00 0.52 0.00 0.00 34.95 33.41 1jz4 s ARG 292 CO 0.21 -0.19 -0.19 -0.51 0.02 0.00 0.00 175.30 174.64 1jz4 s LEU 293 N 1.38 2.33 0.14 2.53 1.02 0.18 -4.83 118.68 121.43 1jz4 s LEU 293 Ca 0.02 -0.49 -0.29 0.00 0.02 0.00 0.00 54.13 53.38 1jz4 s LEU 293 Cb -0.13 -1.50 -0.07 0.00 0.02 0.00 0.00 46.19 44.51 1jz4 s LEU 293 CO -0.08 0.13 0.93 0.20 0.02 0.00 0.00 176.35 177.56 1jz4 s ASN 294 N 0.52 7.51 -0.16 2.29 -0.87 -1.26 -1.30 114.94 121.66 1jz4 s ASN 294 Ca -0.12 1.80 -0.01 0.00 -1.57 0.00 0.00 52.86 52.96 1jz4 s ASN 294 Cb -0.17 -2.58 0.04 0.00 -0.02 0.00 0.00 41.25 38.53 1jz4 s ASN 294 CO 0.05 0.01 -0.03 -0.69 -2.57 0.00 0.00 177.10 173.86 1jz4 s VAL 295 N -0.34 0.95 0.11 1.60 1.01 0.86 -4.88 120.40 119.71 1jz4 s VAL 295 Ca 0.44 -0.57 -0.28 0.00 0.00 0.00 0.00 61.98 61.58 1jz4 s VAL 295 Cb -0.24 -1.19 -0.06 0.00 0.00 0.00 0.00 36.38 34.89 1jz4 s VAL 295 CO 0.30 0.07 0.87 -1.61 0.00 0.00 0.00 175.10 174.72 1jz4 s GLU 296 N 1.70 4.62 -1.31 2.72 0.41 -1.26 -1.33 118.70 124.25 1jz4 s GLU 296 Ca 0.01 1.28 -0.19 0.00 -0.41 0.00 0.00 54.97 55.65 1jz4 s GLU 296 Cb -0.15 -3.35 0.02 0.00 -1.78 0.00 0.00 34.13 28.87 1jz4 s GLU 296 CO -0.07 0.31 0.50 0.09 -0.49 0.00 0.00 175.26 175.59 1jz4 n ASN 297 N 2.53 -2.54 -4.78 -0.19 4.13 0.46 -4.87 115.26 110.01 1jz4 n ASN 297 Ca -0.01 -1.21 -0.33 0.00 1.68 0.00 0.00 54.58 54.72 1jz4 n ASN 297 Cb 0.49 -2.13 0.05 0.00 -1.54 0.00 0.00 39.78 36.65 1jz4 n ASN 297 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1jz4 s PRO 298 N -7.06 2.76 -0.35 3.52 0.04 -1.26 -4.94 135.00 127.71 1jz4 s PRO 298 Ca 0.30 1.32 -0.29 0.00 0.04 0.00 0.00 61.00 62.37 1jz4 s PRO 298 Cb -0.15 -1.95 0.01 0.00 0.04 0.00 0.00 34.50 32.45 1jz4 s PRO 298 CO 0.95 -1.27 1.27 0.15 0.04 0.00 0.00 177.00 178.14 1jz4 s LYS 299 N -4.27 3.84 0.18 4.56 1.02 -1.26 -5.00 119.74 118.82 1jz4 s LYS 299 Ca 0.65 1.07 -0.25 0.00 0.02 0.00 0.00 55.97 57.46 1jz4 s LYS 299 Cb -0.19 -3.89 -0.08 0.00 -0.52 0.00 0.00 37.83 33.14 1jz4 s LYS 299 CO 0.44 -1.22 0.79 -0.51 -0.92 0.00 0.00 175.35 173.94 1jz4 s LEU 300 N 4.50 4.57 0.05 3.17 1.43 -1.26 -4.41 118.68 126.73 1jz4 s LEU 300 Ca 0.55 1.66 -0.14 0.00 -1.03 0.00 0.00 54.13 55.17 1jz4 s LEU 300 Cb -0.14 -3.37 -0.06 0.00 0.03 0.00 0.00 46.19 42.64 1jz4 s LEU 300 CO 0.25 0.18 0.44 0.86 0.23 0.00 0.00 176.35 178.31 1jz4 s TRP 301 N -1.20 3.67 0.24 0.29 -0.00 0.22 -3.95 118.94 118.20 1jz4 s TRP 301 Ca 0.37 0.97 -0.20 0.00 -0.00 0.00 0.00 56.10 57.24 1jz4 s TRP 301 Cb -0.23 -2.28 0.03 0.00 -0.00 0.00 0.00 33.47 30.99 1jz4 s TRP 301 CO 0.26 0.57 0.65 -1.54 -0.00 0.00 0.00 176.95 176.89 1jz4 s SER 302 N -1.39 -0.32 0.43 5.86 1.04 -0.92 -4.70 113.70 113.71 1jz4 s SER 302 Ca 0.29 -0.47 0.16 0.00 0.48 0.00 0.00 55.95 56.41 1jz4 s SER 302 Cb -0.16 0.67 0.97 0.00 0.10 0.00 0.00 66.02 67.60 1jz4 s SER 302 CO 0.16 -1.21 1.94 0.00 0.98 0.00 0.00 173.24 175.12 1jz4 h ALA 303 N 2.05 1.51 -0.26 5.32 0.00 -1.91 -1.42 119.26 124.55 1jz4 h ALA 303 Ca -0.24 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.40 1jz4 h ALA 303 Cb 1.27 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1jz4 h ALA 303 CO 0.29 0.30 -0.04 0.93 0.00 0.00 0.00 179.25 180.73 1jz4 h GLU 304 N 0.00 0.49 -2.59 0.00 5.08 -1.93 -3.39 114.58 112.25 1jz4 h GLU 304 Ca -0.00 -0.18 -0.59 0.00 -1.00 0.00 0.00 59.36 57.59 1jz4 h GLU 304 Cb 0.45 -0.03 -0.39 0.00 0.50 0.00 0.00 28.75 29.28 1jz4 h GLU 304 CO 0.03 0.69 -0.86 0.42 -1.00 0.00 0.00 179.01 178.29 1jz4 s ILE 305 N -4.84 0.46 -0.90 3.13 1.01 -1.04 -4.97 121.20 114.05 1jz4 s ILE 305 Ca -0.13 -2.19 -0.12 0.00 0.00 0.00 0.00 60.65 58.21 1jz4 s ILE 305 Cb 0.08 -1.33 -0.09 0.00 0.01 0.00 0.00 42.46 41.13 1jz4 s ILE 305 CO 0.76 -1.05 2.06 -0.81 0.00 0.00 0.00 174.94 175.90 1jz4 n PRO 306 N 3.55 1.93 -1.99 2.79 -0.04 -0.56 -2.16 135.00 138.52 1jz4 n PRO 306 Ca 0.17 -1.65 -0.41 0.00 -0.04 0.00 0.00 63.50 61.57 1jz4 n PRO 306 Cb 0.40 -2.65 -0.02 0.00 -0.04 0.00 0.00 33.50 31.19 1jz4 n PRO 306 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1jz4 s ASN 307 N 3.94 6.62 0.03 3.54 0.01 -1.25 -4.87 114.94 122.96 1jz4 s ASN 307 Ca 0.46 2.71 0.03 0.00 -0.71 0.00 0.00 52.86 55.36 1jz4 s ASN 307 Cb 0.12 -2.63 -0.02 0.00 0.41 0.00 0.00 41.25 39.13 1jz4 s ASN 307 CO 0.02 -0.72 -0.10 -0.76 -1.51 0.00 0.00 177.10 174.03 1jz4 s LEU 308 N -0.53 2.16 0.42 0.60 1.43 -1.26 -4.00 118.68 117.50 1jz4 s LEU 308 Ca 0.59 -0.40 0.07 0.00 -1.03 0.00 0.00 54.13 53.36 1jz4 s LEU 308 Cb -0.42 -0.37 -0.05 0.00 0.03 0.00 0.00 46.19 45.38 1jz4 s LEU 308 CO 0.45 -0.04 0.17 -0.31 0.23 0.00 0.00 176.35 176.85 1jz4 s TYR 309 N -0.85 2.53 -0.15 0.29 1.51 0.15 -4.75 117.35 116.08 1jz4 s TYR 309 Ca -0.02 -0.62 0.00 0.00 -1.01 0.00 0.00 57.07 55.42 1jz4 s TYR 309 Cb -0.07 -1.93 -0.00 0.00 -0.11 0.00 0.00 41.96 39.84 1jz4 s TYR 309 CO 0.01 0.18 -0.15 0.50 -1.11 0.00 0.00 175.55 174.97 1jz4 s ARG 310 N -3.91 3.23 -0.23 -0.62 6.06 0.60 0.04 118.95 124.12 1jz4 s ARG 310 Ca 0.39 -0.75 -0.06 0.00 -2.50 0.00 0.00 55.73 52.81 1jz4 s ARG 310 Cb 0.04 -2.62 -0.03 0.00 0.06 0.00 0.00 34.95 32.41 1jz4 s ARG 310 CO 0.21 0.04 0.04 0.00 -2.50 0.00 0.00 175.30 173.09 1jz4 s ALA 311 N 0.76 3.11 -0.18 6.12 0.00 -0.31 0.53 121.76 131.79 1jz4 s ALA 311 Ca -0.06 -1.08 -0.01 0.00 0.00 0.00 0.00 51.96 50.81 1jz4 s ALA 311 Cb -0.15 -1.96 -0.00 0.00 0.00 0.00 0.00 23.12 21.00 1jz4 s ALA 311 CO 0.01 -0.37 -0.12 0.08 0.00 0.00 0.00 175.76 175.36 1jz4 s VAL 312 N 1.39 2.91 -0.41 0.00 1.01 -0.02 -1.44 120.40 123.84 1jz4 s VAL 312 Ca 0.05 -0.67 -0.12 0.00 0.00 0.00 0.00 61.98 61.24 1jz4 s VAL 312 Cb -0.15 -2.26 0.05 0.00 0.00 0.00 0.00 36.38 34.02 1jz4 s VAL 312 CO 0.02 0.49 0.28 -0.69 0.00 0.00 0.00 175.10 175.20 1jz4 s VAL 313 N 1.01 4.69 -0.13 2.92 1.01 -0.34 -1.52 120.40 128.05 1jz4 s VAL 313 Ca -0.01 -1.05 -0.05 0.00 0.00 0.00 0.00 61.98 60.87 1jz4 s VAL 313 Cb -0.15 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 1jz4 s VAL 313 CO -0.02 -0.40 0.06 -1.61 0.00 0.00 0.00 175.10 173.13 1jz4 s GLU 314 N 1.55 3.49 -0.36 2.72 2.02 -0.71 -0.67 118.70 126.75 1jz4 s GLU 314 Ca 0.03 -0.30 -0.11 0.00 0.02 0.00 0.00 54.97 54.61 1jz4 s GLU 314 Cb -0.21 -3.07 0.02 0.00 0.10 0.00 0.00 34.13 30.97 1jz4 s GLU 314 CO 0.06 0.56 0.19 -1.17 0.02 0.00 0.00 175.26 174.92 1jz4 s LEU 315 N -0.45 4.55 0.30 1.80 2.96 0.23 -2.09 118.68 125.99 1jz4 s LEU 315 Ca 0.10 -0.88 -0.01 0.00 -0.22 0.00 0.00 54.13 53.13 1jz4 s LEU 315 Cb -0.12 -2.02 -0.02 0.00 0.50 0.00 0.00 46.19 44.54 1jz4 s LEU 315 CO 0.02 -0.34 0.35 -1.38 -1.32 0.00 0.00 176.35 173.68 1jz4 s HIS 316 N 1.57 1.19 0.16 5.38 -3.43 -0.37 0.16 115.29 119.94 1jz4 s HIS 316 Ca 0.03 -1.35 0.02 0.00 -0.80 0.00 0.00 55.06 52.96 1jz4 s HIS 316 Cb -0.19 -0.33 -0.04 0.00 -1.43 0.00 0.00 32.58 30.60 1jz4 s HIS 316 CO 0.06 -0.94 0.30 0.95 -2.00 0.00 0.00 174.74 173.11 1jz4 s THR 317 N -3.52 5.31 0.39 -5.38 -4.23 -0.13 -1.39 115.64 106.68 1jz4 s THR 317 Ca 0.34 -0.63 0.16 0.00 -1.18 0.00 0.00 61.69 60.38 1jz4 s THR 317 Cb 0.02 -3.74 0.37 0.00 1.34 0.00 0.00 72.50 70.49 1jz4 s THR 317 CO 0.19 -0.10 1.80 0.00 -0.54 0.00 0.00 174.62 175.97 1jz4 h ALA 318 N 2.13 2.11 0.00 3.99 0.00 0.49 -0.93 119.26 127.04 1jz4 h ALA 318 Ca -0.48 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1jz4 h ALA 318 Cb 1.19 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1jz4 h ALA 318 CO 0.69 -0.46 0.00 -0.25 0.00 0.00 0.00 179.25 179.22 1jz4 n ASP 319 N -4.61 0.00 0.00 0.00 8.00 -1.26 -4.88 116.55 113.80 1jz4 n ASP 319 Ca 0.23 -0.79 0.00 0.00 0.71 0.00 0.00 54.79 54.94 1jz4 n ASP 319 Cb 0.75 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.85 1jz4 n ASP 319 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1jz4 n GLY 320 N 0.47 0.86 3.75 0.44 0.00 -0.35 -5.07 105.19 105.28 1jz4 n GLY 320 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 1jz4 n GLY 320 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jz4 s THR 321 N -2.00 5.18 0.15 2.61 2.01 -1.25 -4.82 115.64 117.51 1jz4 s THR 321 Ca 0.00 0.85 -0.30 0.00 0.31 0.00 0.00 61.69 62.55 1jz4 s THR 321 Cb 0.00 -3.76 -0.07 0.00 0.01 0.00 0.00 72.50 68.68 1jz4 s THR 321 CO 0.00 0.39 1.08 -0.22 -0.69 0.00 0.00 174.62 175.18 1jz4 s LEU 322 N 0.24 4.47 -0.21 4.42 2.96 -1.26 -0.96 118.68 128.34 1jz4 s LEU 322 Ca 0.24 2.01 -0.21 0.00 -0.22 0.00 0.00 54.13 55.95 1jz4 s LEU 322 Cb -0.15 -3.60 -0.19 0.00 0.50 0.00 0.00 46.19 42.76 1jz4 s LEU 322 CO 0.10 -0.22 0.17 -0.38 -1.32 0.00 0.00 176.35 174.69 1jz4 n ILE 323 N 2.67 1.54 -3.65 6.68 5.41 0.44 -4.94 119.36 127.50 1jz4 n ILE 323 Ca 0.03 -0.07 -0.03 0.00 1.00 0.00 0.00 62.75 63.69 1jz4 n ILE 323 Cb 0.47 -2.02 -0.01 0.00 -0.71 0.00 0.00 39.64 37.37 1jz4 n ILE 323 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 1jz4 s GLU 324 N -2.38 0.75 0.00 0.38 -1.05 -0.80 -4.93 118.70 110.68 1jz4 s GLU 324 Ca -0.30 -0.39 -0.01 0.00 -0.15 0.00 0.00 54.97 54.13 1jz4 s GLU 324 Cb 0.07 0.28 -0.01 0.00 -0.44 0.00 0.00 34.13 34.03 1jz4 s GLU 324 CO 0.59 -0.34 0.01 0.00 0.95 0.00 0.00 175.26 176.46 1jz4 s ALA 325 N -2.86 -0.00 0.43 -0.84 0.00 -0.58 0.77 121.76 118.68 1jz4 s ALA 325 Ca 0.11 -0.23 0.06 0.00 0.00 0.00 0.00 51.96 51.90 1jz4 s ALA 325 Cb 0.01 0.05 -0.07 0.00 0.00 0.00 0.00 23.12 23.12 1jz4 s ALA 325 CO -0.02 -0.09 0.01 -1.21 0.00 0.00 0.00 175.76 174.45 1jz4 s GLU 326 N -0.72 2.01 0.14 0.00 0.41 0.16 -1.87 118.70 118.83 1jz4 s GLU 326 Ca -0.08 -2.17 -0.24 0.00 -0.41 0.00 0.00 54.97 52.07 1jz4 s GLU 326 Cb -0.05 -1.62 0.07 0.00 -1.78 0.00 0.00 34.13 30.75 1jz4 s GLU 326 CO -0.00 -0.12 0.73 0.00 -0.49 0.00 0.00 175.26 175.38 1jz4 s ALA 327 N -2.74 -1.59 0.13 5.21 0.00 -1.26 -1.20 121.76 120.31 1jz4 s ALA 327 Ca 0.29 0.43 -0.15 0.00 0.00 0.00 0.00 51.96 52.53 1jz4 s ALA 327 Cb 0.08 0.74 0.03 0.00 0.00 0.00 0.00 23.12 23.97 1jz4 s ALA 327 CO 0.15 -0.83 0.37 0.00 0.00 0.00 0.00 175.76 175.45 1jz4 s ASP 329 N -2.83 7.20 -0.07 0.00 1.01 -1.26 -1.16 116.67 119.55 1jz4 s ASP 329 Ca 0.05 1.43 0.05 0.00 0.71 0.00 0.00 52.55 54.79 1jz4 s ASP 329 Cb 0.02 -2.44 -0.01 0.00 1.01 0.00 0.00 42.92 41.50 1jz4 s ASP 329 CO -0.10 0.13 -0.25 -0.69 0.21 0.00 0.00 175.17 174.47 1jz4 s VAL 330 N -0.56 2.06 -0.25 -1.27 1.01 0.11 -4.71 120.40 116.79 1jz4 s VAL 330 Ca 0.35 -1.05 -0.04 0.00 0.00 0.00 0.00 61.98 61.25 1jz4 s VAL 330 Cb -0.21 -1.76 0.01 0.00 0.00 0.00 0.00 36.38 34.43 1jz4 s VAL 330 CO 0.22 0.57 -0.02 -0.83 0.00 0.00 0.00 175.10 175.04 1jz4 s GLY 331 N 0.02 1.66 -0.46 4.51 0.00 -1.26 -0.67 107.32 111.12 1jz4 s GLY 331 Ca -0.09 -1.37 -0.28 0.00 0.00 0.00 0.00 44.72 42.97 1jz4 s GLY 331 CO 0.06 0.52 1.52 -1.36 0.00 0.00 0.00 173.10 173.84 1jz4 s PHE 332 N 1.41 2.19 -0.21 1.90 0.40 -1.26 -4.82 117.98 117.59 1jz4 s PHE 332 Ca 0.02 0.61 -0.26 0.00 -0.60 0.00 0.00 56.93 56.71 1jz4 s PHE 332 Cb -0.16 -4.29 0.07 0.00 0.51 0.00 0.00 43.02 39.15 1jz4 s PHE 332 CO -0.03 -2.18 0.69 -0.98 0.70 0.00 0.00 175.22 173.42 1jz4 s ARG 333 N 5.45 0.87 -0.16 0.44 3.03 -1.26 -0.61 118.95 126.71 1jz4 s ARG 333 Ca 0.62 0.78 -0.04 0.00 2.03 0.00 0.00 55.73 59.12 1jz4 s ARG 333 Cb -0.14 0.42 -0.03 0.00 -1.03 0.00 0.00 34.95 34.17 1jz4 s ARG 333 CO 0.29 -0.16 -0.01 -2.00 -1.13 0.00 0.00 175.30 172.29 1jz4 s GLU 334 N -0.03 3.71 -0.16 3.89 2.12 -1.26 -4.90 118.70 122.07 1jz4 s GLU 334 Ca -0.03 -0.48 0.01 0.00 0.36 0.00 0.00 54.97 54.84 1jz4 s GLU 334 Cb -0.04 -2.97 0.01 0.00 0.26 0.00 0.00 34.13 31.38 1jz4 s GLU 334 CO 0.03 0.27 -0.18 0.08 -0.54 0.00 0.00 175.26 174.92 1jz4 s VAL 335 N 0.31 2.37 0.06 3.70 1.01 -1.26 -0.37 120.40 126.22 1jz4 s VAL 335 Ca -0.02 -0.86 -0.22 0.00 0.00 0.00 0.00 61.98 60.87 1jz4 s VAL 335 Cb -0.14 -1.99 0.05 0.00 0.00 0.00 0.00 36.38 34.31 1jz4 s VAL 335 CO 0.02 0.53 0.53 0.00 0.00 0.00 0.00 175.10 176.18 1jz4 s ARG 336 N 0.93 1.07 -0.19 2.72 1.70 -0.76 -4.65 118.95 119.77 1jz4 s ARG 336 Ca -0.04 -0.27 -0.02 0.00 -0.47 0.00 0.00 55.73 54.94 1jz4 s ARG 336 Cb -0.15 0.49 -0.00 0.00 -0.57 0.00 0.00 34.95 34.72 1jz4 s ARG 336 CO -0.03 -0.40 -0.10 0.42 -1.08 0.00 0.00 175.30 174.11 1jz4 s ILE 337 N -2.63 2.97 -0.01 4.99 1.01 -1.26 0.15 121.20 126.42 1jz4 s ILE 337 Ca -0.04 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 59.98 1jz4 s ILE 337 Cb -0.00 -2.31 0.00 0.00 0.01 0.00 0.00 42.46 40.15 1jz4 s ILE 337 CO -0.03 0.47 -0.04 -0.70 0.00 0.00 0.00 174.94 174.64 1jz4 s GLU 338 N 1.23 0.41 -1.64 2.79 2.12 0.26 -4.79 118.70 119.08 1jz4 s GLU 338 Ca 0.03 -0.14 0.00 0.00 0.36 0.00 0.00 54.97 55.21 1jz4 s GLU 338 Cb -0.14 -0.42 0.00 0.00 0.26 0.00 0.00 34.13 33.83 1jz4 s GLU 338 CO -0.04 0.07 0.00 -1.71 -0.54 0.00 0.00 175.26 173.04 1jz4 n ASN 339 N 3.14 -5.42 0.00 -1.70 5.15 -1.26 -1.84 115.26 113.34 1jz4 n ASN 339 Ca -0.15 0.06 0.00 0.00 -0.60 0.00 0.00 54.58 53.89 1jz4 n ASN 339 Cb 0.57 -4.55 0.00 0.00 -0.53 0.00 0.00 39.78 35.27 1jz4 n ASN 339 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1jz4 n GLY 340 N -0.93 0.71 3.20 8.20 0.00 -1.26 -5.04 105.19 110.08 1jz4 n GLY 340 Ca -0.22 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.52 1jz4 n GLY 340 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jz4 s LEU 341 N 0.00 2.01 -0.37 0.99 1.43 -0.76 -3.14 118.68 118.83 1jz4 s LEU 341 Ca 0.00 -0.39 -0.29 0.00 -1.03 0.00 0.00 54.13 52.43 1jz4 s LEU 341 Cb 0.00 -1.08 0.02 0.00 0.03 0.00 0.00 46.19 45.16 1jz4 s LEU 341 CO 0.00 0.23 1.08 -0.22 0.23 0.00 0.00 176.35 177.67 1jz4 s LEU 342 N -0.31 3.85 -0.06 1.79 2.96 -1.26 -0.58 118.68 125.08 1jz4 s LEU 342 Ca 0.03 0.85 0.02 0.00 -0.22 0.00 0.00 54.13 54.81 1jz4 s LEU 342 Cb -0.10 -3.52 -0.03 0.00 0.50 0.00 0.00 46.19 43.04 1jz4 s LEU 342 CO 0.01 -0.99 -0.10 -0.76 -1.32 0.00 0.00 176.35 173.19 1jz4 s LEU 343 N 3.87 3.00 -0.15 -0.68 1.43 0.39 -2.04 118.68 124.49 1jz4 s LEU 343 Ca 0.46 -0.09 0.01 0.00 -1.03 0.00 0.00 54.13 53.48 1jz4 s LEU 343 Cb -0.11 -1.64 0.01 0.00 0.03 0.00 0.00 46.19 44.48 1jz4 s LEU 343 CO 0.20 0.35 -0.18 -0.22 0.23 0.00 0.00 176.35 176.73 1jz4 s LEU 344 N -0.76 2.30 -1.59 1.79 0.20 0.16 -1.82 118.68 118.96 1jz4 s LEU 344 Ca 0.12 -0.54 -0.11 0.00 0.69 0.00 0.00 54.13 54.28 1jz4 s LEU 344 Cb -0.11 -1.51 0.10 0.00 -0.43 0.00 0.00 46.19 44.24 1jz4 s LEU 344 CO 0.01 0.07 0.65 0.59 -0.29 0.00 0.00 176.35 177.38 1jz4 n ASN 345 N 4.14 -2.26 0.00 3.68 3.02 0.51 0.09 115.26 124.44 1jz4 n ASN 345 Ca -0.20 -1.00 0.00 0.00 -0.03 0.00 0.00 54.58 53.35 1jz4 n ASN 345 Cb 0.51 -2.90 0.00 0.00 -0.61 0.00 0.00 39.78 36.78 1jz4 n ASN 345 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1jz4 n GLY 346 N -1.66 1.23 3.54 7.41 0.00 -1.26 -4.99 105.19 109.47 1jz4 n GLY 346 Ca -0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.64 1jz4 n GLY 346 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jz4 s LYS 347 N -0.15 2.27 0.00 1.61 -0.14 0.11 -5.00 119.74 118.45 1jz4 s LYS 347 Ca 0.00 -0.89 -0.30 0.00 -1.36 0.00 0.00 55.97 53.42 1jz4 s LYS 347 Cb 0.00 -2.34 -0.04 0.00 -1.68 0.00 0.00 37.83 33.78 1jz4 s LYS 347 CO 0.00 0.56 1.05 -1.25 -0.76 0.00 0.00 175.35 174.94 1jz4 s PRO 348 N -1.62 4.50 0.78 -1.68 0.04 -1.26 0.36 135.00 136.13 1jz4 s PRO 348 Ca 0.17 1.52 -0.11 0.00 0.04 0.00 0.00 61.00 62.62 1jz4 s PRO 348 Cb -0.11 -3.44 0.06 0.00 0.04 0.00 0.00 34.50 31.04 1jz4 s PRO 348 CO 0.08 -0.15 1.09 -0.51 0.04 0.00 0.00 177.00 177.56 1jz4 s LEU 349 N 1.18 2.70 -0.33 -3.56 1.43 -0.87 -4.91 118.68 114.31 1jz4 s LEU 349 Ca 0.54 1.33 -0.01 0.00 -1.03 0.00 0.00 54.13 54.95 1jz4 s LEU 349 Cb -0.23 -3.99 0.12 0.00 0.03 0.00 0.00 46.19 42.12 1jz4 s LEU 349 CO 0.27 -1.84 0.18 -0.22 0.23 0.00 0.00 176.35 174.97 1jz4 s LEU 350 N -5.70 1.08 -0.33 1.79 2.96 -1.26 -4.77 118.68 112.44 1jz4 s LEU 350 Ca 0.60 -1.88 -0.29 0.00 -0.22 0.00 0.00 54.13 52.35 1jz4 s LEU 350 Cb -0.14 -0.47 -0.01 0.00 0.50 0.00 0.00 46.19 46.07 1jz4 s LEU 350 CO 0.54 -0.36 1.57 -0.63 -1.32 0.00 0.00 176.35 176.15 1jz4 s ILE 351 N 1.40 3.75 -1.04 6.68 -1.09 0.15 -4.91 121.20 126.13 1jz4 s ILE 351 Ca 0.14 0.79 -0.05 0.00 -2.23 0.00 0.00 60.65 59.30 1jz4 s ILE 351 Cb -0.20 -3.92 0.28 0.00 -1.58 0.00 0.00 42.46 37.04 1jz4 s ILE 351 CO -0.14 -0.52 1.21 0.54 -1.23 0.00 0.00 174.94 174.80 1jz4 n ARG 352 N 8.03 3.77 -3.78 2.79 1.74 -1.26 -1.95 116.66 126.00 1jz4 n ARG 352 Ca 0.19 -4.52 -0.24 0.00 -0.77 0.00 0.00 57.85 52.51 1jz4 n ARG 352 Cb 0.47 -2.50 -0.02 0.00 -1.02 0.00 0.00 32.46 29.39 1jz4 n ARG 352 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1jz4 s GLY 353 N -0.48 2.26 -0.03 -0.13 0.00 0.25 -0.48 107.32 108.72 1jz4 s GLY 353 Ca 0.31 -1.66 -0.11 0.00 0.00 0.00 0.00 44.72 43.27 1jz4 s GLY 353 CO -0.00 -1.84 0.23 0.54 0.00 0.00 0.00 173.10 172.03 1jz4 s VAL 354 N -2.63 0.05 0.16 1.40 0.11 -0.43 -0.47 120.40 118.59 1jz4 s VAL 354 Ca 0.41 -0.45 -0.23 0.00 -2.93 0.00 0.00 61.98 58.79 1jz4 s VAL 354 Cb -0.02 -0.49 -0.08 0.00 -1.53 0.00 0.00 36.38 34.27 1jz4 s VAL 354 CO 0.24 -0.25 0.73 0.20 -3.33 0.00 0.00 175.10 172.69 1jz4 s ASN 355 N -1.01 7.26 -0.05 3.54 0.01 0.83 -1.00 114.94 124.52 1jz4 s ASN 355 Ca -0.11 1.53 -0.02 0.00 -0.71 0.00 0.00 52.86 53.55 1jz4 s ASN 355 Cb -0.05 -2.46 0.04 0.00 0.41 0.00 0.00 41.25 39.19 1jz4 s ASN 355 CO 0.02 0.19 0.09 -0.60 -1.51 0.00 0.00 177.10 175.30 1jz4 s ARG 356 N -1.31 -0.02 0.42 -0.60 3.52 -0.58 -1.59 118.95 118.78 1jz4 s ARG 356 Ca 0.36 0.41 -0.05 0.00 -0.13 0.00 0.00 55.73 56.32 1jz4 s ARG 356 Cb -0.21 -0.37 -0.04 0.00 -1.56 0.00 0.00 34.95 32.77 1jz4 s ARG 356 CO 0.24 -0.28 0.70 -1.01 -0.81 0.00 0.00 175.30 174.13 1jz4 s HIS 357 N 1.95 3.53 -0.84 5.12 3.76 -1.26 -3.55 115.29 123.99 1jz4 s HIS 357 Ca 0.01 0.72 -0.19 0.00 -0.15 0.00 0.00 55.06 55.45 1jz4 s HIS 357 Cb -0.12 -2.21 0.12 0.00 1.11 0.00 0.00 32.58 31.49 1jz4 s HIS 357 CO -0.04 -0.11 1.03 -1.21 -0.85 0.00 0.00 174.74 173.56 1jz4 s GLU 358 N -4.36 3.46 0.01 1.40 2.02 -1.26 -4.96 118.70 115.00 1jz4 s GLU 358 Ca 0.46 -1.62 0.01 0.00 0.02 0.00 0.00 54.97 53.84 1jz4 s GLU 358 Cb -0.10 -4.70 -0.01 0.00 0.10 0.00 0.00 34.13 29.42 1jz4 s GLU 358 CO 0.39 -1.72 -0.04 -1.58 0.02 0.00 0.00 175.26 172.33 1jz4 s HIS 359 N 2.73 0.35 -0.04 1.61 2.46 -1.26 -4.43 115.29 116.71 1jz4 s HIS 359 Ca 0.28 -0.16 -0.01 0.00 0.47 0.00 0.00 55.06 55.63 1jz4 s HIS 359 Cb -0.09 -0.22 0.03 0.00 -0.13 0.00 0.00 32.58 32.17 1jz4 s HIS 359 CO -0.05 -0.03 0.08 -1.58 -2.47 0.00 0.00 174.74 170.69 1jz4 s HIS 360 N -0.38 -0.06 0.43 3.88 5.04 0.64 -5.00 115.29 119.84 1jz4 s HIS 360 Ca -0.02 0.26 0.13 0.00 -1.54 0.00 0.00 55.06 53.89 1jz4 s HIS 360 Cb -0.03 -0.12 0.95 0.00 0.04 0.00 0.00 32.58 33.42 1jz4 s HIS 360 CO -0.00 -0.10 1.99 -1.00 -2.34 0.00 0.00 174.74 173.28 1jz4 h PRO 361 N 6.99 0.09 0.01 2.88 0.13 -1.80 0.14 132.00 140.44 1jz4 h PRO 361 Ca -0.40 -0.02 -0.41 0.00 -0.87 0.00 0.00 66.00 64.31 1jz4 h PRO 361 Cb 1.15 -0.01 -0.07 0.00 0.13 0.00 0.00 31.00 32.20 1jz4 h PRO 361 CO 0.46 0.23 -2.45 1.28 -0.23 0.00 0.00 178.00 177.29 1jz4 n LEU 362 N -4.33 2.70 -0.96 1.56 4.77 -1.26 -2.07 117.00 117.40 1jz4 n LEU 362 Ca -0.02 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.07 1jz4 n LEU 362 Cb 0.23 -0.90 0.26 0.00 -2.33 0.00 0.00 43.42 40.68 1jz4 n LEU 362 CO 0.37 0.84 0.72 1.41 -1.33 0.00 0.00 177.39 179.39 1jz4 n HIS 363 N -3.53 0.58 0.00 -1.77 8.25 -1.22 -4.96 115.22 112.57 1jz4 n HIS 363 Ca -0.47 -0.29 0.00 0.00 -0.26 0.00 0.00 57.72 56.70 1jz4 n HIS 363 Cb 0.96 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.07 1jz4 n HIS 363 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1jz4 n GLY 364 N 1.36 2.72 1.28 -1.41 0.00 0.49 -2.66 105.19 106.97 1jz4 n GLY 364 Ca 0.18 -0.07 0.11 0.00 0.00 0.00 0.00 46.02 46.24 1jz4 n GLY 364 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1jz4 n GLN 365 N 8.63 2.82 -2.66 1.61 6.02 -1.26 -0.26 117.38 132.28 1jz4 n GLN 365 Ca 0.00 -2.61 -0.43 0.00 -0.01 0.00 0.00 57.00 53.96 1jz4 n GLN 365 Cb 0.00 -1.55 -0.02 0.00 1.02 0.00 0.00 30.24 29.68 1jz4 n GLN 365 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1jz4 s VAL 366 N -1.06 4.72 0.07 5.09 1.01 -1.09 -4.84 120.40 124.30 1jz4 s VAL 366 Ca 0.46 2.00 0.00 0.00 0.00 0.00 0.00 61.98 64.44 1jz4 s VAL 366 Cb 0.24 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 32.30 1jz4 s VAL 366 CO 0.31 -0.03 0.21 -0.04 0.00 0.00 0.00 175.10 175.55 1jz4 s MET 367 N 2.25 3.42 0.03 2.72 -1.94 -1.26 -4.74 119.30 119.77 1jz4 s MET 367 Ca 0.48 -0.47 -0.01 0.00 -1.71 0.00 0.00 55.69 53.99 1jz4 s MET 367 Cb -0.18 -3.02 -0.02 0.00 2.01 0.00 0.00 34.83 33.61 1jz4 s MET 367 CO 0.16 0.60 -0.01 0.16 -0.01 0.00 0.00 175.02 175.92 1jz4 s ASP 368 N -2.58 0.30 0.18 3.03 1.47 -1.26 -5.04 116.67 112.77 1jz4 s ASP 368 Ca 0.35 -0.63 -0.13 0.00 1.18 0.00 0.00 52.55 53.32 1jz4 s ASP 368 Cb -0.13 0.14 0.17 0.00 -0.34 0.00 0.00 42.92 42.77 1jz4 s ASP 368 CO 0.28 -0.41 1.75 -0.08 0.68 0.00 0.00 175.17 177.39 1jz4 h GLU 369 N 4.12 0.36 -0.96 2.11 4.81 -1.99 0.00 114.58 123.03 1jz4 h GLU 369 Ca -0.33 -0.02 0.07 0.00 -0.13 0.00 0.00 59.36 58.95 1jz4 h GLU 369 Cb 1.19 -0.08 -0.07 0.00 0.63 0.00 0.00 28.75 30.42 1jz4 h GLU 369 CO 0.49 0.24 0.61 0.37 -0.73 0.00 0.00 179.01 179.99 1jz4 h GLN 370 N 0.37 1.06 -0.05 1.92 4.15 -1.98 0.19 115.11 120.77 1jz4 h GLN 370 Ca 0.24 -0.06 -0.24 0.00 0.77 0.00 0.00 58.65 59.36 1jz4 h GLN 370 Cb 0.24 -0.24 0.01 0.00 0.21 0.00 0.00 27.48 27.71 1jz4 h GLN 370 CO -0.24 0.70 -0.92 1.15 -1.93 0.00 0.00 178.83 177.60 1jz4 h THR 371 N 1.09 1.32 -0.73 2.39 2.02 -1.72 -1.18 112.91 116.11 1jz4 h THR 371 Ca 0.42 -2.22 -0.01 0.00 0.77 0.00 0.00 66.41 65.37 1jz4 h THR 371 Cb 0.21 2.26 -0.03 0.00 -1.74 0.00 0.00 68.15 68.84 1jz4 h THR 371 CO -0.18 0.68 0.40 0.24 0.37 0.00 0.00 175.52 177.03 1jz4 h MET 372 N 0.38 1.02 -0.15 6.66 2.86 -0.48 -0.68 114.93 124.54 1jz4 h MET 372 Ca -0.09 -0.12 -0.01 0.00 -2.06 0.00 0.00 59.70 57.43 1jz4 h MET 372 Cb 1.55 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 33.00 1jz4 h MET 372 CO 0.17 0.76 0.06 0.28 1.06 0.00 0.00 176.91 179.24 1jz4 h VAL 373 N 1.01 1.15 -0.98 -2.22 2.07 -0.59 -0.26 116.25 116.44 1jz4 h VAL 373 Ca 0.26 -0.46 0.11 0.00 0.82 0.00 0.00 66.70 67.43 1jz4 h VAL 373 Cb 0.03 1.19 -0.08 0.00 -1.52 0.00 0.00 31.29 30.91 1jz4 h VAL 373 CO -0.04 0.14 0.62 -0.61 0.02 0.00 0.00 177.57 177.70 1jz4 h GLN 374 N 0.08 0.94 -0.08 1.57 4.15 -0.94 -0.59 115.11 120.23 1jz4 h GLN 374 Ca 0.05 -0.06 -0.01 0.00 0.77 0.00 0.00 58.65 59.40 1jz4 h GLN 374 Cb 0.17 -0.21 -0.00 0.00 0.21 0.00 0.00 27.48 27.65 1jz4 h GLN 374 CO -0.00 0.62 -0.00 -0.44 -1.93 0.00 0.00 178.83 177.07 1jz4 h ASP 375 N 0.96 0.15 -0.64 -0.69 3.32 -0.76 -1.41 116.42 117.35 1jz4 h ASP 375 Ca 0.47 -0.32 0.03 0.00 0.02 0.00 0.00 57.03 57.24 1jz4 h ASP 375 Cb 0.47 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 39.94 1jz4 h ASP 375 CO -0.24 0.43 0.39 0.40 -1.72 0.00 0.00 179.24 178.50 1jz4 h ILE 376 N -0.14 1.07 0.02 0.35 2.04 -0.28 -0.15 117.51 120.42 1jz4 h ILE 376 Ca 0.02 -0.26 0.01 0.00 1.00 0.00 0.00 64.86 65.63 1jz4 h ILE 376 Cb 0.36 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 1jz4 h ILE 376 CO 0.00 0.14 -0.06 -0.07 0.00 0.00 0.00 178.15 178.16 1jz4 h LEU 377 N 0.76 -0.18 -0.63 1.44 3.38 -1.07 -1.26 115.31 117.75 1jz4 h LEU 377 Ca 0.26 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.26 1jz4 h LEU 377 Cb 0.04 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1jz4 h LEU 377 CO -0.11 -0.10 0.41 -0.07 0.09 0.00 0.00 178.44 178.66 1jz4 h LEU 378 N -0.12 0.73 0.03 1.67 3.38 -1.11 0.27 115.31 120.15 1jz4 h LEU 378 Ca 0.02 -0.03 0.03 0.00 0.09 0.00 0.00 57.88 57.99 1jz4 h LEU 378 Cb 0.14 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.67 1jz4 h LEU 378 CO -0.05 0.54 -0.27 0.24 0.09 0.00 0.00 178.44 178.99 1jz4 h MET 379 N 0.85 -0.41 -0.39 1.13 2.86 -0.64 0.16 114.93 118.49 1jz4 h MET 379 Ca 0.23 0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.83 1jz4 h MET 379 Cb -0.08 0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.65 1jz4 h MET 379 CO -0.05 -0.28 -0.05 0.87 1.06 0.00 0.00 176.91 178.46 1jz4 h LYS 380 N -0.43 0.64 0.00 1.72 1.57 -1.11 0.21 116.57 119.17 1jz4 h LYS 380 Ca 0.05 -0.18 -0.07 0.00 -1.87 0.00 0.00 60.65 58.59 1jz4 h LYS 380 Cb 0.50 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 1jz4 h LYS 380 CO -0.22 0.70 -0.31 1.96 -0.57 0.00 0.00 179.45 181.01 1jz4 h GLN 381 N 0.60 0.00 -0.79 3.15 4.20 0.03 -2.37 115.11 119.92 1jz4 h GLN 381 Ca 0.12 0.00 -0.34 0.00 0.06 0.00 0.00 58.65 58.49 1jz4 h GLN 381 Cb 0.46 0.00 -0.20 0.00 0.30 0.00 0.00 27.48 28.04 1jz4 h GLN 381 CO 0.02 0.31 0.39 0.09 -0.67 0.00 0.00 178.83 178.98 1jz4 n ASN 382 N -3.71 4.07 -1.38 1.46 3.02 0.50 -4.93 115.26 114.29 1jz4 n ASN 382 Ca -0.01 -3.45 -0.14 0.00 -0.03 0.00 0.00 54.58 50.95 1jz4 n ASN 382 Cb 0.42 -0.77 -0.03 0.00 -0.61 0.00 0.00 39.78 38.79 1jz4 n ASN 382 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1jz4 n ASN 383 N -0.71 -4.38 -4.89 6.41 3.02 -0.89 -3.97 115.26 109.85 1jz4 n ASN 383 Ca 0.48 0.11 -0.30 0.00 -0.03 0.00 0.00 54.58 54.84 1jz4 n ASN 383 Cb 1.46 -3.38 -0.04 0.00 -0.61 0.00 0.00 39.78 37.20 1jz4 n ASN 383 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1jz4 s PHE 384 N -2.62 3.45 0.00 3.10 0.40 -0.00 -4.85 117.98 117.46 1jz4 s PHE 384 Ca 0.00 0.74 0.00 0.00 -0.60 0.00 0.00 56.93 57.07 1jz4 s PHE 384 Cb 0.00 -2.17 0.00 0.00 0.51 0.00 0.00 43.02 41.36 1jz4 s PHE 384 CO 0.00 0.24 0.62 0.27 0.70 0.00 0.00 175.22 177.05 1jz4 n ASN 385 N -0.47 0.94 -3.47 1.36 0.23 0.37 -4.26 115.26 109.95 1jz4 n ASN 385 Ca -0.01 -1.38 -0.15 0.00 -0.53 0.00 0.00 54.58 52.51 1jz4 n ASN 385 Cb 0.53 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 38.19 1jz4 n ASN 385 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1jz4 s ALA 386 N -0.38 -1.67 -0.04 -2.53 0.00 -1.14 -0.54 121.76 115.46 1jz4 s ALA 386 Ca 0.00 0.89 -0.09 0.00 0.00 0.00 0.00 51.96 52.76 1jz4 s ALA 386 Cb 0.00 0.44 0.01 0.00 0.00 0.00 0.00 23.12 23.58 1jz4 s ALA 386 CO 0.00 -0.57 0.21 0.54 0.00 0.00 0.00 175.76 175.94 1jz4 s VAL 387 N -2.47 0.04 -0.17 0.00 0.11 0.29 -1.32 120.40 116.88 1jz4 s VAL 387 Ca -0.05 -0.37 -0.05 0.00 -2.93 0.00 0.00 61.98 58.58 1jz4 s VAL 387 Cb -0.01 -0.42 -0.03 0.00 -1.53 0.00 0.00 36.38 34.39 1jz4 s VAL 387 CO -0.02 -0.20 0.01 -0.60 -3.33 0.00 0.00 175.10 170.96 1jz4 s ARG 388 N -0.77 3.79 -1.33 1.54 3.52 -0.17 -1.61 118.95 123.93 1jz4 s ARG 388 Ca -0.09 -0.45 -0.13 0.00 -0.13 0.00 0.00 55.73 54.93 1jz4 s ARG 388 Cb -0.05 -3.05 -0.04 0.00 -1.56 0.00 0.00 34.95 30.26 1jz4 s ARG 388 CO 0.02 0.24 2.36 0.00 -0.81 0.00 0.00 175.30 177.10 1jz4 s SER 390 N 3.26 6.36 -0.42 0.00 1.04 -1.23 -0.97 113.70 121.74 1jz4 s SER 390 Ca 0.54 2.05 0.09 0.00 0.48 0.00 0.00 55.95 59.11 1jz4 s SER 390 Cb 0.15 -2.53 0.28 0.00 0.10 0.00 0.00 66.02 64.02 1jz4 s SER 390 CO -0.04 -1.21 0.62 1.41 0.98 0.00 0.00 173.24 175.00 1jz4 n HIS 391 N 8.28 0.42 0.00 5.02 -0.00 -1.26 -4.22 115.22 123.46 1jz4 n HIS 391 Ca 0.20 -3.71 0.00 0.00 -0.00 0.00 0.00 57.72 54.21 1jz4 n HIS 391 Cb 0.44 -0.40 0.00 0.00 -0.00 0.00 0.00 29.99 30.03 1jz4 n HIS 391 CO 0.00 0.00 0.00 2.48 -0.00 0.00 0.00 176.34 178.82 1jz4 n TYR 392 N 0.98 0.00 -1.71 4.41 0.18 -0.14 -4.31 117.16 116.57 1jz4 n TYR 392 Ca 0.23 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.59 1jz4 n TYR 392 Cb 0.54 0.00 -0.00 0.00 -0.38 0.00 0.00 39.34 39.50 1jz4 n TYR 392 CO 0.00 0.00 0.00 -2.30 -2.08 0.00 0.00 176.86 172.48 1jz4 n PRO 393 N -0.05 2.17 -2.65 -3.48 -0.02 -0.30 -4.62 135.00 126.06 1jz4 n PRO 393 Ca 0.00 0.76 -0.22 0.00 -2.02 0.00 0.00 63.50 62.03 1jz4 n PRO 393 Cb 0.00 -2.37 0.04 0.00 -0.02 0.00 0.00 33.50 31.15 1jz4 n PRO 393 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 1jz4 s ASN 394 N -0.30 5.31 0.29 2.55 0.02 -1.26 -4.84 114.94 116.71 1jz4 s ASN 394 Ca 0.55 0.07 -0.29 0.00 -1.02 0.00 0.00 52.86 52.17 1jz4 s ASN 394 Cb -0.55 -0.98 -0.13 0.00 0.02 0.00 0.00 41.25 39.60 1jz4 s ASN 394 CO 0.62 -1.12 1.23 1.57 0.02 0.00 0.00 177.10 179.42 1jz4 n HIS 395 N -2.35 1.88 -0.31 2.20 -0.00 -1.26 -4.81 115.22 110.57 1jz4 n HIS 395 Ca 0.07 0.58 0.20 0.00 -0.00 0.00 0.00 57.72 58.57 1jz4 n HIS 395 Cb 0.59 -2.37 0.48 0.00 -0.00 0.00 0.00 29.99 28.70 1jz4 n HIS 395 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1jz4 h PRO 396 N 2.86 0.44 0.00 1.57 0.13 -1.96 -1.44 132.00 133.60 1jz4 h PRO 396 Ca -0.44 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1jz4 h PRO 396 Cb 1.30 -0.10 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 1jz4 h PRO 396 CO 0.66 0.29 -0.00 1.25 -0.23 0.00 0.00 178.00 179.97 1jz4 h LEU 397 N 0.46 0.00 -0.57 1.56 5.85 -2.02 -2.89 115.31 117.70 1jz4 h LEU 397 Ca 0.57 0.00 0.09 0.00 0.84 0.00 0.00 57.88 59.38 1jz4 h LEU 397 Cb 1.34 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 42.30 1jz4 h LEU 397 CO -0.29 0.00 0.18 -0.25 -0.34 0.00 0.00 178.44 177.75 1jz4 h TRP 398 N 0.00 0.32 -0.44 1.25 2.91 -1.60 -2.49 115.95 115.89 1jz4 h TRP 398 Ca -0.00 0.03 -0.11 0.00 1.13 0.00 0.00 58.89 59.94 1jz4 h TRP 398 Cb 0.01 -0.05 -0.02 0.00 -0.51 0.00 0.00 29.16 28.59 1jz4 h TRP 398 CO 0.00 0.06 -0.17 1.88 -1.03 0.00 0.00 178.44 179.19 1jz4 h TYR 399 N 0.35 0.95 -0.46 2.65 -1.99 -1.70 0.60 116.97 117.38 1jz4 h TYR 399 Ca 0.29 -0.20 -0.01 0.00 2.00 0.00 0.00 58.73 60.80 1jz4 h TYR 399 Cb 0.37 -0.23 -0.02 0.00 2.00 0.00 0.00 36.73 38.84 1jz4 h TYR 399 CO -0.19 0.95 0.23 1.15 -0.00 0.00 0.00 178.16 180.30 1jz4 h THR 400 N 0.75 1.18 -0.21 -2.88 2.02 -1.61 -1.02 112.91 111.14 1jz4 h THR 400 Ca 0.11 -0.49 -0.02 0.00 0.77 0.00 0.00 66.41 66.78 1jz4 h THR 400 Cb 0.69 0.67 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 1jz4 h THR 400 CO 0.05 0.19 0.05 -0.07 0.37 0.00 0.00 175.52 176.12 1jz4 h LEU 401 N 0.60 0.33 -0.88 2.58 3.38 -1.26 -1.22 115.31 118.84 1jz4 h LEU 401 Ca 0.16 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 1jz4 h LEU 401 Cb 0.10 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 1jz4 h LEU 401 CO -0.02 0.47 0.15 0.00 0.09 0.00 0.00 178.44 179.13 1jz4 h ASP 403 N 0.93 0.81 0.41 0.00 3.32 -0.96 0.51 116.42 121.44 1jz4 h ASP 403 Ca 0.20 -0.08 -0.31 0.00 0.02 0.00 0.00 57.03 56.85 1jz4 h ASP 403 Cb 0.34 -0.21 0.02 0.00 0.22 0.00 0.00 39.33 39.70 1jz4 h ASP 403 CO 0.00 0.66 -1.45 0.03 -1.72 0.00 0.00 179.24 176.76 1jz4 h ARG 404 N 0.90 0.38 0.00 3.56 3.08 -0.86 -3.34 114.38 118.11 1jz4 h ARG 404 Ca 0.23 -0.65 -0.05 0.00 0.07 0.00 0.00 59.98 59.58 1jz4 h ARG 404 Cb 0.01 0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 1jz4 h ARG 404 CO -0.04 1.29 -1.02 1.88 -1.07 0.00 0.00 179.97 181.01 1jz4 h TYR 405 N 0.10 0.00 -1.61 3.04 -1.99 -0.59 -3.45 116.97 112.48 1jz4 h TYR 405 Ca -0.23 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.50 1jz4 h TYR 405 Cb 2.07 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.80 1jz4 h TYR 405 CO 0.09 0.18 0.00 0.41 -0.00 0.00 0.00 178.16 178.84 1jz4 n GLY 406 N 1.24 -1.30 3.05 3.88 0.00 0.15 -4.78 105.19 107.43 1jz4 n GLY 406 Ca -0.02 -0.45 -0.13 0.00 0.00 0.00 0.00 46.02 45.42 1jz4 n GLY 406 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jz4 s LEU 407 N -0.11 0.85 0.07 0.99 1.43 -1.10 -4.64 118.68 116.17 1jz4 s LEU 407 Ca 0.00 0.43 -0.30 0.00 -1.03 0.00 0.00 54.13 53.23 1jz4 s LEU 407 Cb 0.00 0.65 -0.05 0.00 0.03 0.00 0.00 46.19 46.82 1jz4 s LEU 407 CO 0.00 -0.12 1.08 -0.31 0.23 0.00 0.00 176.35 177.23 1jz4 s TYR 408 N 0.70 3.58 -0.10 0.29 4.12 0.30 -4.73 117.35 121.51 1jz4 s TYR 408 Ca -0.05 1.54 0.00 0.00 0.02 0.00 0.00 57.07 58.59 1jz4 s TYR 408 Cb -0.06 -3.25 -0.02 0.00 -1.52 0.00 0.00 41.96 37.10 1jz4 s TYR 408 CO -0.04 -0.56 -0.09 0.08 0.02 0.00 0.00 175.55 174.95 1jz4 s VAL 409 N 0.70 3.44 -0.38 0.71 1.01 0.20 -0.55 120.40 125.53 1jz4 s VAL 409 Ca 0.53 -0.55 -0.13 0.00 0.00 0.00 0.00 61.98 61.84 1jz4 s VAL 409 Cb -0.26 -2.43 0.02 0.00 0.00 0.00 0.00 36.38 33.71 1jz4 s VAL 409 CO 0.30 0.55 0.24 -0.69 0.00 0.00 0.00 175.10 175.50 1jz4 s VAL 410 N -0.20 4.90 -0.13 2.92 1.01 -0.63 -1.52 120.40 126.74 1jz4 s VAL 410 Ca 0.02 -0.70 -0.14 0.00 0.00 0.00 0.00 61.98 61.16 1jz4 s VAL 410 Cb -0.13 -3.70 -0.05 0.00 0.00 0.00 0.00 36.38 32.51 1jz4 s VAL 410 CO 0.03 -0.22 0.32 -0.62 0.00 0.00 0.00 175.10 174.61 1jz4 s ASP 411 N 1.62 6.51 -0.07 3.32 -1.08 -0.47 -2.16 116.67 124.33 1jz4 s ASP 411 Ca 0.04 0.60 0.01 0.00 -0.52 0.00 0.00 52.55 52.68 1jz4 s ASP 411 Cb -0.19 -2.20 0.02 0.00 -1.46 0.00 0.00 42.92 39.09 1jz4 s ASP 411 CO 0.08 0.14 -0.10 -0.70 0.52 0.00 0.00 175.17 175.11 1jz4 s GLU 412 N 0.19 1.52 0.44 4.34 2.12 -1.26 0.63 118.70 126.69 1jz4 s GLU 412 Ca 0.18 -0.33 -0.25 0.00 0.36 0.00 0.00 54.97 54.94 1jz4 s GLU 412 Cb -0.14 -1.36 -0.08 0.00 0.26 0.00 0.00 34.13 32.82 1jz4 s GLU 412 CO 0.06 -0.06 1.30 0.00 -0.54 0.00 0.00 175.26 176.02 1jz4 s ALA 413 N 0.94 3.13 -1.18 6.30 0.00 -0.82 -1.15 121.76 128.97 1jz4 s ALA 413 Ca -0.10 1.22 -0.17 0.00 0.00 0.00 0.00 51.96 52.91 1jz4 s ALA 413 Cb -0.15 -3.49 -0.04 0.00 0.00 0.00 0.00 23.12 19.44 1jz4 s ALA 413 CO 0.01 -0.93 2.13 -1.71 0.00 0.00 0.00 175.76 175.26 1jz4 n ASN 414 N -0.22 3.51 -3.68 0.00 5.15 -1.26 -3.96 115.26 114.80 1jz4 n ASN 414 Ca 0.06 -2.76 -0.25 0.00 -0.60 0.00 0.00 54.58 51.03 1jz4 n ASN 414 Cb 0.44 -1.43 -0.17 0.00 -0.53 0.00 0.00 39.78 38.09 1jz4 n ASN 414 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1jz4 s ILE 415 N 3.87 0.14 -0.13 -1.44 1.01 -1.26 -4.79 121.20 118.61 1jz4 s ILE 415 Ca 0.52 -0.13 -0.05 0.00 0.00 0.00 0.00 60.65 60.98 1jz4 s ILE 415 Cb 0.14 -0.62 0.06 0.00 0.01 0.00 0.00 42.46 42.05 1jz4 s ILE 415 CO -0.01 -0.10 0.29 -0.70 0.00 0.00 0.00 174.94 174.42 1jz4 s GLU 416 N 2.04 0.20 -0.21 2.79 2.12 0.52 -2.21 118.70 123.95 1jz4 s GLU 416 Ca 0.02 0.72 0.13 0.00 0.36 0.00 0.00 54.97 56.20 1jz4 s GLU 416 Cb -0.15 -0.02 0.44 0.00 0.26 0.00 0.00 34.13 34.66 1jz4 s GLU 416 CO -0.07 -0.24 1.19 0.25 -0.54 0.00 0.00 175.26 175.85 1jz4 n THR 417 N 4.96 1.96 -0.30 -1.70 -2.24 -1.08 -0.53 114.28 115.35 1jz4 n THR 417 Ca -0.13 -3.26 0.14 0.00 -2.27 0.00 0.00 64.05 58.53 1jz4 n THR 417 Cb 0.51 -0.24 0.31 0.00 -2.10 0.00 0.00 70.33 68.80 1jz4 n THR 417 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 1jz4 h HIS 418 N 1.52 0.47 0.00 4.78 6.17 -1.49 -0.29 115.15 126.31 1jz4 h HIS 418 Ca 0.08 0.05 0.00 0.00 0.71 0.00 0.00 60.37 61.21 1jz4 h HIS 418 Cb 1.31 -0.07 0.00 0.00 2.52 0.00 0.00 27.41 31.18 1jz4 h HIS 418 CO 0.69 -0.17 0.00 0.41 0.71 0.00 0.00 177.93 179.58 1jz4 n GLY 419 N -1.36 -0.98 3.74 5.26 0.00 -1.24 -4.75 105.19 105.85 1jz4 n GLY 419 Ca 0.22 -0.02 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 1jz4 n GLY 419 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1jz4 s MET 420 N -3.05 1.67 -0.16 1.61 -1.94 -0.12 -4.82 119.30 112.49 1jz4 s MET 420 Ca 0.06 0.98 -0.02 0.00 -1.71 0.00 0.00 55.69 55.00 1jz4 s MET 420 Cb 0.08 -1.84 0.05 0.00 2.01 0.00 0.00 34.83 35.13 1jz4 s MET 420 CO 0.25 -2.00 0.00 0.08 -0.01 0.00 0.00 175.02 173.35 1jz4 s VAL 421 N -2.91 0.65 1.00 -6.03 1.01 -1.26 -3.26 120.40 109.59 1jz4 s VAL 421 Ca 0.63 -0.42 -0.17 0.00 0.00 0.00 0.00 61.98 62.02 1jz4 s VAL 421 Cb -0.18 -0.98 0.24 0.00 0.00 0.00 0.00 36.38 35.46 1jz4 s VAL 421 CO 0.57 -0.01 1.06 -0.81 0.00 0.00 0.00 175.10 175.91 1jz4 n PRO 422 N 5.02 -2.16 0.22 2.72 -0.04 -1.26 -4.82 135.00 134.68 1jz4 n PRO 422 Ca -0.09 -1.67 0.10 0.00 -0.04 0.00 0.00 63.50 61.80 1jz4 n PRO 422 Cb 0.48 -1.35 0.65 0.00 -0.04 0.00 0.00 33.50 33.23 1jz4 n PRO 422 CO 0.00 0.00 0.00 1.98 -0.04 0.00 0.00 175.50 177.44 1jz4 h MET 423 N 0.00 0.00 -0.61 0.54 4.05 -1.84 -2.43 114.93 114.64 1jz4 h MET 423 Ca -0.37 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.05 1jz4 h MET 423 Cb 1.09 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.89 1jz4 h MET 423 CO 0.25 0.00 0.00 0.27 0.23 0.00 0.00 176.91 177.66 1jz4 n ASN 424 N -4.51 3.34 -0.28 1.39 6.94 -1.25 -3.92 115.26 116.97 1jz4 n ASN 424 Ca -0.01 -2.31 0.09 0.00 -0.02 0.00 0.00 54.58 52.33 1jz4 n ASN 424 Cb 0.17 -0.47 0.23 0.00 -2.36 0.00 0.00 39.78 37.35 1jz4 n ASN 424 CO 0.00 0.00 0.00 -0.09 -1.03 0.00 0.00 177.26 176.14 1jz4 h ARG 425 N 2.69 0.29 0.15 -3.83 2.43 -1.73 -0.07 114.38 114.31 1jz4 h ARG 425 Ca 0.00 -0.02 -0.26 0.00 -0.81 0.00 0.00 59.98 58.89 1jz4 h ARG 425 Cb 1.06 -0.07 0.01 0.00 -0.42 0.00 0.00 29.97 30.56 1jz4 h ARG 425 CO 0.16 0.19 -1.25 -0.07 -1.51 0.00 0.00 179.97 177.50 1jz4 h LEU 426 N 0.30 0.48 -1.94 3.80 3.38 -1.87 -3.33 115.31 116.14 1jz4 h LEU 426 Ca 0.48 -0.90 -0.02 0.00 0.09 0.00 0.00 57.88 57.53 1jz4 h LEU 426 Cb 0.87 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 1jz4 h LEU 426 CO -0.54 1.57 -0.10 0.71 0.09 0.00 0.00 178.44 180.17 1jz4 h THR 427 N -0.24 0.45 -0.01 0.22 1.35 -1.73 0.13 112.91 113.09 1jz4 h THR 427 Ca -0.25 -0.50 0.00 0.00 -0.55 0.00 0.00 66.41 65.11 1jz4 h THR 427 Cb 1.80 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 69.56 1jz4 h THR 427 CO 0.12 0.10 -0.15 -0.67 -0.25 0.00 0.00 175.52 174.67 1jz4 n ASP 428 N -3.52 1.26 -4.57 5.36 2.03 -0.07 -1.88 116.55 115.16 1jz4 n ASP 428 Ca -0.02 -1.16 -0.37 0.00 0.52 0.00 0.00 54.79 53.76 1jz4 n ASP 428 Cb 0.24 0.08 -0.11 0.00 -0.72 0.00 0.00 41.12 40.61 1jz4 n ASP 428 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1jz4 s ASP 429 N -2.29 5.84 0.55 1.67 -1.08 0.47 -4.53 116.67 117.30 1jz4 s ASP 429 Ca 0.30 -0.04 0.24 0.00 -0.52 0.00 0.00 52.55 52.53 1jz4 s ASP 429 Cb 0.20 -2.08 1.46 0.00 -1.46 0.00 0.00 42.92 41.04 1jz4 s ASP 429 CO 0.44 -0.03 2.09 -0.65 0.52 0.00 0.00 175.17 177.54 1jz4 h PRO 430 N 8.22 0.00 0.00 4.34 0.11 -1.89 0.37 132.00 143.15 1jz4 h PRO 430 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1jz4 h PRO 430 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1jz4 h PRO 430 CO 0.57 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.90 1jz4 n ARG 431 N -4.23 0.16 0.00 1.05 1.74 -1.26 -0.36 116.66 113.76 1jz4 n ARG 431 Ca 0.02 0.51 0.09 0.00 -0.77 0.00 0.00 57.85 57.71 1jz4 n ARG 431 Cb 0.33 -1.89 0.05 0.00 -1.02 0.00 0.00 32.46 29.93 1jz4 n ARG 431 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 1jz4 n TRP 432 N -2.21 0.00 0.04 -1.55 7.02 0.13 -4.61 117.44 116.26 1jz4 n TRP 432 Ca 0.01 0.00 -0.11 0.00 -1.02 0.00 0.00 57.50 56.38 1jz4 n TRP 432 Cb 0.14 0.00 -0.04 0.00 -2.42 0.00 0.00 31.31 28.99 1jz4 n TRP 432 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 1jz4 h LEU 433 N 3.21 -0.73 -0.30 -0.99 5.85 -0.68 -0.94 115.31 120.73 1jz4 h LEU 433 Ca 0.00 0.11 0.07 0.00 0.84 0.00 0.00 57.88 58.90 1jz4 h LEU 433 Cb 0.74 0.31 -0.08 0.00 0.37 0.00 0.00 40.66 42.01 1jz4 h LEU 433 CO 0.00 -0.30 -0.22 -0.65 -0.34 0.00 0.00 178.44 176.92 1jz4 h PRO 434 N -0.35 -0.19 -0.55 5.25 0.11 -1.82 0.82 132.00 135.27 1jz4 h PRO 434 Ca 0.08 0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.15 1jz4 h PRO 434 Cb 0.46 0.04 -0.03 0.00 0.11 0.00 0.00 31.00 31.59 1jz4 h PRO 434 CO -0.25 -0.13 0.14 0.00 -0.21 0.00 0.00 178.00 177.55 1jz4 h ALA 435 N 0.92 1.22 -0.32 -0.75 0.00 -1.71 -2.67 119.26 115.95 1jz4 h ALA 435 Ca 0.16 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 1jz4 h ALA 435 Cb 0.44 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1jz4 h ALA 435 CO -0.42 0.54 -0.15 0.52 0.00 0.00 0.00 179.25 179.74 1jz4 h MET 436 N 0.80 0.67 -0.83 0.00 2.86 -0.34 -3.21 114.93 114.89 1jz4 h MET 436 Ca 0.18 -0.29 0.20 0.00 -2.06 0.00 0.00 59.70 57.73 1jz4 h MET 436 Cb 0.28 -0.02 -0.13 0.00 0.06 0.00 0.00 31.60 31.79 1jz4 h MET 436 CO -0.00 0.88 0.18 0.66 1.06 0.00 0.00 176.91 179.69 1jz4 h SER 437 N 0.44 -0.06 0.90 1.22 4.64 0.97 -1.27 113.55 120.38 1jz4 h SER 437 Ca 0.07 0.19 -0.08 0.00 -0.47 0.00 0.00 61.79 61.50 1jz4 h SER 437 Cb 0.68 0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 63.02 1jz4 h SER 437 CO 0.05 -0.13 -0.37 -0.33 -0.87 0.00 0.00 176.83 175.18 1jz4 h GLU 438 N 0.21 0.00 -0.18 4.77 5.08 -1.52 0.42 114.58 123.36 1jz4 h GLU 438 Ca 0.49 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.75 1jz4 h GLU 438 Cb 0.94 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 1jz4 h GLU 438 CO -0.63 0.37 -0.34 0.00 -1.00 0.00 0.00 179.01 177.42 1jz4 h ARG 439 N 0.00 0.38 0.00 2.33 3.08 -1.28 -0.50 114.38 118.39 1jz4 h ARG 439 Ca -0.00 -0.16 -0.10 0.00 0.07 0.00 0.00 59.98 59.79 1jz4 h ARG 439 Cb 0.92 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.94 1jz4 h ARG 439 CO 0.05 0.67 -0.70 0.28 -1.07 0.00 0.00 179.97 179.20 1jz4 h VAL 440 N 0.32 0.65 -0.57 2.04 2.07 -1.12 -3.32 116.25 116.33 1jz4 h VAL 440 Ca 0.04 -1.70 -0.05 0.00 0.82 0.00 0.00 66.70 65.81 1jz4 h VAL 440 Cb 0.75 1.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.94 1jz4 h VAL 440 CO 0.06 0.22 0.16 0.71 0.02 0.00 0.00 177.57 178.74 1jz4 h THR 441 N -1.00 1.23 -0.08 2.57 1.35 -0.22 -2.23 112.91 114.53 1jz4 h THR 441 Ca -0.15 -0.79 -0.07 0.00 -0.55 0.00 0.00 66.41 64.85 1jz4 h THR 441 Cb 0.86 0.61 -0.01 0.00 -1.73 0.00 0.00 68.15 67.88 1jz4 h THR 441 CO -0.09 0.30 -0.26 0.03 -0.25 0.00 0.00 175.52 175.25 1jz4 h ARG 442 N 0.84 0.14 -0.29 4.72 3.08 -1.29 -0.88 114.38 120.70 1jz4 h ARG 442 Ca 0.19 -0.04 -0.11 0.00 0.07 0.00 0.00 59.98 60.08 1jz4 h ARG 442 Cb 0.27 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 1jz4 h ARG 442 CO -0.01 0.40 -0.25 1.98 -1.07 0.00 0.00 179.97 181.03 1jz4 h MET 443 N 0.13 0.69 -0.41 0.04 4.05 -1.55 -2.21 114.93 115.66 1jz4 h MET 443 Ca 0.02 -0.35 -0.14 0.00 -0.28 0.00 0.00 59.70 58.95 1jz4 h MET 443 Cb 0.54 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.33 1jz4 h MET 443 CO 0.04 0.95 -0.31 0.28 0.23 0.00 0.00 176.91 178.11 1jz4 h VAL 444 N 0.43 1.27 -0.48 -5.77 2.07 -1.14 -1.25 116.25 111.38 1jz4 h VAL 444 Ca 0.05 -1.47 0.02 0.00 0.82 0.00 0.00 66.70 66.11 1jz4 h VAL 444 Cb 0.81 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.85 1jz4 h VAL 444 CO 0.06 0.50 0.32 1.56 0.02 0.00 0.00 177.57 180.03 1jz4 h GLN 445 N 0.77 0.59 0.13 1.57 4.20 -1.11 -1.63 115.11 119.64 1jz4 h GLN 445 Ca 0.08 -0.04 -0.20 0.00 0.06 0.00 0.00 58.65 58.55 1jz4 h GLN 445 Cb 0.89 -0.13 0.01 0.00 0.30 0.00 0.00 27.48 28.55 1jz4 h GLN 445 CO 0.08 0.39 -0.95 -0.09 -0.67 0.00 0.00 178.83 177.59 1jz4 h ARG 446 N 0.61 0.28 0.00 1.46 2.43 -1.16 -2.85 114.38 115.15 1jz4 h ARG 446 Ca 0.18 -0.47 0.00 0.00 -0.81 0.00 0.00 59.98 58.88 1jz4 h ARG 446 Cb -0.00 0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 1jz4 h ARG 446 CO -0.04 1.23 -0.73 -0.25 -1.51 0.00 0.00 179.97 178.67 1jz4 n ASP 447 N -4.09 0.71 0.32 -3.80 8.00 -0.49 -4.22 116.55 112.98 1jz4 n ASP 447 Ca -0.17 -0.56 0.17 0.00 0.71 0.00 0.00 54.79 54.94 1jz4 n ASP 447 Cb 0.83 0.58 0.90 0.00 -0.02 0.00 0.00 41.12 43.42 1jz4 n ASP 447 CO 0.00 0.00 0.00 0.08 -0.39 0.00 0.00 177.20 176.89 1jz4 h ARG 448 N 0.00 0.00 -0.01 -1.24 0.11 -1.51 -0.91 114.38 110.81 1jz4 h ARG 448 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1jz4 h ARG 448 Cb 0.51 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.59 1jz4 h ARG 448 CO 0.00 0.00 -0.23 0.09 0.10 0.00 0.00 179.97 179.93 1jz4 n ASN 449 N -3.01 1.43 -4.68 0.08 3.02 -1.26 -4.86 115.26 105.98 1jz4 n ASN 449 Ca -0.02 -1.20 -0.43 0.00 -0.03 0.00 0.00 54.58 52.91 1jz4 n ASN 449 Cb 0.32 0.16 -0.02 0.00 -0.61 0.00 0.00 39.78 39.63 1jz4 n ASN 449 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1jz4 s HIS 450 N -2.37 3.41 0.46 3.10 3.76 -0.35 -4.85 115.29 118.45 1jz4 s HIS 450 Ca 0.26 1.50 0.13 0.00 -0.15 0.00 0.00 55.06 56.80 1jz4 s HIS 450 Cb 0.19 -3.25 1.05 0.00 1.11 0.00 0.00 32.58 31.69 1jz4 s HIS 450 CO 0.48 -0.45 2.06 -1.00 -0.85 0.00 0.00 174.74 174.98 1jz4 h PRO 451 N 7.27 0.17 0.00 8.40 0.13 -1.88 -2.77 132.00 143.32 1jz4 h PRO 451 Ca -0.28 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 64.82 1jz4 h PRO 451 Cb 1.12 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 32.22 1jz4 h PRO 451 CO 0.90 0.18 -0.09 0.66 -0.23 0.00 0.00 178.00 179.41 1jz4 h SER 452 N 0.17 0.00 -3.11 1.44 4.64 -1.87 -3.39 113.55 111.43 1jz4 h SER 452 Ca 0.04 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.79 1jz4 h SER 452 Cb 0.10 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.14 1jz4 h SER 452 CO 0.00 0.09 0.98 -0.69 -0.87 0.00 0.00 176.83 176.34 1jz4 s VAL 453 N -4.78 4.11 -0.09 0.95 1.01 -1.05 0.61 120.40 121.16 1jz4 s VAL 453 Ca -0.04 1.25 0.07 0.00 0.00 0.00 0.00 61.98 63.25 1jz4 s VAL 453 Cb 0.16 -4.12 -0.09 0.00 0.00 0.00 0.00 36.38 32.33 1jz4 s VAL 453 CO 0.67 -0.45 0.18 2.30 0.00 0.00 0.00 175.10 177.79 1jz4 n ILE 454 N 6.21 0.00 -3.82 2.22 -5.35 -0.58 -4.91 119.36 113.13 1jz4 n ILE 454 Ca 0.15 -0.21 -0.13 0.00 -0.27 0.00 0.00 62.75 62.29 1jz4 n ILE 454 Cb 0.46 0.53 -0.14 0.00 -1.74 0.00 0.00 39.64 38.76 1jz4 n ILE 454 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1jz4 s ILE 455 N -2.21 -0.02 -0.15 7.28 1.01 -1.20 -3.68 121.20 122.22 1jz4 s ILE 455 Ca -0.01 0.07 -0.08 0.00 0.00 0.00 0.00 60.65 60.63 1jz4 s ILE 455 Cb 0.04 -0.10 -0.04 0.00 0.01 0.00 0.00 42.46 42.37 1jz4 s ILE 455 CO 0.27 0.03 0.13 0.26 0.00 0.00 0.00 174.94 175.63 1jz4 s TRP 456 N 0.40 3.50 -0.09 3.97 0.52 -0.20 -1.37 118.94 125.67 1jz4 s TRP 456 Ca -0.03 0.42 0.02 0.00 0.02 0.00 0.00 56.10 56.53 1jz4 s TRP 456 Cb -0.05 -2.03 -0.02 0.00 -1.15 0.00 0.00 33.47 30.22 1jz4 s TRP 456 CO -0.01 0.53 -0.14 0.45 0.02 0.00 0.00 176.95 177.79 1jz4 s SER 457 N -0.41 3.97 0.00 2.95 0.15 0.21 0.12 113.70 120.69 1jz4 s SER 457 Ca 0.12 -0.27 0.12 0.00 0.70 0.00 0.00 55.95 56.62 1jz4 s SER 457 Cb -0.12 -1.19 0.70 0.00 -1.71 0.00 0.00 66.02 63.71 1jz4 s SER 457 CO 0.01 0.26 1.45 0.18 1.20 0.00 0.00 173.24 176.35 1jz4 n LEU 458 N 2.88 0.12 0.00 3.45 4.77 -0.95 -1.94 117.00 125.33 1jz4 n LEU 458 Ca -0.18 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 1jz4 n LEU 458 Cb 0.52 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 1jz4 n LEU 458 CO 0.28 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 1jz4 n GLY 459 N 0.71 0.59 3.35 -0.72 0.00 -1.25 -4.68 105.19 103.18 1jz4 n GLY 459 Ca 0.09 -1.96 -0.14 0.00 0.00 0.00 0.00 46.02 44.01 1jz4 n GLY 459 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1jz4 s ASN 460 N -4.00 -0.43 -0.91 1.61 2.47 -0.94 -4.74 114.94 108.00 1jz4 s ASN 460 Ca 0.00 0.68 -0.25 0.00 0.42 0.00 0.00 52.86 53.72 1jz4 s ASN 460 Cb 0.00 0.73 0.03 0.00 -1.45 0.00 0.00 41.25 40.56 1jz4 s ASN 460 CO 0.00 -0.30 0.52 -0.62 -3.72 0.00 0.00 177.10 172.99 1jz4 n GLU 461 N 2.16 -0.48 -0.79 0.43 1.02 -1.26 -4.09 120.64 117.63 1jz4 n GLU 461 Ca -0.16 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.03 1jz4 n GLU 461 Cb 0.57 -1.69 0.13 0.00 -0.02 0.00 0.00 31.44 30.43 1jz4 n GLU 461 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1jz4 n SER 462 N -1.51 1.47 0.00 1.62 7.64 -1.26 -1.42 113.62 120.16 1jz4 n SER 462 Ca -0.11 -3.14 0.00 0.00 1.01 0.00 0.00 58.87 56.64 1jz4 n SER 462 Cb 0.45 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 1jz4 n SER 462 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1jz4 n GLY 463 N -0.62 0.80 2.86 0.23 0.00 -1.25 -3.85 105.19 103.36 1jz4 n GLY 463 Ca 0.14 -0.76 -0.28 0.00 0.00 0.00 0.00 46.02 45.11 1jz4 n GLY 463 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1jz4 s HIS 464 N 0.00 1.58 0.32 1.61 2.46 -1.26 -3.51 115.29 116.49 1jz4 s HIS 464 Ca 0.00 -1.06 0.10 0.00 0.47 0.00 0.00 55.06 54.57 1jz4 s HIS 464 Cb 0.00 -1.25 -0.06 0.00 -0.13 0.00 0.00 32.58 31.14 1jz4 s HIS 464 CO 0.00 -0.62 -0.08 0.20 -2.47 0.00 0.00 174.74 171.77 1jz4 s GLY 465 N 1.67 2.04 0.57 1.59 0.00 -1.26 -4.84 107.32 107.10 1jz4 s GLY 465 Ca -0.00 -1.97 0.31 0.00 0.00 0.00 0.00 44.72 43.07 1jz4 s GLY 465 CO -0.07 -1.95 2.19 0.00 0.00 0.00 0.00 173.10 173.27 1jz4 h ALA 466 N 2.00 1.32 0.00 3.20 0.00 -1.79 0.22 119.26 124.22 1jz4 h ALA 466 Ca -0.42 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.41 1jz4 h ALA 466 Cb 1.25 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1jz4 h ALA 466 CO 0.66 0.06 -0.18 -0.91 0.00 0.00 0.00 179.25 178.88 1jz4 h ASN 467 N 0.00 0.00 -0.26 0.00 2.35 -1.68 -0.93 115.58 115.06 1jz4 h ASN 467 Ca -0.00 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.69 1jz4 h ASN 467 Cb 0.15 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 1jz4 h ASN 467 CO 0.01 0.18 -0.06 0.45 -1.65 0.00 0.00 177.43 176.36 1jz4 h HIS 468 N 0.00 0.57 -0.61 1.19 3.86 -0.74 -1.52 115.15 117.90 1jz4 h HIS 468 Ca -0.00 -0.12 -0.04 0.00 -1.16 0.00 0.00 60.37 59.05 1jz4 h HIS 468 Cb 0.40 -0.14 -0.03 0.00 1.06 0.00 0.00 27.41 28.71 1jz4 h HIS 468 CO 0.00 0.71 0.23 -0.44 0.86 0.00 0.00 177.93 179.29 1jz4 h ASP 469 N 0.26 0.85 -0.63 2.45 3.32 -1.20 0.13 116.42 121.59 1jz4 h ASP 469 Ca 0.07 -0.18 -0.01 0.00 0.02 0.00 0.00 57.03 56.92 1jz4 h ASP 469 Cb 0.53 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.83 1jz4 h ASP 469 CO 0.03 0.80 0.35 0.00 -1.72 0.00 0.00 179.24 178.70 1jz4 h ALA 470 N 1.08 0.81 -0.28 3.45 0.00 -1.11 -1.38 119.26 121.84 1jz4 h ALA 470 Ca 0.20 -0.10 -0.14 0.00 0.00 0.00 0.00 54.91 54.87 1jz4 h ALA 470 Cb 0.23 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1jz4 h ALA 470 CO -0.01 0.32 -0.42 -0.07 0.00 0.00 0.00 179.25 179.07 1jz4 h LEU 471 N 0.86 0.72 -0.49 0.00 3.38 -0.85 -2.26 115.31 116.68 1jz4 h LEU 471 Ca 0.22 -0.33 0.05 0.00 0.09 0.00 0.00 57.88 57.91 1jz4 h LEU 471 Cb 0.03 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.53 1jz4 h LEU 471 CO -0.04 1.05 0.21 0.22 0.09 0.00 0.00 178.44 179.97 1jz4 h TYR 472 N 0.55 0.38 -0.14 1.13 3.20 -0.58 -1.48 116.97 120.04 1jz4 h TYR 472 Ca 0.04 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.94 1jz4 h TYR 472 Cb 0.95 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 39.12 1jz4 h TYR 472 CO 0.05 0.16 0.09 -0.09 -1.64 0.00 0.00 178.16 176.73 1jz4 h ARG 473 N 0.42 0.19 -0.28 1.82 9.65 -1.08 -0.96 114.38 124.14 1jz4 h ARG 473 Ca 0.22 -0.01 0.06 0.00 -1.10 0.00 0.00 59.98 59.15 1jz4 h ARG 473 Cb 0.18 -0.04 -0.07 0.00 -1.39 0.00 0.00 29.97 28.66 1jz4 h ARG 473 CO -0.19 0.13 -0.16 2.35 2.80 0.00 0.00 179.97 184.90 1jz4 h TRP 474 N 0.18 -0.41 0.07 2.20 7.01 -1.09 0.16 115.95 124.07 1jz4 h TRP 474 Ca 0.05 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.09 1jz4 h TRP 474 Cb -0.01 0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 27.27 1jz4 h TRP 474 CO -0.07 -0.24 -0.06 0.82 -2.79 0.00 0.00 178.44 176.11 1jz4 h ILE 475 N -0.14 0.86 -0.79 2.65 2.04 -1.00 0.59 117.51 121.72 1jz4 h ILE 475 Ca 0.15 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.17 1jz4 h ILE 475 Cb 0.36 0.86 -0.05 0.00 -0.74 0.00 0.00 36.82 37.25 1jz4 h ILE 475 CO -0.36 0.00 0.53 0.11 0.00 0.00 0.00 178.15 178.43 1jz4 h LYS 476 N -0.14 0.39 0.20 2.37 1.79 -0.35 0.61 116.57 121.44 1jz4 h LYS 476 Ca 0.00 -0.02 -0.31 0.00 -2.18 0.00 0.00 60.65 58.14 1jz4 h LYS 476 Cb 0.13 -0.09 0.03 0.00 -1.58 0.00 0.00 32.23 30.73 1jz4 h LYS 476 CO -0.01 0.26 -1.33 0.77 -1.08 0.00 0.00 179.45 178.06 1jz4 h SER 477 N 0.40 0.82 0.21 0.86 0.02 0.15 -3.30 113.55 112.72 1jz4 h SER 477 Ca 0.39 -0.89 -0.21 0.00 -0.84 0.00 0.00 61.79 60.24 1jz4 h SER 477 Cb 0.94 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.22 1jz4 h SER 477 CO -0.13 1.64 -0.84 0.58 -1.14 0.00 0.00 176.83 176.95 1jz4 h VAL 478 N 0.13 1.37 -2.22 2.27 2.07 0.81 -3.41 116.25 117.25 1jz4 h VAL 478 Ca -0.22 -2.24 -0.51 0.00 0.82 0.00 0.00 66.70 64.55 1jz4 h VAL 478 Cb 2.03 2.23 -0.35 0.00 -1.52 0.00 0.00 31.29 33.67 1jz4 h VAL 478 CO 0.25 0.68 -0.84 -0.62 0.02 0.00 0.00 177.57 177.06 1jz4 s ASP 479 N -7.06 1.55 0.00 0.57 2.15 0.20 -4.93 116.67 109.15 1jz4 s ASP 479 Ca -0.07 -2.41 0.18 0.00 0.43 0.00 0.00 52.55 50.68 1jz4 s ASP 479 Cb 0.09 -0.02 0.96 0.00 -0.30 0.00 0.00 42.92 43.65 1jz4 s ASP 479 CO 0.87 -0.22 1.49 -0.81 -0.17 0.00 0.00 175.17 176.33 1jz4 n PRO 480 N 3.47 0.39 0.16 4.34 -0.04 -1.24 -3.36 135.00 138.72 1jz4 n PRO 480 Ca 0.20 0.07 0.13 0.00 -0.04 0.00 0.00 63.50 63.86 1jz4 n PRO 480 Cb 0.45 -1.50 0.47 0.00 -0.04 0.00 0.00 33.50 32.88 1jz4 n PRO 480 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1jz4 h SER 481 N 0.00 0.00 -4.26 3.54 4.64 -1.91 -3.45 113.55 112.11 1jz4 h SER 481 Ca 0.00 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.83 1jz4 h SER 481 Cb 0.09 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 61.90 1jz4 h SER 481 CO 0.00 0.00 -0.81 -0.13 -0.87 0.00 0.00 176.83 175.02 1jz4 s ARG 482 N -3.32 1.16 0.75 4.77 0.52 -1.21 -4.31 118.95 117.31 1jz4 s ARG 482 Ca 0.06 -0.62 -0.13 0.00 -0.52 0.00 0.00 55.73 54.51 1jz4 s ARG 482 Cb 0.10 -1.15 0.05 0.00 0.52 0.00 0.00 34.95 34.46 1jz4 s ARG 482 CO 0.50 0.31 1.13 -2.14 0.02 0.00 0.00 175.30 175.12 1jz4 s PRO 483 N -0.61 2.23 -0.13 3.54 0.02 -1.24 -4.80 135.00 134.00 1jz4 s PRO 483 Ca 0.05 1.43 0.02 0.00 0.02 0.00 0.00 61.00 62.53 1jz4 s PRO 483 Cb -0.06 -1.88 0.00 0.00 0.02 0.00 0.00 34.50 32.58 1jz4 s PRO 483 CO 0.00 -1.70 -0.21 0.08 -0.33 0.00 0.00 177.00 174.84 1jz4 s VAL 484 N -2.47 2.25 0.25 3.83 1.01 -1.26 -1.04 120.40 122.98 1jz4 s VAL 484 Ca 0.67 -0.93 0.06 0.00 0.00 0.00 0.00 61.98 61.78 1jz4 s VAL 484 Cb -0.22 -1.90 -0.05 0.00 0.00 0.00 0.00 36.38 34.21 1jz4 s VAL 484 CO 0.49 0.54 -0.07 0.00 0.00 0.00 0.00 175.10 176.06 1jz4 s GLN 485 N 0.66 1.46 -0.28 2.72 -2.07 0.12 0.27 119.66 122.54 1jz4 s GLN 485 Ca -0.10 -1.72 -0.22 0.00 -1.82 0.00 0.00 55.36 51.50 1jz4 s GLN 485 Cb -0.16 -1.05 0.11 0.00 -1.09 0.00 0.00 33.01 30.82 1jz4 s GLN 485 CO 0.02 0.05 0.90 -0.47 -1.32 0.00 0.00 175.29 174.46 1jz4 s TYR 486 N -3.08 -0.66 -0.14 9.60 5.04 -1.26 -2.23 117.35 124.62 1jz4 s TYR 486 Ca 0.27 1.49 0.22 0.00 -2.44 0.00 0.00 57.07 56.61 1jz4 s TYR 486 Cb 0.03 0.38 -0.24 0.00 0.35 0.00 0.00 41.96 42.48 1jz4 s TYR 486 CO 0.10 -0.32 0.65 -1.91 -1.34 0.00 0.00 175.55 172.73 1jz4 n GLU 487 N 2.97 0.60 -1.58 4.97 0.00 -1.26 -4.63 120.64 121.72 1jz4 n GLU 487 Ca -0.15 -0.11 -0.41 0.00 0.00 0.00 0.00 57.16 56.49 1jz4 n GLU 487 Cb 0.57 -1.59 0.02 0.00 0.00 0.00 0.00 31.44 30.43 1jz4 n GLU 487 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1jz4 n GLY 488 N 1.26 -0.49 2.21 8.31 0.00 -1.26 -0.23 105.19 114.99 1jz4 n GLY 488 Ca -0.02 0.08 -0.10 0.00 0.00 0.00 0.00 46.02 45.98 1jz4 n GLY 488 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jz4 n GLY 489 N 1.32 0.35 0.00 -0.02 0.00 -1.23 -3.76 105.19 101.85 1jz4 n GLY 489 Ca 0.10 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.60 1jz4 n GLY 489 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jz4 n GLY 490 N -1.27 1.10 3.05 -0.02 0.00 -1.21 -4.71 105.19 102.13 1jz4 n GLY 490 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1jz4 n GLY 490 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jz4 n ALA 491 N -0.20 0.00 -2.46 4.61 0.00 0.68 -4.72 120.51 118.41 1jz4 n ALA 491 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 1jz4 n ALA 491 Cb 0.00 -1.47 0.01 0.00 0.00 0.00 0.00 19.45 17.99 1jz4 n ALA 491 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1jz4 n ASP 492 N -0.93 0.51 -4.60 0.00 5.68 -1.26 -2.24 116.55 113.70 1jz4 n ASP 492 Ca 0.00 -2.02 -0.29 0.00 -0.50 0.00 0.00 54.79 51.98 1jz4 n ASP 492 Cb 0.47 -0.14 0.13 0.00 -1.14 0.00 0.00 41.12 40.44 1jz4 n ASP 492 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 1jz4 s THR 493 N -0.65 2.00 -2.00 2.12 -4.23 -1.26 -4.92 115.64 106.70 1jz4 s THR 493 Ca 0.24 0.00 0.16 0.00 -1.18 0.00 0.00 61.69 60.91 1jz4 s THR 493 Cb 0.30 -2.99 0.44 0.00 1.34 0.00 0.00 72.50 71.60 1jz4 s THR 493 CO -0.11 0.00 1.36 0.35 -0.54 0.00 0.00 174.62 175.68 1jz4 n THR 494 N -3.51 0.00 -0.82 3.99 -2.24 -1.26 -2.55 114.28 107.89 1jz4 n THR 494 Ca 0.11 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.97 1jz4 n THR 494 Cb 0.60 -0.64 0.37 0.00 -2.10 0.00 0.00 70.33 68.56 1jz4 n THR 494 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1jz4 n ALA 495 N -0.93 3.48 -3.22 6.98 0.00 -1.26 -4.94 120.51 120.62 1jz4 n ALA 495 Ca 0.12 -1.87 -0.13 0.00 0.00 0.00 0.00 53.44 51.56 1jz4 n ALA 495 Cb 0.05 -1.01 -0.14 0.00 0.00 0.00 0.00 19.45 18.35 1jz4 n ALA 495 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1jz4 s THR 496 N -2.46 -0.02 -0.71 0.00 -1.32 -1.06 -4.00 115.64 106.07 1jz4 s THR 496 Ca 0.51 0.08 0.25 0.00 -1.21 0.00 0.00 61.69 61.32 1jz4 s THR 496 Cb 0.37 -0.07 0.16 0.00 -1.51 0.00 0.00 72.50 71.46 1jz4 s THR 496 CO 0.18 0.03 1.55 0.47 -2.21 0.00 0.00 174.62 174.64 1jz4 n ASP 497 N 3.49 0.72 -4.16 8.08 8.00 0.14 -4.84 116.55 127.98 1jz4 n ASP 497 Ca -0.18 0.33 -0.26 0.00 0.71 0.00 0.00 54.79 55.38 1jz4 n ASP 497 Cb 0.56 -0.29 -0.16 0.00 -0.02 0.00 0.00 41.12 41.21 1jz4 n ASP 497 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1jz4 s ILE 498 N -3.12 1.49 -0.32 0.53 1.01 -1.26 -4.52 121.20 115.00 1jz4 s ILE 498 Ca 0.09 -0.76 -0.29 0.00 0.00 0.00 0.00 60.65 59.68 1jz4 s ILE 498 Cb 0.13 -1.27 -0.00 0.00 0.01 0.00 0.00 42.46 41.33 1jz4 s ILE 498 CO 0.66 0.43 1.40 -0.63 0.00 0.00 0.00 174.94 176.79 1jz4 s ILE 499 N -0.08 3.98 -0.50 2.92 1.01 0.15 -4.73 121.20 123.95 1jz4 s ILE 499 Ca -0.01 1.07 0.08 0.00 0.00 0.00 0.00 60.65 61.79 1jz4 s ILE 499 Cb -0.11 -4.09 0.32 0.00 0.01 0.00 0.00 42.46 38.59 1jz4 s ILE 499 CO 0.02 -0.54 0.81 0.00 0.00 0.00 0.00 174.94 175.23 1jz4 s PRO 501 N -2.77 0.74 -0.18 0.00 0.04 -1.26 -3.77 135.00 127.80 1jz4 s PRO 501 Ca 0.43 0.34 -0.00 0.00 0.04 0.00 0.00 61.00 61.81 1jz4 s PRO 501 Cb 0.27 -1.79 0.01 0.00 0.04 0.00 0.00 34.50 33.03 1jz4 s PRO 501 CO -0.10 -2.48 -0.15 0.00 0.04 0.00 0.00 177.00 174.31 1jz4 s MET 502 N -5.17 3.14 -1.43 4.56 0.23 -1.25 -1.70 119.30 117.67 1jz4 s MET 502 Ca 0.65 -0.76 0.00 0.00 -1.03 0.00 0.00 55.69 54.55 1jz4 s MET 502 Cb -0.16 -2.68 0.00 0.00 -1.53 0.00 0.00 34.83 30.46 1jz4 s MET 502 CO 0.55 -0.14 0.00 0.66 -2.03 0.00 0.00 175.02 174.06 1jz4 n TYR 503 N 4.49 -0.24 -2.13 3.16 4.02 0.17 -4.98 117.16 121.65 1jz4 n TYR 503 Ca -0.20 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.28 1jz4 n TYR 503 Cb 0.51 -2.74 -0.03 0.00 -0.02 0.00 0.00 39.34 37.06 1jz4 n TYR 503 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1jz4 s ALA 504 N -2.60 3.59 0.64 -0.72 0.00 -1.26 -4.90 121.76 116.50 1jz4 s ALA 504 Ca 0.00 1.18 -0.07 0.00 0.00 0.00 0.00 51.96 53.07 1jz4 s ALA 504 Cb 0.00 -3.53 0.02 0.00 0.00 0.00 0.00 23.12 19.61 1jz4 s ALA 504 CO 0.00 -0.63 0.97 1.03 0.00 0.00 0.00 175.76 177.13 1jz4 s ARG 505 N 0.30 2.79 0.01 0.00 0.52 -1.26 -4.80 118.95 116.52 1jz4 s ARG 505 Ca 0.61 0.08 -0.26 0.00 -0.52 0.00 0.00 55.73 55.63 1jz4 s ARG 505 Cb -0.38 -2.19 -0.15 0.00 0.52 0.00 0.00 34.95 32.74 1jz4 s ARG 505 CO 0.36 -0.87 1.15 0.28 0.02 0.00 0.00 175.30 176.25 1jz4 h VAL 506 N -0.36 0.20 0.00 3.52 2.07 -1.93 -1.33 116.25 118.42 1jz4 h VAL 506 Ca -0.45 -0.37 -0.11 0.00 0.82 0.00 0.00 66.70 66.59 1jz4 h VAL 506 Cb 1.26 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 1jz4 h VAL 506 CO 0.61 0.03 -1.75 0.47 0.02 0.00 0.00 177.57 176.95 1jz4 n ASP 507 N -5.33 1.83 -4.69 0.57 8.00 -1.26 -3.23 116.55 112.43 1jz4 n ASP 507 Ca -0.11 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 54.99 1jz4 n ASP 507 Cb 0.34 1.25 -0.05 0.00 -0.02 0.00 0.00 41.12 42.64 1jz4 n ASP 507 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1jz4 s GLU 508 N -2.66 4.32 0.52 -1.24 2.12 -1.26 -4.71 118.70 115.79 1jz4 s GLU 508 Ca -0.06 0.69 -0.12 0.00 0.36 0.00 0.00 54.97 55.84 1jz4 s GLU 508 Cb 0.07 -3.50 -0.06 0.00 0.26 0.00 0.00 34.13 30.90 1jz4 s GLU 508 CO 0.55 -0.05 0.93 -0.51 -0.54 0.00 0.00 175.26 175.64 1jz4 s ASP 509 N 0.92 6.45 -0.39 -1.70 1.01 -1.26 -3.75 116.67 117.95 1jz4 s ASP 509 Ca 0.32 1.36 0.03 0.00 0.71 0.00 0.00 52.55 54.96 1jz4 s ASP 509 Cb -0.16 -2.43 0.16 0.00 1.01 0.00 0.00 42.92 41.50 1jz4 s ASP 509 CO 0.13 -0.62 0.35 -1.10 0.21 0.00 0.00 175.17 174.13 1jz4 s GLN 510 N -4.40 0.76 -1.37 8.23 -0.21 -0.39 -4.91 119.66 117.37 1jz4 s GLN 510 Ca 0.55 -1.53 -0.09 0.00 0.02 0.00 0.00 55.36 54.31 1jz4 s GLN 510 Cb -0.10 -1.11 -0.11 0.00 1.00 0.00 0.00 33.01 32.69 1jz4 s GLN 510 CO 0.39 -1.29 2.97 -0.35 -2.12 0.00 0.00 175.29 174.89 1jz4 n PRO 511 N 3.49 3.36 -1.91 2.91 -0.04 -1.26 0.16 135.00 141.72 1jz4 n PRO 511 Ca 0.20 -1.99 -0.40 0.00 -0.04 0.00 0.00 63.50 61.27 1jz4 n PRO 511 Cb 0.45 -2.67 0.00 0.00 -0.04 0.00 0.00 33.50 31.24 1jz4 n PRO 511 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1jz4 s PHE 512 N 2.13 2.67 0.36 0.54 0.40 -1.26 -4.83 117.98 117.98 1jz4 s PHE 512 Ca 0.67 1.30 -0.28 0.00 -0.60 0.00 0.00 56.93 58.01 1jz4 s PHE 512 Cb 0.19 -3.85 -0.11 0.00 0.51 0.00 0.00 43.02 39.76 1jz4 s PHE 512 CO -0.05 -2.58 1.45 -2.14 0.70 0.00 0.00 175.22 172.59 1jz4 s PRO 513 N -2.21 4.17 0.00 0.24 0.02 -1.26 -1.19 135.00 134.77 1jz4 s PRO 513 Ca 0.56 2.48 0.00 0.00 0.02 0.00 0.00 61.00 64.06 1jz4 s PRO 513 Cb -0.42 -3.00 0.00 0.00 0.02 0.00 0.00 34.50 31.10 1jz4 s PRO 513 CO 0.56 -0.45 0.00 0.00 -0.33 0.00 0.00 177.00 176.78 1jz4 n ALA 514 N 0.67 0.00 -3.11 -1.55 0.00 -1.26 -4.43 120.51 110.83 1jz4 n ALA 514 Ca 0.01 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.22 1jz4 n ALA 514 Cb 0.40 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.80 1jz4 n ALA 514 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1jz4 n VAL 515 N 0.00 1.44 -1.67 0.00 0.24 -1.17 -4.82 118.33 112.35 1jz4 n VAL 515 Ca 0.00 -5.03 -0.34 0.00 -2.04 0.00 0.00 64.34 56.93 1jz4 n VAL 515 Cb 0.00 -1.10 0.06 0.00 -1.47 0.00 0.00 33.84 31.33 1jz4 n VAL 515 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1jz4 s PRO 516 N -2.77 2.57 -0.66 7.34 0.04 -0.34 -4.46 135.00 136.73 1jz4 s PRO 516 Ca 0.43 1.57 -0.03 0.00 0.04 0.00 0.00 61.00 63.02 1jz4 s PRO 516 Cb 0.28 -1.90 0.17 0.00 0.04 0.00 0.00 34.50 33.09 1jz4 s PRO 516 CO -0.10 -1.46 0.48 0.15 0.04 0.00 0.00 177.00 176.10 1jz4 s LYS 517 N -3.93 2.65 0.62 4.56 1.02 0.12 -4.86 119.74 119.92 1jz4 s LYS 517 Ca 0.71 -2.63 -0.16 0.00 0.02 0.00 0.00 55.97 53.91 1jz4 s LYS 517 Cb -0.25 -3.76 -0.02 0.00 -0.52 0.00 0.00 37.83 33.29 1jz4 s LYS 517 CO 0.42 -1.19 1.10 -1.58 -0.92 0.00 0.00 175.35 173.18 1jz4 s TRP 518 N -0.23 2.73 0.25 3.18 0.52 -1.26 -1.26 118.94 122.88 1jz4 s TRP 518 Ca 0.18 1.54 -0.30 0.00 0.02 0.00 0.00 56.10 57.54 1jz4 s TRP 518 Cb -0.19 -3.15 -0.14 0.00 -1.15 0.00 0.00 33.47 28.85 1jz4 s TRP 518 CO -0.04 -1.49 1.28 0.45 0.02 0.00 0.00 176.95 177.16 1jz4 n SER 519 N -2.08 2.28 -0.18 2.95 2.88 -1.25 -4.42 113.62 113.81 1jz4 n SER 519 Ca 0.10 1.16 -0.00 0.00 -1.33 0.00 0.00 58.87 58.80 1jz4 n SER 519 Cb 0.52 -1.38 0.23 0.00 -0.75 0.00 0.00 64.21 62.83 1jz4 n SER 519 CO 0.00 0.00 0.00 0.16 -1.23 0.00 0.00 175.04 173.97 1jz4 h ILE 520 N 2.72 1.20 -0.66 2.46 3.07 -1.21 0.13 117.51 125.22 1jz4 h ILE 520 Ca -0.44 -0.49 -0.04 0.00 1.55 0.00 0.00 64.86 65.44 1jz4 h ILE 520 Cb 1.30 0.28 -0.03 0.00 -0.27 0.00 0.00 36.82 38.10 1jz4 h ILE 520 CO 0.70 0.22 0.27 0.11 -1.05 0.00 0.00 178.15 178.40 1jz4 h LYS 521 N 0.94 0.99 -0.48 0.16 1.57 -1.84 -2.99 116.57 114.92 1jz4 h LYS 521 Ca 0.24 -0.17 -0.10 0.00 -1.87 0.00 0.00 60.65 58.75 1jz4 h LYS 521 Cb 0.01 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.14 1jz4 h LYS 521 CO -0.04 0.82 -0.08 -0.22 -0.57 0.00 0.00 179.45 179.36 1jz4 h LYS 522 N 0.93 0.90 -0.65 3.15 3.64 -1.52 -3.27 116.57 119.75 1jz4 h LYS 522 Ca 0.22 -0.33 0.13 0.00 -1.27 0.00 0.00 60.65 59.41 1jz4 h LYS 522 Cb 0.20 -0.06 -0.10 0.00 -0.41 0.00 0.00 32.23 31.86 1jz4 h LYS 522 CO -0.02 0.97 0.10 2.35 -2.27 0.00 0.00 179.45 180.59 1jz4 h TRP 523 N 0.75 0.15 -0.98 1.91 2.91 -0.66 -2.33 115.95 117.69 1jz4 h TRP 523 Ca 0.13 0.04 0.13 0.00 1.13 0.00 0.00 58.89 60.31 1jz4 h TRP 523 Cb 0.62 0.03 -0.08 0.00 -0.51 0.00 0.00 29.16 29.22 1jz4 h TRP 523 CO 0.05 -0.09 0.62 -0.07 -1.03 0.00 0.00 178.44 177.92 1jz4 h LEU 524 N 0.22 0.88 -3.07 0.65 3.38 -1.58 -2.91 115.31 112.87 1jz4 h LEU 524 Ca 0.35 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.37 1jz4 h LEU 524 Cb 0.57 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1jz4 h LEU 524 CO -0.48 0.46 0.00 -1.54 0.09 0.00 0.00 178.44 176.97 1jz4 n SER 525 N -4.61 4.75 -4.73 -0.43 3.41 -0.89 -4.51 113.62 106.61 1jz4 n SER 525 Ca 0.19 -2.47 -0.41 0.00 -0.26 0.00 0.00 58.87 55.92 1jz4 n SER 525 Cb 0.38 -0.58 0.00 0.00 -0.26 0.00 0.00 64.21 63.75 1jz4 n SER 525 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1jz4 n LEU 526 N 1.08 4.32 -4.60 1.04 4.77 -1.10 -4.76 117.00 117.75 1jz4 n LEU 526 Ca 0.25 1.18 -0.53 0.00 -0.03 0.00 0.00 56.01 56.88 1jz4 n LEU 526 Cb 0.90 -1.55 -0.06 0.00 -2.33 0.00 0.00 43.42 40.37 1jz4 n LEU 526 CO 0.24 -0.25 0.93 -2.65 -1.33 0.00 0.00 177.39 174.33 1jz4 n PRO 527 N 0.28 1.04 -0.16 3.23 -0.02 -1.26 0.77 135.00 138.88 1jz4 n PRO 527 Ca 0.04 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 1jz4 n PRO 527 Cb 0.39 -2.01 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 1jz4 n PRO 527 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jz4 n GLY 528 N 2.65 2.02 3.75 -1.23 0.00 -1.26 -5.02 105.19 106.10 1jz4 n GLY 528 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 1jz4 n GLY 528 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1jz4 s GLU 529 N -0.04 4.76 0.00 1.61 2.56 0.23 -4.91 118.70 122.90 1jz4 s GLU 529 Ca 0.00 1.61 0.00 0.00 0.00 0.00 0.00 54.97 56.58 1jz4 s GLU 529 Cb 0.00 -3.26 0.00 0.00 2.00 0.00 0.00 34.13 32.87 1jz4 s GLU 529 CO 0.00 0.37 0.03 0.25 -0.56 0.00 0.00 175.26 175.34 1jz4 n THR 530 N 1.54 0.00 -1.46 -1.70 -2.24 -1.26 -4.76 114.28 104.40 1jz4 n THR 530 Ca -0.01 -0.16 -0.32 0.00 -2.27 0.00 0.00 64.05 61.29 1jz4 n THR 530 Cb 0.46 1.12 0.08 0.00 -2.10 0.00 0.00 70.33 69.89 1jz4 n THR 530 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1jz4 s ARG 531 N -0.26 2.39 0.62 -0.78 0.52 -1.26 -4.00 118.95 116.18 1jz4 s ARG 531 Ca 0.00 1.38 -0.11 0.00 -0.52 0.00 0.00 55.73 56.49 1jz4 s ARG 531 Cb 0.00 -1.90 -0.04 0.00 0.52 0.00 0.00 34.95 33.54 1jz4 s ARG 531 CO 0.00 -1.57 1.02 -1.25 0.02 0.00 0.00 175.30 173.51 1jz4 s PRO 532 N -4.37 3.55 -0.12 3.54 0.04 -1.19 -4.76 135.00 131.69 1jz4 s PRO 532 Ca 0.66 0.69 0.01 0.00 0.04 0.00 0.00 61.00 62.40 1jz4 s PRO 532 Cb -0.21 -2.10 0.02 0.00 0.04 0.00 0.00 34.50 32.25 1jz4 s PRO 532 CO 0.48 -0.57 -0.13 -1.17 0.04 0.00 0.00 177.00 175.65 1jz4 s LEU 533 N -5.16 1.57 -0.16 -3.56 0.20 -0.28 0.29 118.68 111.58 1jz4 s LEU 533 Ca 0.55 -0.41 -0.02 0.00 0.69 0.00 0.00 54.13 54.94 1jz4 s LEU 533 Cb -0.11 -1.04 0.05 0.00 -0.43 0.00 0.00 46.19 44.66 1jz4 s LEU 533 CO 0.53 -0.04 -0.00 -0.63 -0.29 0.00 0.00 176.35 175.91 1jz4 s ILE 534 N 1.33 0.74 0.13 6.68 1.01 -0.44 -1.37 121.20 129.29 1jz4 s ILE 534 Ca -0.00 -0.49 -0.31 0.00 0.00 0.00 0.00 60.65 59.85 1jz4 s ILE 534 Cb -0.14 -1.06 -0.10 0.00 0.01 0.00 0.00 42.46 41.18 1jz4 s ILE 534 CO -0.06 -0.00 1.62 -0.76 0.00 0.00 0.00 174.94 175.73 1jz4 s LEU 535 N 1.78 4.37 0.33 2.97 1.02 -0.76 -4.20 118.68 124.19 1jz4 s LEU 535 Ca 0.00 2.59 0.13 0.00 0.02 0.00 0.00 54.13 56.88 1jz4 s LEU 535 Cb -0.16 -3.58 0.54 0.00 0.02 0.00 0.00 46.19 43.02 1jz4 s LEU 535 CO -0.07 -0.86 1.70 0.00 0.02 0.00 0.00 176.35 177.14 1jz4 s GLU 537 N -3.76 0.39 0.25 0.00 2.02 -1.22 -4.33 118.70 112.05 1jz4 s GLU 537 Ca -0.01 0.65 -0.20 0.00 0.02 0.00 0.00 54.97 55.43 1jz4 s GLU 537 Cb 0.13 0.06 0.03 0.00 0.10 0.00 0.00 34.13 34.44 1jz4 s GLU 537 CO 0.73 -0.12 0.65 1.52 0.02 0.00 0.00 175.26 178.07 1jz4 s TYR 538 N 0.91 -0.18 -0.98 1.61 -0.85 -0.93 -0.65 117.35 116.28 1jz4 s TYR 538 Ca -0.06 -0.22 -0.12 0.00 -0.52 0.00 0.00 57.07 56.15 1jz4 s TYR 538 Cb -0.06 0.60 0.00 0.00 0.38 0.00 0.00 41.96 42.88 1jz4 s TYR 538 CO -0.07 -1.12 0.71 0.00 -1.52 0.00 0.00 175.55 173.55 1jz4 n ALA 539 N -0.43 -2.63 -1.66 9.51 0.00 -1.26 -2.43 120.51 121.61 1jz4 n ALA 539 Ca -0.06 -0.25 -0.39 0.00 0.00 0.00 0.00 53.44 52.74 1jz4 n ALA 539 Cb 0.61 -2.41 -0.03 0.00 0.00 0.00 0.00 19.45 17.62 1jz4 n ALA 539 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1jz4 s HIS 540 N -3.24 1.22 0.00 0.00 2.46 -0.77 -4.12 115.29 110.84 1jz4 s HIS 540 Ca 0.24 1.12 0.00 0.00 0.47 0.00 0.00 55.06 56.89 1jz4 s HIS 540 Cb -0.10 -3.78 0.00 0.00 -0.13 0.00 0.00 32.58 28.57 1jz4 s HIS 540 CO 0.87 -2.98 1.67 0.00 -2.47 0.00 0.00 174.74 171.82 1jz4 n ALA 541 N 13.93 3.53 -2.60 1.58 0.00 -0.24 -4.40 120.51 132.30 1jz4 n ALA 541 Ca 0.32 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.33 1jz4 n ALA 541 Cb 0.51 -1.05 -0.02 0.00 0.00 0.00 0.00 19.45 18.89 1jz4 n ALA 541 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1jz4 s MET 542 N 0.11 3.74 7.38 0.00 0.00 -1.26 -3.67 119.30 125.60 1jz4 s MET 542 Ca 0.00 0.56 0.00 0.00 0.00 0.00 0.00 55.69 56.25 1jz4 s MET 542 Cb 0.00 -3.89 0.00 0.00 0.00 0.00 0.00 34.83 30.94 1jz4 s MET 542 CO 0.00 -1.29 0.00 0.41 0.00 0.00 0.00 175.02 174.14 1jz4 n GLY 543 N 4.74 2.79 3.56 2.11 0.00 -1.26 -4.09 105.19 113.03 1jz4 n GLY 543 Ca 0.11 -0.26 -0.40 0.00 0.00 0.00 0.00 46.02 45.47 1jz4 n GLY 543 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1jz4 s ASN 544 N -4.00 6.40 0.00 1.61 3.84 -1.26 -4.87 114.94 116.65 1jz4 s ASN 544 Ca 0.00 -1.43 0.00 0.00 0.21 0.00 0.00 52.86 51.64 1jz4 s ASN 544 Cb 0.00 -2.57 0.00 0.00 -0.55 0.00 0.00 41.25 38.13 1jz4 s ASN 544 CO 0.00 -1.60 0.00 -0.24 -2.79 0.00 0.00 177.10 172.47 1jz4 n SER 545 N 9.32 0.00 0.00 -4.21 2.88 -1.26 -4.72 113.62 115.63 1jz4 n SER 545 Ca 0.34 -0.77 0.00 0.00 -1.33 0.00 0.00 58.87 57.12 1jz4 n SER 545 Cb 0.50 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.96 1jz4 n SER 545 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1jz4 n LEU 546 N 0.00 -0.12 -4.71 2.46 4.32 -1.20 -4.72 117.00 113.03 1jz4 n LEU 546 Ca 0.00 0.00 -0.42 0.00 -0.02 0.00 0.00 56.01 55.57 1jz4 n LEU 546 Cb 0.00 -0.34 -0.03 0.00 -1.62 0.00 0.00 43.42 41.43 1jz4 n LEU 546 CO 0.00 0.00 0.82 -0.83 -1.22 0.00 0.00 177.39 176.16 1jz4 s GLY 547 N -2.68 2.54 0.00 -0.72 0.00 0.29 -2.64 107.32 104.12 1jz4 s GLY 547 Ca 0.00 0.68 0.00 0.00 0.00 0.00 0.00 44.72 45.40 1jz4 s GLY 547 CO 0.00 1.93 0.00 0.61 0.00 0.00 0.00 173.10 175.64 1jz4 n GLY 548 N 3.12 0.64 0.20 0.20 0.00 -0.10 -3.97 105.19 105.28 1jz4 n GLY 548 Ca 0.08 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.04 1jz4 n GLY 548 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1jz4 h PHE 549 N 0.00 0.50 -0.11 1.61 3.57 -1.69 -1.30 116.94 119.52 1jz4 h PHE 549 Ca 0.00 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.54 1jz4 h PHE 549 Cb 0.00 -0.16 -0.00 0.00 2.79 0.00 0.00 35.95 38.58 1jz4 h PHE 549 CO 0.00 0.27 0.08 0.00 -2.23 0.00 0.00 178.31 176.43 1jz4 h ALA 550 N 1.23 2.07 -0.47 2.41 0.00 -1.86 -1.49 119.26 121.14 1jz4 h ALA 550 Ca 0.20 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.13 1jz4 h ALA 550 Cb 0.05 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1jz4 h ALA 550 CO -0.11 -0.10 0.31 -0.22 0.00 0.00 0.00 179.25 179.14 1jz4 h LYS 551 N 0.03 0.54 0.03 0.00 3.64 -1.63 -1.58 116.57 117.60 1jz4 h LYS 551 Ca 0.05 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1jz4 h LYS 551 Cb 0.17 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1jz4 h LYS 551 CO -0.00 0.36 -0.02 1.88 -2.27 0.00 0.00 179.45 179.40 1jz4 h TYR 552 N 0.56 -0.04 -0.77 1.91 -1.99 -1.31 -2.91 116.97 112.42 1jz4 h TYR 552 Ca 0.19 -0.00 0.12 0.00 2.00 0.00 0.00 58.73 61.03 1jz4 h TYR 552 Cb 0.06 0.01 -0.08 0.00 2.00 0.00 0.00 36.73 38.72 1jz4 h TYR 552 CO -0.00 0.51 0.38 -1.49 -0.00 0.00 0.00 178.16 177.56 1jz4 h TRP 553 N -0.62 0.68 -0.32 4.88 4.06 -1.42 0.43 115.95 123.63 1jz4 h TRP 553 Ca -0.00 0.03 0.05 0.00 2.06 0.00 0.00 58.89 61.02 1jz4 h TRP 553 Cb 0.57 -0.19 -0.04 0.00 -1.00 0.00 0.00 29.16 28.50 1jz4 h TRP 553 CO 0.12 0.20 0.06 0.37 -3.56 0.00 0.00 178.44 175.63 1jz4 h GLN 554 N 0.61 0.17 -0.39 0.49 -0.00 -1.29 -0.70 115.11 113.99 1jz4 h GLN 554 Ca 0.40 -0.01 -0.07 0.00 -0.00 0.00 0.00 58.65 58.97 1jz4 h GLN 554 Cb 0.49 -0.04 -0.01 0.00 0.00 0.00 0.00 27.48 27.92 1jz4 h GLN 554 CO -0.31 0.11 -0.03 0.00 0.00 0.00 0.00 178.83 178.59 1jz4 h ALA 555 N 1.24 0.53 -0.61 3.38 0.00 -0.92 -1.34 119.26 121.54 1jz4 h ALA 555 Ca 0.15 -0.28 0.08 0.00 0.00 0.00 0.00 54.91 54.86 1jz4 h ALA 555 Cb 0.17 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.76 1jz4 h ALA 555 CO -0.21 0.34 0.27 0.74 0.00 0.00 0.00 179.25 180.40 1jz4 h PHE 556 N 0.53 0.49 -0.65 0.00 0.05 0.16 -1.15 116.94 116.36 1jz4 h PHE 556 Ca 0.11 0.03 -0.07 0.00 3.82 0.00 0.00 57.97 61.86 1jz4 h PHE 556 Cb 0.53 -0.13 -0.03 0.00 2.00 0.00 0.00 35.95 38.32 1jz4 h PHE 556 CO 0.04 0.17 0.15 0.00 -0.18 0.00 0.00 178.31 178.50 1jz4 h ARG 557 N 0.49 1.05 -0.03 1.51 3.08 -0.92 -3.25 114.38 116.32 1jz4 h ARG 557 Ca 0.30 -0.26 -0.17 0.00 0.07 0.00 0.00 59.98 59.92 1jz4 h ARG 557 Cb 0.31 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 1jz4 h ARG 557 CO -0.25 0.95 -0.75 0.37 -1.07 0.00 0.00 179.97 179.21 1jz4 h GLN 558 N 0.97 0.19 -4.78 0.04 4.15 -0.39 -3.43 115.11 111.86 1jz4 h GLN 558 Ca 0.20 -0.17 -0.68 0.00 0.77 0.00 0.00 58.65 58.77 1jz4 h GLN 558 Cb 0.38 0.04 -0.25 0.00 0.21 0.00 0.00 27.48 27.86 1jz4 h GLN 558 CO 0.00 0.85 -0.59 0.71 -1.93 0.00 0.00 178.83 177.87 1jz4 s TYR 559 N -3.45 3.16 0.17 3.99 1.51 -0.52 -4.99 117.35 117.22 1jz4 s TYR 559 Ca -0.03 -0.86 -0.24 0.00 -1.01 0.00 0.00 57.07 54.93 1jz4 s TYR 559 Cb 0.11 -2.30 0.05 0.00 -0.11 0.00 0.00 41.96 39.71 1jz4 s TYR 559 CO 0.81 -0.54 1.58 -1.35 -1.11 0.00 0.00 175.55 174.94 1jz4 h PRO 560 N 8.28 -0.25 0.00 -1.71 0.11 -1.84 -0.90 132.00 135.69 1jz4 h PRO 560 Ca -0.31 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1jz4 h PRO 560 Cb 1.13 0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1jz4 h PRO 560 CO 0.61 -0.17 0.00 0.54 -0.21 0.00 0.00 178.00 178.77 1jz4 n ARG 561 N -5.42 0.08 -2.92 1.05 1.74 -1.26 -4.28 116.66 105.65 1jz4 n ARG 561 Ca 0.01 0.45 -0.43 0.00 -0.77 0.00 0.00 57.85 57.11 1jz4 n ARG 561 Cb 0.35 -1.69 -0.04 0.00 -1.02 0.00 0.00 32.46 30.05 1jz4 n ARG 561 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1jz4 s LEU 562 N -3.69 4.48 -0.40 0.55 1.43 -0.34 -1.13 118.68 119.58 1jz4 s LEU 562 Ca 0.02 -0.84 0.05 0.00 -1.03 0.00 0.00 54.13 52.34 1jz4 s LEU 562 Cb 0.06 -2.53 0.54 0.00 0.03 0.00 0.00 46.19 44.30 1jz4 s LEU 562 CO 0.21 -1.27 1.68 0.00 0.23 0.00 0.00 176.35 177.19 1jz4 n GLN 563 N 7.28 2.27 0.00 1.70 6.02 -0.47 -4.70 117.38 129.48 1jz4 n GLN 563 Ca -0.03 -3.25 0.00 0.00 -0.01 0.00 0.00 57.00 53.71 1jz4 n GLN 563 Cb 0.46 -2.05 0.00 0.00 1.02 0.00 0.00 30.24 29.66 1jz4 n GLN 563 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1jz4 n GLY 564 N -1.06 -0.02 0.00 1.08 0.00 -1.26 0.33 105.19 104.26 1jz4 n GLY 564 Ca 0.48 -1.89 0.00 0.00 0.00 0.00 0.00 46.02 44.61 1jz4 n GLY 564 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jz4 n GLY 565 N 0.00 -1.29 3.17 -0.02 0.00 -0.82 -1.83 105.19 104.40 1jz4 n GLY 565 Ca 0.00 -1.00 -0.34 0.00 0.00 0.00 0.00 46.02 44.68 1jz4 n GLY 565 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1jz4 s PHE 566 N -2.22 2.95 0.54 1.61 0.40 0.13 -0.58 117.98 120.81 1jz4 s PHE 566 Ca 0.00 -1.57 -0.21 0.00 -0.60 0.00 0.00 56.93 54.55 1jz4 s PHE 566 Cb 0.00 -1.99 -0.05 0.00 0.51 0.00 0.00 43.02 41.48 1jz4 s PHE 566 CO 0.00 -0.75 1.22 0.08 0.70 0.00 0.00 175.22 176.47 1jz4 s VAL 567 N 1.31 2.73 -0.35 -0.44 1.01 0.38 -2.18 120.40 122.86 1jz4 s VAL 567 Ca 0.02 0.50 -0.03 0.00 0.00 0.00 0.00 61.98 62.47 1jz4 s VAL 567 Cb -0.15 -3.23 0.07 0.00 0.00 0.00 0.00 36.38 33.07 1jz4 s VAL 567 CO -0.08 -0.05 0.10 0.86 0.00 0.00 0.00 175.10 175.92 1jz4 s TRP 568 N -1.54 3.39 0.00 5.22 -0.11 -1.02 -0.12 118.94 124.77 1jz4 s TRP 568 Ca 0.71 -2.02 0.00 0.00 1.22 0.00 0.00 56.10 56.01 1jz4 s TRP 568 Cb -0.31 -2.57 0.00 0.00 -1.50 0.00 0.00 33.47 29.09 1jz4 s TRP 568 CO 0.36 -0.86 0.00 -0.40 -4.62 0.00 0.00 176.95 171.43 1jz4 n ASP 569 N 4.64 0.00 0.33 5.86 5.75 -0.11 -1.08 116.55 131.94 1jz4 n ASP 569 Ca -0.09 -0.90 -0.13 0.00 -0.01 0.00 0.00 54.79 53.66 1jz4 n ASP 569 Cb 0.43 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.45 1jz4 n ASP 569 CO 0.00 0.00 0.00 -0.25 -0.11 0.00 0.00 177.20 176.84 1jz4 h TRP 570 N 0.90 -0.81 -4.07 2.11 2.91 -1.53 -0.61 115.95 114.85 1jz4 h TRP 570 Ca 0.00 -0.02 -0.47 0.00 1.13 0.00 0.00 58.89 59.53 1jz4 h TRP 570 Cb 0.00 0.27 -0.30 0.00 -0.51 0.00 0.00 29.16 28.62 1jz4 h TRP 570 CO 0.00 -0.50 -0.81 0.54 -1.03 0.00 0.00 178.44 176.64 1jz4 s VAL 571 N -4.52 1.05 0.17 2.65 0.11 -1.26 0.04 120.40 118.63 1jz4 s VAL 571 Ca -0.13 -0.55 -0.33 0.00 -2.93 0.00 0.00 61.98 58.04 1jz4 s VAL 571 Cb 0.01 -0.89 -0.14 0.00 -1.53 0.00 0.00 36.38 33.84 1jz4 s VAL 571 CO 0.38 0.30 1.56 0.47 -3.33 0.00 0.00 175.10 174.48 1jz4 n ASP 572 N 2.91 3.08 -3.40 3.54 8.00 -0.98 -4.35 116.55 125.35 1jz4 n ASP 572 Ca -0.15 1.09 -0.39 0.00 0.71 0.00 0.00 54.79 56.05 1jz4 n ASP 572 Cb 0.55 -1.43 -0.01 0.00 -0.02 0.00 0.00 41.12 40.21 1jz4 n ASP 572 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jz4 n GLN 573 N 3.21 4.40 -3.63 -1.24 6.02 -0.31 -4.01 117.38 121.83 1jz4 n GLN 573 Ca 0.16 -3.29 -0.30 0.00 -0.01 0.00 0.00 57.00 53.56 1jz4 n GLN 573 Cb 0.29 -2.61 -0.04 0.00 1.02 0.00 0.00 30.24 28.90 1jz4 n GLN 573 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1jz4 s SER 574 N 0.51 6.46 0.07 1.08 1.04 -1.26 -4.73 113.70 116.87 1jz4 s SER 574 Ca 0.56 0.56 0.07 0.00 0.48 0.00 0.00 55.95 57.61 1jz4 s SER 574 Cb 0.20 -2.08 -0.04 0.00 0.10 0.00 0.00 66.02 64.20 1jz4 s SER 574 CO -0.10 -0.01 -0.13 -0.76 0.98 0.00 0.00 173.24 173.22 1jz4 s LEU 575 N -2.97 2.88 -0.04 2.42 1.43 -0.16 -4.42 118.68 117.82 1jz4 s LEU 575 Ca 0.41 -0.38 -0.28 0.00 -1.03 0.00 0.00 54.13 52.84 1jz4 s LEU 575 Cb -0.12 -1.69 -0.03 0.00 0.03 0.00 0.00 46.19 44.39 1jz4 s LEU 575 CO 0.26 0.22 0.92 -0.63 0.23 0.00 0.00 176.35 177.35 1jz4 s ILE 576 N -1.08 4.89 0.29 -0.59 -1.09 -0.88 0.04 121.20 122.78 1jz4 s ILE 576 Ca 0.18 1.91 0.12 0.00 -2.23 0.00 0.00 60.65 60.62 1jz4 s ILE 576 Cb -0.11 -4.25 -0.05 0.00 -1.58 0.00 0.00 42.46 36.47 1jz4 s ILE 576 CO 0.09 0.14 -0.19 -0.54 -1.23 0.00 0.00 174.94 173.22 1jz4 s LYS 577 N 1.20 1.69 -0.09 2.79 1.02 0.26 -4.93 119.74 121.68 1jz4 s LYS 577 Ca 0.48 -1.79 0.03 0.00 0.02 0.00 0.00 55.97 54.70 1jz4 s LYS 577 Cb -0.20 -1.76 -0.01 0.00 -0.52 0.00 0.00 37.83 35.34 1jz4 s LYS 577 CO 0.23 0.31 -0.18 0.71 -0.92 0.00 0.00 175.35 175.50 1jz4 s TYR 578 N -2.53 2.67 0.79 3.18 1.51 -1.26 0.82 117.35 122.53 1jz4 s TYR 578 Ca 0.30 -0.63 -0.11 0.00 -1.01 0.00 0.00 57.07 55.62 1jz4 s TYR 578 Cb -0.04 -1.73 0.18 0.00 -0.11 0.00 0.00 41.96 40.26 1jz4 s TYR 578 CO 0.15 -0.17 1.08 -0.40 -1.11 0.00 0.00 175.55 175.10 1jz4 n ASP 579 N 3.16 0.28 -0.13 2.29 5.68 0.45 -4.80 116.55 123.49 1jz4 n ASP 579 Ca -0.18 -1.51 0.24 0.00 -0.50 0.00 0.00 54.79 52.84 1jz4 n ASP 579 Cb 0.52 -0.80 0.68 0.00 -1.14 0.00 0.00 41.12 40.38 1jz4 n ASP 579 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1jz4 h GLU 580 N 0.00 0.06 -0.00 0.11 4.39 -2.01 0.57 114.58 117.70 1jz4 h GLU 580 Ca -0.35 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.35 1jz4 h GLU 580 Cb 1.01 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.65 1jz4 h GLU 580 CO 0.27 0.04 -0.05 0.09 -1.16 0.00 0.00 179.01 178.20 1jz4 n ASN 581 N -4.34 0.31 -0.06 1.42 3.02 -1.26 -4.89 115.26 109.47 1jz4 n ASN 581 Ca 0.16 -0.64 -0.01 0.00 -0.03 0.00 0.00 54.58 54.06 1jz4 n ASN 581 Cb 0.80 -0.10 -0.00 0.00 -0.61 0.00 0.00 39.78 39.87 1jz4 n ASN 581 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1jz4 n GLY 582 N 1.20 0.48 3.75 7.41 0.00 0.20 -4.99 105.19 113.23 1jz4 n GLY 582 Ca 0.17 -0.61 -0.39 0.00 0.00 0.00 0.00 46.02 45.19 1jz4 n GLY 582 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1jz4 s ASN 583 N -2.58 6.96 0.39 1.61 0.01 -1.26 -4.68 114.94 115.39 1jz4 s ASN 583 Ca 0.00 1.15 -0.23 0.00 -0.71 0.00 0.00 52.86 53.07 1jz4 s ASN 583 Cb 0.00 -2.38 -0.10 0.00 0.41 0.00 0.00 41.25 39.18 1jz4 s ASN 583 CO 0.00 0.03 0.96 -2.16 -1.51 0.00 0.00 177.10 174.42 1jz4 s PRO 584 N 0.16 4.34 0.03 -0.60 0.04 -1.26 0.17 135.00 137.88 1jz4 s PRO 584 Ca 0.33 1.27 -0.08 0.00 0.04 0.00 0.00 61.00 62.55 1jz4 s PRO 584 Cb -0.18 -2.47 0.00 0.00 0.04 0.00 0.00 34.50 31.89 1jz4 s PRO 584 CO 0.17 0.06 0.17 1.67 0.04 0.00 0.00 177.00 179.11 1jz4 s TRP 585 N -1.87 0.06 -0.28 0.56 1.48 0.24 -4.90 118.94 114.24 1jz4 s TRP 585 Ca 0.57 -0.24 -0.29 0.00 -1.06 0.00 0.00 56.10 55.08 1jz4 s TRP 585 Cb -0.15 -0.05 0.01 0.00 -1.16 0.00 0.00 33.47 32.12 1jz4 s TRP 585 CO 0.20 -0.38 1.11 -1.12 -4.06 0.00 0.00 176.95 172.70 1jz4 s SER 586 N -1.85 6.95 0.10 -2.66 0.01 -1.26 -0.58 113.70 114.42 1jz4 s SER 586 Ca -0.08 1.22 0.05 0.00 1.31 0.00 0.00 55.95 58.45 1jz4 s SER 586 Cb -0.03 -2.54 -0.04 0.00 0.21 0.00 0.00 66.02 63.62 1jz4 s SER 586 CO -0.02 -0.83 0.00 0.00 0.41 0.00 0.00 173.24 172.80 1jz4 s ALA 587 N 3.59 3.30 0.00 1.44 0.00 0.11 -4.89 121.76 125.30 1jz4 s ALA 587 Ca 0.47 -1.14 0.00 0.00 0.00 0.00 0.00 51.96 51.30 1jz4 s ALA 587 Cb -0.14 -1.19 0.00 0.00 0.00 0.00 0.00 23.12 21.79 1jz4 s ALA 587 CO 0.13 0.68 0.00 2.48 0.00 0.00 0.00 175.76 179.06 1jz4 n TYR 588 N 0.49 0.00 -1.62 0.00 0.18 -1.26 -0.99 117.16 113.96 1jz4 n TYR 588 Ca -0.11 0.00 -0.56 0.00 1.88 0.00 0.00 57.90 59.12 1jz4 n TYR 588 Cb 0.52 0.00 -0.07 0.00 -0.38 0.00 0.00 39.34 39.41 1jz4 n TYR 588 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1jz4 n GLY 589 N 1.58 0.44 1.69 -7.48 0.00 -0.76 -0.82 105.19 99.84 1jz4 n GLY 589 Ca 0.00 0.79 0.00 0.00 0.00 0.00 0.00 46.02 46.81 1jz4 n GLY 589 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jz4 n GLY 590 N 2.91 1.69 0.00 -0.02 0.00 -1.26 -3.91 105.19 104.60 1jz4 n GLY 590 Ca 0.22 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.30 1jz4 n GLY 590 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1jz4 n ASP 591 N 0.00 0.00 -0.02 1.61 8.00 -0.00 -1.65 116.55 124.49 1jz4 n ASP 591 Ca 0.00 0.03 0.02 0.00 0.71 0.00 0.00 54.79 55.55 1jz4 n ASP 591 Cb 0.00 -0.24 0.03 0.00 -0.02 0.00 0.00 41.12 40.89 1jz4 n ASP 591 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1jz4 n PHE 592 N -1.24 0.00 -0.06 1.24 3.01 -1.26 -4.93 117.46 114.22 1jz4 n PHE 592 Ca 0.06 -0.56 0.00 0.00 1.01 0.00 0.00 57.45 57.96 1jz4 n PHE 592 Cb 0.09 -0.07 0.00 0.00 -0.01 0.00 0.00 39.48 39.49 1jz4 n PHE 592 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1jz4 n GLY 593 N -0.65 1.08 3.71 1.37 0.00 -0.66 -4.87 105.19 105.17 1jz4 n GLY 593 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1jz4 n GLY 593 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1jz4 s ASP 594 N -2.81 6.45 -0.28 1.61 -4.77 -1.26 -4.98 116.67 110.62 1jz4 s ASP 594 Ca 0.00 2.77 -0.22 0.00 -3.30 0.00 0.00 52.55 51.80 1jz4 s ASP 594 Cb 0.00 -2.59 0.13 0.00 -1.09 0.00 0.00 42.92 39.37 1jz4 s ASP 594 CO 0.00 -0.94 1.01 0.28 0.70 0.00 0.00 175.17 176.22 1jz4 s THR 595 N 1.56 0.00 0.85 2.11 -1.32 -1.26 -4.14 115.64 113.45 1jz4 s THR 595 Ca 0.75 0.00 -0.11 0.00 -1.21 0.00 0.00 61.69 61.12 1jz4 s THR 595 Cb -0.47 -1.00 0.11 0.00 -1.51 0.00 0.00 72.50 69.63 1jz4 s THR 595 CO 0.33 0.00 1.15 -2.84 -2.21 0.00 0.00 174.62 171.04 1jz4 s PRO 596 N 0.63 1.48 0.15 7.08 0.02 -1.26 -5.17 135.00 137.93 1jz4 s PRO 596 Ca -0.01 1.51 -0.07 0.00 0.02 0.00 0.00 61.00 62.45 1jz4 s PRO 596 Cb -0.05 -1.78 -0.01 0.00 0.02 0.00 0.00 34.50 32.68 1jz4 s PRO 596 CO -0.10 -2.28 0.23 0.54 -0.33 0.00 0.00 177.00 175.07 1jz4 s ASN 597 N -2.70 0.10 -0.38 2.53 2.20 -1.26 -4.70 114.94 110.74 1jz4 s ASN 597 Ca 0.67 -0.91 0.06 0.00 -0.94 0.00 0.00 52.86 51.74 1jz4 s ASN 597 Cb -0.23 0.40 0.56 0.00 -2.00 0.00 0.00 41.25 39.98 1jz4 s ASN 597 CO 0.55 -0.85 1.67 0.47 -2.94 0.00 0.00 177.10 176.00 1jz4 n ASP 598 N -0.18 3.42 0.00 3.54 8.00 -0.14 -4.95 116.55 126.24 1jz4 n ASP 598 Ca -0.08 -3.73 0.00 0.00 0.71 0.00 0.00 54.79 51.69 1jz4 n ASP 598 Cb 0.63 -0.73 0.00 0.00 -0.02 0.00 0.00 41.12 41.00 1jz4 n ASP 598 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 1jz4 n ARG 599 N -1.10 0.00 0.00 -1.24 1.85 -1.25 -0.87 116.66 114.05 1jz4 n ARG 599 Ca 0.46 0.00 0.09 0.00 -1.00 0.00 0.00 57.85 57.40 1jz4 n ARG 599 Cb 1.25 0.00 0.56 0.00 -1.05 0.00 0.00 32.46 33.22 1jz4 n ARG 599 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1jz4 n GLN 600 N 14.00 0.87 0.24 2.89 0.00 -1.26 -1.82 117.38 132.29 1jz4 n GLN 600 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 57.00 57.15 1jz4 n GLN 600 Cb 0.00 -1.34 0.81 0.00 0.00 0.00 0.00 30.24 29.71 1jz4 n GLN 600 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.06 177.80 1jz4 h PHE 601 N 0.00 0.00 -0.00 2.61 -1.00 -1.42 -0.30 116.94 116.83 1jz4 h PHE 601 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1jz4 h PHE 601 Cb 0.00 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.56 1jz4 h PHE 601 CO 0.00 0.00 -0.02 0.00 -1.61 0.00 0.00 178.31 176.68 1jz4 s MET 603 N -2.38 2.26 -0.06 0.00 -1.94 -0.12 -1.16 119.30 115.90 1jz4 s MET 603 Ca 0.34 -1.90 0.10 0.00 -1.71 0.00 0.00 55.69 52.52 1jz4 s MET 603 Cb 0.21 -3.73 0.17 0.00 2.01 0.00 0.00 34.83 33.49 1jz4 s MET 603 CO 0.44 -1.13 1.08 0.09 -0.01 0.00 0.00 175.02 175.49 1jz4 n ASN 604 N 4.55 1.07 -4.80 3.03 5.03 -1.26 -4.33 115.26 118.54 1jz4 n ASN 604 Ca -0.03 -2.53 -0.33 0.00 0.87 0.00 0.00 54.58 52.57 1jz4 n ASN 604 Cb 0.41 -0.32 0.01 0.00 -1.02 0.00 0.00 39.78 38.86 1jz4 n ASN 604 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1jz4 s GLY 605 N -1.93 2.20 0.33 7.41 0.00 -1.24 -0.93 107.32 113.16 1jz4 s GLY 605 Ca 0.17 0.44 0.22 0.00 0.00 0.00 0.00 44.72 45.56 1jz4 s GLY 605 CO -0.01 0.76 1.36 1.41 0.00 0.00 0.00 173.10 176.63 1jz4 h LEU 606 N 0.61 0.00 -8.71 0.66 3.38 0.13 -3.44 115.31 107.93 1jz4 h LEU 606 Ca -0.47 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.10 1jz4 h LEU 606 Cb 1.22 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.81 1jz4 h LEU 606 CO 0.57 0.02 -0.74 0.68 0.09 0.00 0.00 178.44 179.07 1jz4 s VAL 607 N -3.26 1.41 0.88 1.22 -7.23 0.05 -1.25 120.40 112.22 1jz4 s VAL 607 Ca 0.04 -1.98 -0.12 0.00 -1.81 0.00 0.00 61.98 58.11 1jz4 s VAL 607 Cb 0.07 -1.80 0.12 0.00 0.56 0.00 0.00 36.38 35.33 1jz4 s VAL 607 CO 0.72 -0.58 1.10 -0.36 -0.31 0.00 0.00 175.10 175.68 1jz4 s PHE 608 N -2.77 2.48 0.55 2.82 0.40 0.99 -2.32 117.98 120.12 1jz4 s PHE 608 Ca 0.16 1.13 0.30 0.00 -0.60 0.00 0.00 56.93 57.92 1jz4 s PHE 608 Cb -0.01 -3.19 1.47 0.00 0.51 0.00 0.00 43.02 41.79 1jz4 s PHE 608 CO 0.03 -2.26 1.90 0.00 0.70 0.00 0.00 175.22 175.59 1jz4 h ALA 609 N -1.44 2.66 -0.41 5.36 0.00 -1.89 0.67 119.26 124.21 1jz4 h ALA 609 Ca -0.50 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1jz4 h ALA 609 Cb 1.29 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1jz4 h ALA 609 CO 0.57 -0.97 0.00 -0.40 0.00 0.00 0.00 179.25 178.45 1jz4 n ASP 610 N -4.15 2.38 -0.02 0.00 5.68 -1.26 -4.53 116.55 114.65 1jz4 n ASP 610 Ca 0.15 -2.05 -0.00 0.00 -0.50 0.00 0.00 54.79 52.39 1jz4 n ASP 610 Cb 0.86 -0.31 -0.00 0.00 -1.14 0.00 0.00 41.12 40.53 1jz4 n ASP 610 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1jz4 n ARG 611 N 0.70 -0.03 -2.89 0.11 3.00 0.23 -5.01 116.66 112.77 1jz4 n ARG 611 Ca 0.14 0.30 -0.41 0.00 -0.01 0.00 0.00 57.85 57.87 1jz4 n ARG 611 Cb 0.39 -3.60 -0.04 0.00 0.00 0.00 0.00 32.46 29.21 1jz4 n ARG 611 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 1jz4 s THR 612 N -2.00 4.89 0.59 0.55 2.01 -1.25 -4.78 115.64 115.64 1jz4 s THR 612 Ca 0.00 1.65 -0.19 0.00 0.31 0.00 0.00 61.69 63.46 1jz4 s THR 612 Cb 0.00 -4.14 -0.04 0.00 0.01 0.00 0.00 72.50 68.33 1jz4 s THR 612 CO 0.00 0.06 1.20 -2.84 -0.69 0.00 0.00 174.62 172.35 1jz4 s PRO 613 N 1.95 3.02 0.68 4.92 0.02 -1.26 -0.01 135.00 144.32 1jz4 s PRO 613 Ca 0.39 1.81 -0.08 0.00 0.02 0.00 0.00 61.00 63.14 1jz4 s PRO 613 Cb -0.17 -1.94 0.03 0.00 0.02 0.00 0.00 34.50 32.44 1jz4 s PRO 613 CO 0.14 -1.16 1.02 -1.01 -0.33 0.00 0.00 177.00 175.66 1jz4 s HIS 614 N -1.61 3.13 0.40 6.54 3.76 -0.38 -4.75 115.29 122.39 1jz4 s HIS 614 Ca 0.77 0.69 0.12 0.00 -0.15 0.00 0.00 55.06 56.50 1jz4 s HIS 614 Cb -0.30 -3.05 0.84 0.00 1.11 0.00 0.00 32.58 31.19 1jz4 s HIS 614 CO 0.32 -1.20 1.91 -1.35 -0.85 0.00 0.00 174.74 173.57 1jz4 h PRO 615 N -0.53 0.07 -0.10 8.40 0.11 -1.94 -2.71 132.00 135.31 1jz4 h PRO 615 Ca -0.45 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 65.67 1jz4 h PRO 615 Cb 1.28 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.38 1jz4 h PRO 615 CO 0.62 0.30 0.17 0.00 -0.21 0.00 0.00 178.00 178.88 1jz4 h ALA 616 N 1.70 1.52 -0.10 -0.75 0.00 -1.86 -2.67 119.26 117.11 1jz4 h ALA 616 Ca 0.01 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1jz4 h ALA 616 Cb 0.45 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1jz4 h ALA 616 CO 0.03 -0.22 -0.05 1.25 0.00 0.00 0.00 179.25 180.26 1jz4 h LEU 617 N 0.00 0.13 -0.84 0.00 5.85 -1.67 -2.14 115.31 116.64 1jz4 h LEU 617 Ca 0.05 -0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.63 1jz4 h LEU 617 Cb 0.39 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 1jz4 h LEU 617 CO -0.00 0.20 -0.57 0.74 -0.34 0.00 0.00 178.44 178.47 1jz4 h THR 618 N 0.14 1.40 -0.63 1.05 2.02 -1.70 0.20 112.91 115.39 1jz4 h THR 618 Ca 0.03 -1.95 -0.04 0.00 0.77 0.00 0.00 66.41 65.23 1jz4 h THR 618 Cb 0.18 2.04 -0.03 0.00 -1.74 0.00 0.00 68.15 68.60 1jz4 h THR 618 CO 0.01 0.56 0.24 -0.08 0.37 0.00 0.00 175.52 176.62 1jz4 h GLU 619 N 0.03 0.94 -0.13 6.66 4.57 -1.53 -0.02 114.58 125.09 1jz4 h GLU 619 Ca -0.01 -0.18 -0.04 0.00 -1.18 0.00 0.00 59.36 57.96 1jz4 h GLU 619 Cb 1.01 -0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 29.45 1jz4 h GLU 619 CO 0.08 0.80 -0.07 0.00 -1.18 0.00 0.00 179.01 178.64 1jz4 h ALA 620 N 1.09 0.19 -0.90 2.92 0.00 -1.04 -1.72 119.26 119.79 1jz4 h ALA 620 Ca 0.21 -0.27 0.09 0.00 0.00 0.00 0.00 54.91 54.95 1jz4 h ALA 620 Cb 0.22 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 17.89 1jz4 h ALA 620 CO -0.02 -0.02 0.55 -0.22 0.00 0.00 0.00 179.25 179.55 1jz4 h LYS 621 N -0.06 0.89 -0.26 0.00 3.64 -0.35 -0.71 116.57 119.72 1jz4 h LYS 621 Ca 0.03 -0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.28 1jz4 h LYS 621 Cb 0.54 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 1jz4 h LYS 621 CO 0.02 0.59 -0.12 1.25 -2.27 0.00 0.00 179.45 178.92 1jz4 h HIS 622 N 0.92 0.62 0.00 1.91 2.76 -0.86 -3.03 115.15 117.47 1jz4 h HIS 622 Ca 0.43 -0.15 -0.07 0.00 -2.20 0.00 0.00 60.37 58.38 1jz4 h HIS 622 Cb 0.35 -0.14 -0.01 0.00 1.55 0.00 0.00 27.41 29.16 1jz4 h HIS 622 CO -0.03 0.79 -0.31 1.96 -1.30 0.00 0.00 177.93 179.04 1jz4 h GLN 623 N 0.27 0.00 -0.63 5.26 1.08 -1.00 -2.67 115.11 117.42 1jz4 h GLN 623 Ca 0.06 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.26 1jz4 h GLN 623 Cb 0.62 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.05 1jz4 h GLN 623 CO 0.04 0.31 0.00 1.04 -0.95 0.00 0.00 178.83 179.27 1jz4 n GLN 624 N -3.82 2.96 -1.22 1.46 6.02 -0.30 -4.96 117.38 117.53 1jz4 n GLN 624 Ca -0.01 -1.90 -0.35 0.00 -0.01 0.00 0.00 57.00 54.72 1jz4 n GLN 624 Cb 0.39 -1.75 0.09 0.00 1.02 0.00 0.00 30.24 29.99 1jz4 n GLN 624 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1jz4 n GLN 625 N 0.60 0.28 0.00 -1.09 6.02 -1.01 -4.86 117.38 117.32 1jz4 n GLN 625 Ca 0.17 0.15 0.11 0.00 -0.01 0.00 0.00 57.00 57.42 1jz4 n GLN 625 Cb 0.68 -2.02 0.04 0.00 1.02 0.00 0.00 30.24 29.96 1jz4 n GLN 625 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1jz4 n PHE 626 N -2.67 0.00 -5.09 1.08 3.01 -1.26 -4.88 117.46 107.65 1jz4 n PHE 626 Ca 0.11 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.25 1jz4 n PHE 626 Cb 0.50 -0.06 -0.16 0.00 -0.01 0.00 0.00 39.48 39.75 1jz4 n PHE 626 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 1jz4 s PHE 627 N -2.78 2.61 0.11 1.38 0.40 -1.26 -0.30 117.98 118.14 1jz4 s PHE 627 Ca 0.14 -0.81 0.04 0.00 -0.60 0.00 0.00 56.93 55.69 1jz4 s PHE 627 Cb 0.17 -1.72 -0.04 0.00 0.51 0.00 0.00 43.02 41.95 1jz4 s PHE 627 CO 0.71 -0.28 0.10 -0.65 0.70 0.00 0.00 175.22 175.80 1jz4 s GLN 628 N 0.17 2.89 0.09 0.44 -1.52 0.96 -4.91 119.66 117.78 1jz4 s GLN 628 Ca -0.12 -0.75 0.01 0.00 -1.95 0.00 0.00 55.36 52.56 1jz4 s GLN 628 Cb -0.16 -2.70 -0.04 0.00 -0.22 0.00 0.00 33.01 29.89 1jz4 s GLN 628 CO 0.06 0.54 -0.06 -0.06 -0.25 0.00 0.00 175.29 175.52 1jz4 s PHE 629 N -1.51 0.83 -0.02 0.91 0.40 -1.26 -0.38 117.98 116.95 1jz4 s PHE 629 Ca 0.30 -0.93 -0.12 0.00 -0.60 0.00 0.00 56.93 55.58 1jz4 s PHE 629 Cb -0.11 -0.49 0.02 0.00 0.51 0.00 0.00 43.02 42.94 1jz4 s PHE 629 CO 0.22 -0.18 0.25 1.03 0.70 0.00 0.00 175.22 177.24 1jz4 s ARG 630 N -3.80 0.56 -0.06 0.44 1.81 -0.47 -4.97 118.95 112.46 1jz4 s ARG 630 Ca 0.11 -0.18 0.04 0.00 -1.72 0.00 0.00 55.73 53.98 1jz4 s ARG 630 Cb 0.05 0.24 0.00 0.00 -0.45 0.00 0.00 34.95 34.80 1jz4 s ARG 630 CO -0.05 -0.14 -0.18 -1.17 -0.68 0.00 0.00 175.30 173.08 1jz4 s LEU 631 N -1.13 1.89 -0.30 2.53 2.96 -1.26 -0.42 118.68 122.95 1jz4 s LEU 631 Ca -0.12 -0.40 -0.03 0.00 -0.22 0.00 0.00 54.13 53.36 1jz4 s LEU 631 Cb -0.06 -1.06 0.11 0.00 0.50 0.00 0.00 46.19 45.68 1jz4 s LEU 631 CO 0.03 0.13 0.14 -0.55 -1.32 0.00 0.00 176.35 174.78 1jz4 s SER 632 N 0.27 3.50 0.44 3.68 0.15 -0.52 -5.01 113.70 116.21 1jz4 s SER 632 Ca -0.10 -1.44 0.00 0.00 0.70 0.00 0.00 55.95 55.10 1jz4 s SER 632 Cb -0.14 -0.40 0.00 0.00 -1.71 0.00 0.00 66.02 63.77 1jz4 s SER 632 CO 0.04 -0.42 0.00 0.61 1.20 0.00 0.00 173.24 174.67 1jz4 n GLY 633 N 5.05 1.49 0.24 9.45 0.00 -1.26 -1.76 105.19 118.39 1jz4 n GLY 633 Ca -0.03 0.14 0.04 0.00 0.00 0.00 0.00 46.02 46.17 1jz4 n GLY 633 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1jz4 n GLN 634 N 0.00 1.44 -3.46 1.61 6.02 -1.26 -4.97 117.38 116.76 1jz4 n GLN 634 Ca 0.00 -0.71 -0.37 0.00 -0.01 0.00 0.00 57.00 55.91 1jz4 n GLN 634 Cb 0.00 -1.07 -0.07 0.00 1.02 0.00 0.00 30.24 30.12 1jz4 n GLN 634 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1jz4 s THR 635 N -0.99 5.26 -0.11 5.09 2.01 -0.72 0.86 115.64 127.03 1jz4 s THR 635 Ca 0.08 0.65 -0.11 0.00 0.31 0.00 0.00 61.69 62.61 1jz4 s THR 635 Cb 0.07 -3.69 -0.05 0.00 0.01 0.00 0.00 72.50 68.84 1jz4 s THR 635 CO 0.16 0.34 0.25 -0.63 -0.69 0.00 0.00 174.62 174.06 1jz4 s ILE 636 N 0.71 5.32 -0.25 1.82 1.01 0.23 -1.44 121.20 128.61 1jz4 s ILE 636 Ca 0.19 0.46 -0.03 0.00 0.00 0.00 0.00 60.65 61.27 1jz4 s ILE 636 Cb -0.14 -3.55 0.02 0.00 0.01 0.00 0.00 42.46 38.79 1jz4 s ILE 636 CO 0.06 0.52 -0.04 -0.70 0.00 0.00 0.00 174.94 174.78 1jz4 s GLU 637 N -0.43 2.99 -0.26 2.79 2.12 0.44 -0.68 118.70 125.68 1jz4 s GLU 637 Ca 0.17 -0.88 -0.10 0.00 0.36 0.00 0.00 54.97 54.51 1jz4 s GLU 637 Cb -0.13 -3.04 -0.05 0.00 0.26 0.00 0.00 34.13 31.17 1jz4 s GLU 637 CO 0.06 -0.36 0.17 0.08 -0.54 0.00 0.00 175.26 174.66 1jz4 s VAL 638 N 1.38 5.27 -0.09 3.70 1.01 0.42 -1.36 120.40 130.73 1jz4 s VAL 638 Ca 0.02 0.15 0.04 0.00 0.00 0.00 0.00 61.98 62.19 1jz4 s VAL 638 Cb -0.16 -3.48 -0.01 0.00 0.00 0.00 0.00 36.38 32.73 1jz4 s VAL 638 CO -0.03 0.31 -0.21 -0.89 0.00 0.00 0.00 175.10 174.27 1jz4 s THR 639 N 1.38 2.35 -0.01 3.92 2.01 0.49 0.01 115.64 125.80 1jz4 s THR 639 Ca 0.07 -0.93 -0.19 0.00 0.31 0.00 0.00 61.69 60.95 1jz4 s THR 639 Cb -0.15 -1.91 -0.05 0.00 0.01 0.00 0.00 72.50 70.40 1jz4 s THR 639 CO 0.07 0.56 0.56 -0.55 -0.69 0.00 0.00 174.62 174.57 1jz4 s SER 640 N 0.15 6.93 0.00 3.53 0.15 -0.54 -0.03 113.70 123.89 1jz4 s SER 640 Ca -0.11 1.11 0.25 0.00 0.70 0.00 0.00 55.95 57.89 1jz4 s SER 640 Cb -0.16 -2.34 0.35 0.00 -1.71 0.00 0.00 66.02 62.16 1jz4 s SER 640 CO 0.06 0.14 1.35 -0.62 1.20 0.00 0.00 173.24 175.37 1jz4 n GLU 641 N 2.60 2.21 -2.07 5.44 1.02 0.59 -1.84 120.64 128.60 1jz4 n GLU 641 Ca -0.08 -1.76 -0.37 0.00 -0.02 0.00 0.00 57.16 54.93 1jz4 n GLU 641 Cb 0.51 -1.46 0.02 0.00 -0.02 0.00 0.00 31.44 30.49 1jz4 n GLU 641 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1jz4 s TYR 642 N -1.99 2.53 -0.11 -0.32 1.51 -1.26 -4.75 117.35 112.95 1jz4 s TYR 642 Ca 0.30 1.50 0.15 0.00 -1.01 0.00 0.00 57.07 58.01 1jz4 s TYR 642 Cb 0.20 -3.49 -0.23 0.00 -0.11 0.00 0.00 41.96 38.33 1jz4 s TYR 642 CO 0.31 -2.07 0.43 1.28 -1.11 0.00 0.00 175.55 174.38 1jz4 n LEU 643 N -1.17 0.48 0.00 -1.29 4.77 -1.26 -1.73 117.00 116.80 1jz4 n LEU 643 Ca 0.11 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.32 1jz4 n LEU 643 Cb 0.49 0.29 0.00 0.00 -2.33 0.00 0.00 43.42 41.87 1jz4 n LEU 643 CO 0.46 0.40 -0.39 0.49 -1.33 0.00 0.00 177.39 177.03 1jz4 n PHE 644 N -2.88 0.00 -3.48 -1.77 3.01 -1.26 -4.83 117.46 106.25 1jz4 n PHE 644 Ca -0.23 0.00 -0.29 0.00 1.01 0.00 0.00 57.45 57.95 1jz4 n PHE 644 Cb 1.06 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 40.50 1jz4 n PHE 644 CO 0.00 0.00 0.00 -0.98 1.01 0.00 0.00 176.76 176.79 1jz4 s ARG 645 N -1.77 3.61 0.43 -1.08 1.70 -1.26 -4.77 118.95 115.81 1jz4 s ARG 645 Ca 0.00 -0.08 -0.15 0.00 -0.47 0.00 0.00 55.73 55.03 1jz4 s ARG 645 Cb 0.00 -2.72 -0.08 0.00 -0.57 0.00 0.00 34.95 31.57 1jz4 s ARG 645 CO 0.00 0.30 0.87 -1.58 -1.08 0.00 0.00 175.30 173.81 1jz4 s HIS 646 N -1.95 3.42 -1.51 5.89 5.65 -1.26 -3.27 115.29 122.25 1jz4 s HIS 646 Ca 0.42 1.31 -0.13 0.00 0.25 0.00 0.00 55.06 56.92 1jz4 s HIS 646 Cb -0.11 -2.65 0.00 0.00 -1.18 0.00 0.00 32.58 28.65 1jz4 s HIS 646 CO 0.28 -0.16 2.46 -1.13 -0.65 0.00 0.00 174.74 175.54 1jz4 n SER 647 N -1.11 5.46 -1.26 9.88 3.41 -0.47 -4.71 113.62 124.84 1jz4 n SER 647 Ca 0.05 -2.76 0.04 0.00 -0.26 0.00 0.00 58.87 55.94 1jz4 n SER 647 Cb 0.54 -1.62 0.23 0.00 -0.26 0.00 0.00 64.21 63.10 1jz4 n SER 647 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1jz4 n ASP 648 N 5.25 3.60 -2.75 4.04 5.68 -1.26 -4.03 116.55 127.08 1jz4 n ASP 648 Ca 0.60 -2.48 -0.09 0.00 -0.50 0.00 0.00 54.79 52.32 1jz4 n ASP 648 Cb 0.34 -0.57 0.09 0.00 -1.14 0.00 0.00 41.12 39.84 1jz4 n ASP 648 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1jz4 n ASN 649 N 0.41 -1.81 -3.66 -1.12 5.15 -1.26 -5.06 115.26 107.91 1jz4 n ASN 649 Ca 0.16 -3.17 -0.15 0.00 -0.60 0.00 0.00 54.58 50.82 1jz4 n ASN 649 Cb 0.75 1.33 -0.08 0.00 -0.53 0.00 0.00 39.78 41.26 1jz4 n ASN 649 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 1jz4 s GLU 650 N -0.09 0.78 -0.02 1.20 8.01 -1.26 -4.05 118.70 123.28 1jz4 s GLU 650 Ca 0.23 0.22 -0.11 0.00 0.01 0.00 0.00 54.97 55.32 1jz4 s GLU 650 Cb 0.34 0.36 0.02 0.00 -4.31 0.00 0.00 34.13 30.54 1jz4 s GLU 650 CO -0.06 -0.20 0.24 -1.17 0.01 0.00 0.00 175.26 174.08 1jz4 s LEU 651 N -0.83 1.13 -0.21 1.80 0.20 -0.09 -2.36 118.68 118.32 1jz4 s LEU 651 Ca -0.09 0.06 -0.09 0.00 0.69 0.00 0.00 54.13 54.71 1jz4 s LEU 651 Cb -0.03 0.99 -0.04 0.00 -0.43 0.00 0.00 46.19 46.68 1jz4 s LEU 651 CO 0.05 -0.36 0.10 -0.22 -0.29 0.00 0.00 176.35 175.64 1jz4 s LEU 652 N -1.08 3.92 0.01 -0.68 2.96 0.29 -0.36 118.68 123.73 1jz4 s LEU 652 Ca -0.12 0.08 0.03 0.00 -0.22 0.00 0.00 54.13 53.90 1jz4 s LEU 652 Cb -0.05 -2.02 -0.04 0.00 0.50 0.00 0.00 46.19 44.58 1jz4 s LEU 652 CO 0.03 0.12 -0.03 -1.00 -1.32 0.00 0.00 176.35 174.14 1jz4 s HIS 653 N 0.70 2.97 0.04 5.38 3.76 0.32 -0.78 115.29 127.68 1jz4 s HIS 653 Ca 0.05 0.01 0.01 0.00 -0.15 0.00 0.00 55.06 54.98 1jz4 s HIS 653 Cb -0.13 -1.63 -0.03 0.00 1.11 0.00 0.00 32.58 31.91 1jz4 s HIS 653 CO 0.02 0.42 -0.04 1.67 -0.85 0.00 0.00 174.74 175.95 1jz4 s TRP 654 N -1.06 0.46 -0.08 1.40 1.48 0.83 -0.31 118.94 121.66 1jz4 s TRP 654 Ca 0.19 -0.65 -0.25 0.00 -1.06 0.00 0.00 56.10 54.33 1jz4 s TRP 654 Cb -0.11 -0.30 0.06 0.00 -1.16 0.00 0.00 33.47 31.95 1jz4 s TRP 654 CO 0.09 -0.19 0.57 0.00 -4.06 0.00 0.00 176.95 173.36 1jz4 s MET 655 N -2.12 0.88 -0.12 3.25 0.23 0.25 -0.62 119.30 121.04 1jz4 s MET 655 Ca -0.08 0.27 0.01 0.00 -1.03 0.00 0.00 55.69 54.86 1jz4 s MET 655 Cb -0.06 0.41 -0.01 0.00 -1.53 0.00 0.00 34.83 33.65 1jz4 s MET 655 CO -0.03 -0.24 -0.16 0.08 -2.03 0.00 0.00 175.02 172.65 1jz4 s VAL 656 N -0.89 2.81 0.00 5.16 1.01 0.05 -0.05 120.40 128.48 1jz4 s VAL 656 Ca -0.09 -0.75 0.01 0.00 0.00 0.00 0.00 61.98 61.15 1jz4 s VAL 656 Cb -0.02 -2.16 -0.01 0.00 0.00 0.00 0.00 36.38 34.19 1jz4 s VAL 656 CO 0.06 0.53 -0.04 0.00 0.00 0.00 0.00 175.10 175.66 1jz4 s ALA 657 N 0.35 0.31 -0.46 5.51 0.00 -0.53 -1.09 121.76 125.86 1jz4 s ALA 657 Ca -0.13 -0.22 -0.17 0.00 0.00 0.00 0.00 51.96 51.44 1jz4 s ALA 657 Cb -0.16 -0.06 0.05 0.00 0.00 0.00 0.00 23.12 22.95 1jz4 s ALA 657 CO 0.06 0.06 0.44 -1.17 0.00 0.00 0.00 175.76 175.15 1jz4 s LEU 658 N -0.26 5.20 -1.31 0.00 2.96 0.32 -0.04 118.68 125.56 1jz4 s LEU 658 Ca -0.00 -1.00 -0.17 0.00 -0.22 0.00 0.00 54.13 52.73 1jz4 s LEU 658 Cb -0.02 -2.29 0.02 0.00 0.50 0.00 0.00 46.19 44.39 1jz4 s LEU 658 CO -0.00 -0.66 0.50 0.47 -1.32 0.00 0.00 176.35 175.34 1jz4 n ASP 659 N 5.52 -2.47 0.00 3.68 8.00 -0.72 -0.25 116.55 130.30 1jz4 n ASP 659 Ca -0.10 -1.18 0.00 0.00 0.71 0.00 0.00 54.79 54.22 1jz4 n ASP 659 Cb 0.45 -2.27 0.00 0.00 -0.02 0.00 0.00 41.12 39.28 1jz4 n ASP 659 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1jz4 n GLY 660 N -2.10 2.60 3.40 0.44 0.00 -1.26 -4.84 105.19 103.43 1jz4 n GLY 660 Ca -0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.42 1jz4 n GLY 660 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jz4 s LYS 661 N -0.31 3.00 -0.08 1.61 1.02 0.65 -4.63 119.74 121.00 1jz4 s LYS 661 Ca 0.00 -0.96 -0.36 0.00 0.02 0.00 0.00 55.97 54.67 1jz4 s LYS 661 Cb 0.00 -3.70 -0.14 0.00 -0.52 0.00 0.00 37.83 33.47 1jz4 s LYS 661 CO 0.00 -0.61 1.74 -0.35 -0.92 0.00 0.00 175.35 175.21 1jz4 n PRO 662 N 5.01 1.79 -0.07 -1.68 -0.04 -1.26 -0.52 135.00 138.22 1jz4 n PRO 662 Ca -0.12 0.65 -0.13 0.00 -0.04 0.00 0.00 63.50 63.86 1jz4 n PRO 662 Cb 0.47 -2.42 -0.06 0.00 -0.04 0.00 0.00 33.50 31.45 1jz4 n PRO 662 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1jz4 n LEU 663 N 5.35 2.16 -3.81 1.53 -0.00 -0.25 -4.91 117.00 117.06 1jz4 n LEU 663 Ca 0.22 0.04 -0.05 0.00 -0.00 0.00 0.00 56.01 56.22 1jz4 n LEU 663 Cb 0.24 -0.48 0.00 0.00 -0.00 0.00 0.00 43.42 43.18 1jz4 n LEU 663 CO 0.73 0.56 0.69 0.00 -0.00 0.00 0.00 177.39 179.36 1jz4 s ALA 664 N -2.28 -1.44 0.00 1.96 0.00 -1.03 -4.98 121.76 113.99 1jz4 s ALA 664 Ca -0.20 -0.19 0.00 0.00 0.00 0.00 0.00 51.96 51.57 1jz4 s ALA 664 Cb 0.06 0.70 0.00 0.00 0.00 0.00 0.00 23.12 23.89 1jz4 s ALA 664 CO 0.30 -1.04 0.00 -1.13 0.00 0.00 0.00 175.76 173.89 1jz4 n SER 665 N -0.82 0.00 -2.98 0.00 3.41 -1.26 -0.77 113.62 111.20 1jz4 n SER 665 Ca -0.05 0.00 0.03 0.00 -0.26 0.00 0.00 58.87 58.59 1jz4 n SER 665 Cb 0.60 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.56 1jz4 n SER 665 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1jz4 n GLY 666 N -0.52 0.20 3.22 5.00 0.00 0.21 -4.97 105.19 108.32 1jz4 n GLY 666 Ca 0.00 -0.94 -0.17 0.00 0.00 0.00 0.00 46.02 44.91 1jz4 n GLY 666 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1jz4 s GLU 667 N -2.00 0.95 -0.20 1.61 -1.05 -1.26 -0.12 118.70 116.63 1jz4 s GLU 667 Ca 0.21 -1.20 -0.17 0.00 -0.15 0.00 0.00 54.97 53.67 1jz4 s GLU 667 Cb -0.00 -0.77 0.06 0.00 -0.44 0.00 0.00 34.13 32.97 1jz4 s GLU 667 CO -0.02 0.14 0.53 0.08 0.95 0.00 0.00 175.26 176.94 1jz4 s VAL 668 N -2.20 -0.00 0.48 1.83 1.01 0.04 -4.99 120.40 116.57 1jz4 s VAL 668 Ca 0.07 0.02 -0.20 0.00 0.00 0.00 0.00 61.98 61.87 1jz4 s VAL 668 Cb -0.04 -0.75 -0.09 0.00 0.00 0.00 0.00 36.38 35.50 1jz4 s VAL 668 CO 0.02 0.01 1.01 -2.84 0.00 0.00 0.00 175.10 173.30 1jz4 s PRO 669 N 0.61 3.91 -0.24 2.72 0.02 -1.26 0.10 135.00 140.86 1jz4 s PRO 669 Ca -0.03 1.26 -0.10 0.00 0.02 0.00 0.00 61.00 62.15 1jz4 s PRO 669 Cb -0.05 -2.12 -0.05 0.00 0.02 0.00 0.00 34.50 32.31 1jz4 s PRO 669 CO -0.04 -0.33 0.16 -0.51 -0.33 0.00 0.00 177.00 175.95 1jz4 s LEU 670 N -3.48 4.10 -0.50 -5.54 1.43 -0.99 -4.75 118.68 108.95 1jz4 s LEU 670 Ca 0.65 0.11 0.04 0.00 -1.03 0.00 0.00 54.13 53.90 1jz4 s LEU 670 Cb -0.14 -2.10 0.16 0.00 0.03 0.00 0.00 46.19 44.14 1jz4 s LEU 670 CO 0.19 0.07 0.37 -0.62 0.23 0.00 0.00 176.35 176.59 1jz4 s ASP 671 N 1.04 2.87 -0.05 2.29 -1.08 -1.26 -4.70 116.67 115.77 1jz4 s ASP 671 Ca 0.07 -3.21 0.03 0.00 -0.52 0.00 0.00 52.55 48.92 1jz4 s ASP 671 Cb -0.13 -0.89 0.00 0.00 -1.46 0.00 0.00 42.92 40.44 1jz4 s ASP 671 CO 0.04 -0.16 -0.14 0.54 0.52 0.00 0.00 175.17 175.97 1jz4 s VAL 672 N -0.33 1.23 0.45 1.11 0.11 -1.26 -4.91 120.40 116.79 1jz4 s VAL 672 Ca 0.28 -0.57 -0.17 0.00 -2.93 0.00 0.00 61.98 58.58 1jz4 s VAL 672 Cb -0.04 -1.08 -0.09 0.00 -1.53 0.00 0.00 36.38 33.64 1jz4 s VAL 672 CO -0.15 0.37 0.92 0.00 -3.33 0.00 0.00 175.10 172.91 1jz4 s ALA 673 N 0.32 3.12 0.11 1.54 0.00 -1.26 -1.36 121.76 124.23 1jz4 s ALA 673 Ca -0.09 0.21 -0.35 0.00 0.00 0.00 0.00 51.96 51.73 1jz4 s ALA 673 Cb -0.13 -3.05 -0.16 0.00 0.00 0.00 0.00 23.12 19.78 1jz4 s ALA 673 CO 0.03 -0.00 1.26 -0.35 0.00 0.00 0.00 175.76 176.69 1jz4 n PRO 674 N -1.04 1.10 -0.87 0.00 -0.04 -1.20 0.29 135.00 133.23 1jz4 n PRO 674 Ca 0.06 0.40 0.00 0.00 -0.04 0.00 0.00 63.50 63.92 1jz4 n PRO 674 Cb 0.54 -1.98 0.00 0.00 -0.04 0.00 0.00 33.50 32.02 1jz4 n PRO 674 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1jz4 n GLN 675 N 2.20 -1.01 -2.03 0.54 1.13 -0.70 -4.94 117.38 112.56 1jz4 n GLN 675 Ca 0.17 0.25 -0.29 0.00 -1.94 0.00 0.00 57.00 55.20 1jz4 n GLN 675 Cb 0.21 -4.36 0.16 0.00 0.11 0.00 0.00 30.24 26.36 1jz4 n GLN 675 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1jz4 s GLY 676 N -2.00 1.75 0.11 1.08 0.00 0.83 -4.72 107.32 104.37 1jz4 s GLY 676 Ca 0.00 -1.19 0.05 0.00 0.00 0.00 0.00 44.72 43.58 1jz4 s GLY 676 CO 0.00 -0.50 -0.14 0.54 0.00 0.00 0.00 173.10 173.00 1jz4 s LYS 677 N -5.72 0.96 -0.05 2.90 3.01 -1.26 -1.47 119.74 118.10 1jz4 s LYS 677 Ca 0.71 -1.17 -0.04 0.00 -1.01 0.00 0.00 55.97 54.46 1jz4 s LYS 677 Cb -0.05 -0.84 0.02 0.00 -1.01 0.00 0.00 37.83 35.95 1jz4 s LYS 677 CO 0.51 0.16 0.13 -1.14 0.51 0.00 0.00 175.35 175.52 1jz4 s GLN 678 N -2.50 0.12 -0.16 1.68 0.74 0.10 -4.91 119.66 114.73 1jz4 s GLN 678 Ca 0.06 0.25 -0.07 0.00 0.05 0.00 0.00 55.36 55.65 1jz4 s GLN 678 Cb -0.06 -0.02 -0.04 0.00 1.10 0.00 0.00 33.01 33.99 1jz4 s GLN 678 CO 0.02 -0.07 0.07 -0.51 -0.55 0.00 0.00 175.29 174.25 1jz4 s LEU 679 N 0.48 3.89 -0.17 3.68 1.43 -1.26 -0.43 118.68 126.30 1jz4 s LEU 679 Ca -0.03 0.17 -0.01 0.00 -1.03 0.00 0.00 54.13 53.22 1jz4 s LEU 679 Cb -0.05 -1.96 0.05 0.00 0.03 0.00 0.00 46.19 44.25 1jz4 s LEU 679 CO -0.02 0.25 -0.02 -0.63 0.23 0.00 0.00 176.35 176.16 1jz4 s ILE 680 N -0.09 0.88 -0.28 -0.59 1.01 0.14 -4.97 121.20 117.31 1jz4 s ILE 680 Ca 0.07 -0.57 -0.29 0.00 0.00 0.00 0.00 60.65 59.86 1jz4 s ILE 680 Cb -0.12 -1.16 0.01 0.00 0.01 0.00 0.00 42.46 41.20 1jz4 s ILE 680 CO 0.01 0.02 1.11 -1.61 0.00 0.00 0.00 174.94 174.47 1jz4 s GLU 681 N 1.72 4.12 0.51 2.79 0.41 -1.26 -0.60 118.70 126.39 1jz4 s GLU 681 Ca 0.00 1.23 -0.22 0.00 -0.41 0.00 0.00 54.97 55.57 1jz4 s GLU 681 Cb -0.16 -3.73 -0.06 0.00 -1.78 0.00 0.00 34.13 28.40 1jz4 s GLU 681 CO -0.07 -0.83 1.29 -0.51 -0.49 0.00 0.00 175.26 174.64 1jz4 s LEU 682 N 3.60 3.92 0.84 1.80 1.43 0.25 -4.97 118.68 125.55 1jz4 s LEU 682 Ca 0.47 2.60 -0.11 0.00 -1.03 0.00 0.00 54.13 56.06 1jz4 s LEU 682 Cb -0.14 -4.26 0.10 0.00 0.03 0.00 0.00 46.19 41.92 1jz4 s LEU 682 CO 0.14 -1.32 1.13 -2.16 0.23 0.00 0.00 176.35 174.37 1jz4 s PRO 683 N -2.82 1.58 0.15 1.29 0.04 -1.26 -4.89 135.00 129.08 1jz4 s PRO 683 Ca 0.68 1.44 -0.31 0.00 0.04 0.00 0.00 61.00 62.85 1jz4 s PRO 683 Cb -0.36 -1.80 -0.08 0.00 0.04 0.00 0.00 34.50 32.30 1jz4 s PRO 683 CO 0.43 -2.20 1.36 -2.00 0.04 0.00 0.00 177.00 174.63 1jz4 s GLU 684 N -4.65 4.35 -0.01 4.56 2.12 -1.26 -4.98 118.70 118.82 1jz4 s GLU 684 Ca 0.66 2.07 0.04 0.00 0.36 0.00 0.00 54.97 58.10 1jz4 s GLU 684 Cb -0.21 -3.22 -0.03 0.00 0.26 0.00 0.00 34.13 30.92 1jz4 s GLU 684 CO 0.56 -0.36 -0.13 -0.51 -0.54 0.00 0.00 175.26 174.27 1jz4 s LEU 685 N 0.60 2.81 0.00 2.70 1.02 -1.26 -5.11 118.68 119.43 1jz4 s LEU 685 Ca 0.61 -0.24 -0.15 0.00 0.02 0.00 0.00 54.13 54.37 1jz4 s LEU 685 Cb -0.37 -1.61 0.24 0.00 0.02 0.00 0.00 46.19 44.47 1jz4 s LEU 685 CO 0.34 0.31 0.62 -0.81 0.02 0.00 0.00 176.35 176.83 1jz4 n PRO 686 N 1.92 -3.42 -4.88 1.29 -0.04 -1.26 -5.03 135.00 123.58 1jz4 n PRO 686 Ca -0.16 -1.03 -0.26 0.00 -0.04 0.00 0.00 63.50 62.00 1jz4 n PRO 686 Cb 0.52 -1.20 -0.15 0.00 -0.04 0.00 0.00 33.50 32.63 1jz4 n PRO 686 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 1jz4 s GLN 687 N -4.47 1.54 -0.30 0.54 0.00 -1.26 -5.09 119.66 110.63 1jz4 s GLN 687 Ca 0.45 -0.77 0.03 0.00 -0.00 0.00 0.00 55.36 55.08 1jz4 s GLN 687 Cb -0.07 -1.54 0.08 0.00 0.00 0.00 0.00 33.01 31.49 1jz4 s GLN 687 CO 0.37 0.41 -0.02 -1.25 0.00 0.00 0.00 175.29 174.80 1jz4 s PRO 688 N -0.65 1.79 0.00 9.60 0.04 -1.26 -4.95 135.00 139.57 1jz4 s PRO 688 Ca 0.08 -1.60 0.00 0.00 0.04 0.00 0.00 61.00 59.52 1jz4 s PRO 688 Cb -0.08 -3.02 0.00 0.00 0.04 0.00 0.00 34.50 31.44 1jz4 s PRO 688 CO -0.00 -0.77 0.77 0.39 0.04 0.00 0.00 177.00 177.43 1jz4 n GLU 689 N 4.36 0.82 -1.96 4.56 4.71 -1.26 -4.60 120.64 127.27 1jz4 n GLU 689 Ca -0.04 0.00 -0.43 0.00 -0.01 0.00 0.00 57.16 56.68 1jz4 n GLU 689 Cb 0.42 -1.06 -0.03 0.00 -1.01 0.00 0.00 31.44 29.76 1jz4 n GLU 689 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 1jz4 s SER 690 N -1.03 6.38 0.54 1.62 0.15 -1.26 -4.94 113.70 115.14 1jz4 s SER 690 Ca 0.00 1.99 -0.20 0.00 0.70 0.00 0.00 55.95 58.44 1jz4 s SER 690 Cb 0.00 -2.53 -0.08 0.00 -1.71 0.00 0.00 66.02 61.70 1jz4 s SER 690 CO 0.00 -1.20 0.71 0.00 1.20 0.00 0.00 173.24 173.95 1jz4 n ALA 691 N 8.28 -0.64 0.00 5.45 0.00 -1.26 -4.85 120.51 127.48 1jz4 n ALA 691 Ca 0.20 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1jz4 n ALA 691 Cb 0.44 -1.93 0.00 0.00 0.00 0.00 0.00 19.45 17.96 1jz4 n ALA 691 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jz4 n GLY 692 N 1.56 1.56 3.47 0.00 0.00 0.12 -4.94 105.19 106.96 1jz4 n GLY 692 Ca 0.12 -1.75 -0.35 0.00 0.00 0.00 0.00 46.02 44.03 1jz4 n GLY 692 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1jz4 s GLN 693 N -1.49 3.67 0.16 1.61 2.00 -1.26 1.00 119.66 125.35 1jz4 s GLN 693 Ca 0.00 -0.48 -0.19 0.00 -2.00 0.00 0.00 55.36 52.68 1jz4 s GLN 693 Cb 0.00 -3.17 -0.08 0.00 0.80 0.00 0.00 33.01 30.56 1jz4 s GLN 693 CO 0.00 -0.02 0.66 -0.51 -0.50 0.00 0.00 175.29 174.92 1jz4 s LEU 694 N 1.11 4.43 0.01 3.68 1.43 -0.84 -1.76 118.68 126.74 1jz4 s LEU 694 Ca 0.03 1.35 0.03 0.00 -1.03 0.00 0.00 54.13 54.51 1jz4 s LEU 694 Cb -0.14 -3.31 -0.01 0.00 0.03 0.00 0.00 46.19 42.76 1jz4 s LEU 694 CO 0.02 0.13 -0.09 0.26 0.23 0.00 0.00 176.35 176.90 1jz4 s TRP 695 N -1.35 0.81 -0.12 0.29 0.52 0.95 -0.89 118.94 119.15 1jz4 s TRP 695 Ca 0.37 -0.23 -0.02 0.00 0.02 0.00 0.00 56.10 56.24 1jz4 s TRP 695 Cb -0.18 -0.51 -0.03 0.00 -1.15 0.00 0.00 33.47 31.60 1jz4 s TRP 695 CO 0.21 -0.01 -0.05 -1.17 0.02 0.00 0.00 176.95 175.95 1jz4 s LEU 696 N -0.59 3.22 -0.04 2.99 2.96 -0.22 -1.45 118.68 125.55 1jz4 s LEU 696 Ca 0.01 -0.08 0.03 0.00 -0.22 0.00 0.00 54.13 53.87 1jz4 s LEU 696 Cb -0.05 -1.75 0.00 0.00 0.50 0.00 0.00 46.19 44.90 1jz4 s LEU 696 CO 0.00 0.25 -0.13 -0.89 -1.32 0.00 0.00 176.35 174.26 1jz4 s THR 697 N -0.13 1.16 0.04 3.68 2.01 0.92 -1.79 115.64 121.53 1jz4 s THR 697 Ca 0.02 -0.55 0.09 0.00 0.31 0.00 0.00 61.69 61.56 1jz4 s THR 697 Cb -0.13 -1.02 -0.03 0.00 0.01 0.00 0.00 72.50 71.33 1jz4 s THR 697 CO 0.03 0.35 -0.26 0.68 -0.69 0.00 0.00 174.62 174.73 1jz4 s VAL 698 N 0.22 2.06 -0.01 3.82 -7.23 -0.18 0.85 120.40 119.93 1jz4 s VAL 698 Ca -0.06 -1.34 0.01 0.00 -1.81 0.00 0.00 61.98 58.79 1jz4 s VAL 698 Cb -0.11 -1.76 -0.00 0.00 0.56 0.00 0.00 36.38 35.06 1jz4 s VAL 698 CO 0.02 0.36 -0.05 -0.13 -0.31 0.00 0.00 175.10 174.99 1jz4 s ARG 699 N -1.18 0.42 -0.22 4.82 0.52 0.57 -1.76 118.95 122.13 1jz4 s ARG 699 Ca 0.11 -0.16 -0.12 0.00 -0.52 0.00 0.00 55.73 55.04 1jz4 s ARG 699 Cb -0.10 -0.42 -0.05 0.00 0.52 0.00 0.00 34.95 34.91 1jz4 s ARG 699 CO 0.02 0.08 0.22 0.08 0.02 0.00 0.00 175.30 175.72 1jz4 s VAL 700 N 0.01 5.33 0.00 3.52 1.01 -0.04 -0.52 120.40 129.71 1jz4 s VAL 700 Ca 0.00 0.33 0.07 0.00 0.00 0.00 0.00 61.98 62.39 1jz4 s VAL 700 Cb -0.03 -3.56 -0.02 0.00 0.00 0.00 0.00 36.38 32.77 1jz4 s VAL 700 CO -0.00 0.35 -0.22 -0.69 0.00 0.00 0.00 175.10 174.53 1jz4 s VAL 701 N 0.93 1.75 -0.52 2.92 1.01 0.51 -2.06 120.40 124.95 1jz4 s VAL 701 Ca 0.11 -1.04 -0.16 0.00 0.00 0.00 0.00 61.98 60.88 1jz4 s VAL 701 Cb -0.13 -1.48 0.11 0.00 0.00 0.00 0.00 36.38 34.88 1jz4 s VAL 701 CO 0.04 0.41 0.48 -1.10 0.00 0.00 0.00 175.10 174.93 1jz4 s GLN 702 N -0.75 2.99 0.33 2.72 -0.21 -0.46 -0.91 119.66 123.38 1jz4 s GLN 702 Ca 0.09 -1.56 0.06 0.00 0.02 0.00 0.00 55.36 53.97 1jz4 s GLN 702 Cb -0.09 -4.24 0.60 0.00 1.00 0.00 0.00 33.01 30.28 1jz4 s GLN 702 CO 0.00 -1.24 1.83 -1.00 -2.12 0.00 0.00 175.29 172.76 1jz4 h PRO 703 N 8.86 0.39 -6.17 2.91 0.14 -1.88 1.42 132.00 137.67 1jz4 h PRO 703 Ca -0.29 -0.11 -0.62 0.00 0.14 0.00 0.00 66.00 65.12 1jz4 h PRO 703 Cb 1.10 -0.04 -0.08 0.00 0.14 0.00 0.00 31.00 32.12 1jz4 h PRO 703 CO 0.99 0.54 -0.58 -0.80 0.14 0.00 0.00 178.00 178.29 1jz4 s ASN 704 N -6.81 5.59 0.91 1.44 -0.87 -1.26 -3.84 114.94 110.10 1jz4 s ASN 704 Ca -0.06 -0.02 -0.12 0.00 -1.57 0.00 0.00 52.86 51.09 1jz4 s ASN 704 Cb 0.15 -1.51 0.14 0.00 -0.02 0.00 0.00 41.25 40.01 1jz4 s ASN 704 CO 0.76 0.14 1.09 0.00 -2.57 0.00 0.00 177.10 176.52 1jz4 s ALA 705 N -1.51 1.46 0.24 0.60 0.00 -1.26 -4.43 121.76 116.86 1jz4 s ALA 705 Ca 0.30 -0.12 0.05 0.00 0.00 0.00 0.00 51.96 52.19 1jz4 s ALA 705 Cb -0.12 -3.18 -0.02 0.00 0.00 0.00 0.00 23.12 19.81 1jz4 s ALA 705 CO 0.23 -2.42 0.20 0.25 0.00 0.00 0.00 175.76 174.01 1jz4 n THR 706 N -3.92 0.00 0.53 0.00 -2.24 0.57 -4.90 114.28 104.31 1jz4 n THR 706 Ca 0.07 -1.72 0.12 0.00 -2.27 0.00 0.00 64.05 60.24 1jz4 n THR 706 Cb 0.56 0.85 0.45 0.00 -2.10 0.00 0.00 70.33 70.09 1jz4 n THR 706 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1jz4 n ALA 707 N -1.39 1.89 -0.10 6.98 0.00 -1.26 -3.41 120.51 123.22 1jz4 n ALA 707 Ca -0.08 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1jz4 n ALA 707 Cb 0.43 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.48 1jz4 n ALA 707 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.50 174.83 1jz4 n TRP 708 N -2.07 0.00 -3.47 0.00 4.27 -1.26 -5.04 117.44 109.87 1jz4 n TRP 708 Ca 0.04 -0.38 -0.14 0.00 -3.89 0.00 0.00 57.50 53.12 1jz4 n TRP 708 Cb 0.28 -0.04 -0.04 0.00 -1.36 0.00 0.00 31.31 30.16 1jz4 n TRP 708 CO 0.00 0.00 0.00 -1.54 -2.29 0.00 0.00 177.69 173.86 1jz4 s SER 709 N -0.76 -0.58 0.28 -0.67 1.04 -1.22 -4.56 113.70 107.22 1jz4 s SER 709 Ca 0.00 0.25 -0.08 0.00 0.48 0.00 0.00 55.95 56.59 1jz4 s SER 709 Cb 0.00 0.57 -0.06 0.00 0.10 0.00 0.00 66.02 66.63 1jz4 s SER 709 CO 0.00 -0.83 0.59 -1.61 0.98 0.00 0.00 173.24 172.37 1jz4 s GLU 710 N -2.81 3.74 0.34 4.02 2.02 -1.26 -0.31 118.70 124.45 1jz4 s GLU 710 Ca -0.03 0.22 -0.28 0.00 0.02 0.00 0.00 54.97 54.90 1jz4 s GLU 710 Cb -0.01 -2.60 -0.12 0.00 0.10 0.00 0.00 34.13 31.50 1jz4 s GLU 710 CO -0.05 0.22 1.26 0.00 0.02 0.00 0.00 175.26 176.72 1jz4 n ALA 711 N -0.61 1.17 -0.29 5.21 0.00 -1.26 -1.40 120.51 123.33 1jz4 n ALA 711 Ca 0.00 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.80 1jz4 n ALA 711 Cb 0.53 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.75 1jz4 n ALA 711 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jz4 n GLY 712 N 0.81 1.19 3.63 0.00 0.00 0.48 -4.95 105.19 106.36 1jz4 n GLY 712 Ca 0.05 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.61 1jz4 n GLY 712 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1jz4 n HIS 713 N -2.00 1.81 -3.46 1.61 -0.00 -0.49 -4.56 115.22 108.13 1jz4 n HIS 713 Ca 0.00 0.53 -0.38 0.00 0.46 0.00 0.00 57.72 58.33 1jz4 n HIS 713 Cb 0.00 -2.39 -0.09 0.00 -0.12 0.00 0.00 29.99 27.40 1jz4 n HIS 713 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 1jz4 s ILE 714 N -0.10 5.23 -0.11 3.57 1.01 -1.26 -1.36 121.20 128.19 1jz4 s ILE 714 Ca 0.70 0.52 0.17 0.00 0.00 0.00 0.00 60.65 62.05 1jz4 s ILE 714 Cb -0.73 -3.66 -0.25 0.00 0.01 0.00 0.00 42.46 37.82 1jz4 s ILE 714 CO 0.50 0.24 0.22 -1.54 0.00 0.00 0.00 174.94 174.37 1jz4 n SER 715 N 4.71 0.60 -3.49 3.58 3.41 -0.87 -5.03 113.62 116.53 1jz4 n SER 715 Ca -0.10 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.38 1jz4 n SER 715 Cb 0.51 1.35 -0.04 0.00 -0.26 0.00 0.00 64.21 65.78 1jz4 n SER 715 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1jz4 s ALA 716 N -2.83 -1.74 0.25 7.33 0.00 -1.24 -4.63 121.76 118.89 1jz4 s ALA 716 Ca -0.08 0.98 -0.16 0.00 0.00 0.00 0.00 51.96 52.71 1jz4 s ALA 716 Cb 0.08 0.33 0.01 0.00 0.00 0.00 0.00 23.12 23.54 1jz4 s ALA 716 CO 0.76 -0.58 0.55 1.67 0.00 0.00 0.00 175.76 178.16 1jz4 s TRP 717 N -2.54 0.15 -0.23 0.00 -2.14 -1.26 -0.86 118.94 112.06 1jz4 s TRP 717 Ca -0.02 -0.54 -0.28 0.00 2.66 0.00 0.00 56.10 57.92 1jz4 s TRP 717 Cb -0.01 0.36 0.15 0.00 -3.10 0.00 0.00 33.47 30.87 1jz4 s TRP 717 CO -0.04 -1.05 1.13 -1.14 -2.66 0.00 0.00 176.95 173.20 1jz4 s GLN 718 N -3.97 0.40 0.12 3.25 2.00 -0.72 -5.00 119.66 115.75 1jz4 s GLN 718 Ca 0.18 0.21 0.05 0.00 -2.00 0.00 0.00 55.36 53.79 1jz4 s GLN 718 Cb -0.02 0.19 -0.04 0.00 0.80 0.00 0.00 33.01 33.94 1jz4 s GLN 718 CO 0.07 -0.10 -0.12 -0.65 -0.50 0.00 0.00 175.29 173.99 1jz4 s GLN 719 N -0.66 0.99 -0.02 1.67 -0.21 -1.26 -1.01 119.66 119.16 1jz4 s GLN 719 Ca 0.03 -1.28 -0.10 0.00 0.02 0.00 0.00 55.36 54.03 1jz4 s GLN 719 Cb -0.02 -0.74 0.01 0.00 1.00 0.00 0.00 33.01 33.26 1jz4 s GLN 719 CO -0.04 0.12 0.20 -1.58 -2.12 0.00 0.00 175.29 171.88 1jz4 s TRP 720 N -2.56 -0.07 0.16 0.91 0.51 -0.74 -5.01 118.94 112.14 1jz4 s TRP 720 Ca 0.10 0.10 -0.26 0.00 -2.12 0.00 0.00 56.10 53.92 1jz4 s TRP 720 Cb -0.02 0.02 -0.08 0.00 -0.81 0.00 0.00 33.47 32.58 1jz4 s TRP 720 CO 0.02 -0.30 0.81 1.03 -0.51 0.00 0.00 176.95 178.01 1jz4 s ARG 721 N -1.15 4.62 0.00 4.98 0.52 -1.26 -1.05 118.95 125.60 1jz4 s ARG 721 Ca -0.12 1.22 0.00 0.00 -0.52 0.00 0.00 55.73 56.31 1jz4 s ARG 721 Cb -0.06 -3.28 0.00 0.00 0.52 0.00 0.00 34.95 32.13 1jz4 s ARG 721 CO 0.02 0.51 0.00 1.28 0.02 0.00 0.00 175.30 177.13 1jz4 n LEU 722 N 1.77 0.00 -4.68 2.53 4.77 -0.06 -4.90 117.00 116.43 1jz4 n LEU 722 Ca -0.04 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.54 1jz4 n LEU 722 Cb 0.49 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.60 1jz4 n LEU 722 CO 0.47 0.00 0.79 0.00 -1.33 0.00 0.00 177.39 177.32 1jz4 n ALA 723 N -3.00 0.97 -2.87 -1.18 0.00 -1.26 -4.63 120.51 108.53 1jz4 n ALA 723 Ca 0.00 0.20 -0.31 0.00 0.00 0.00 0.00 53.44 53.33 1jz4 n ALA 723 Cb 0.00 -2.22 -0.17 0.00 0.00 0.00 0.00 19.45 17.06 1jz4 n ALA 723 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1jz4 s GLU 724 N -2.35 2.57 -0.35 0.00 2.12 -1.26 -1.98 118.70 117.45 1jz4 s GLU 724 Ca 0.65 -0.86 0.04 0.00 0.36 0.00 0.00 54.97 55.16 1jz4 s GLU 724 Cb -0.49 -2.12 0.10 0.00 0.26 0.00 0.00 34.13 31.88 1jz4 s GLU 724 CO 0.55 0.32 0.06 -0.80 -0.54 0.00 0.00 175.26 174.85 1jz4 s ASN 725 N -0.02 4.76 0.46 -1.70 0.01 0.28 -4.97 114.94 113.76 1jz4 s ASN 725 Ca -0.07 -2.19 -0.24 0.00 -0.71 0.00 0.00 52.86 49.64 1jz4 s ASN 725 Cb -0.14 -1.63 -0.07 0.00 0.41 0.00 0.00 41.25 39.81 1jz4 s ASN 725 CO 0.05 -0.38 1.30 -0.76 -1.51 0.00 0.00 177.10 175.80 1jz4 s LEU 726 N 0.85 4.06 -0.21 0.60 1.43 -1.26 0.13 118.68 124.29 1jz4 s LEU 726 Ca 0.11 2.63 -0.29 0.00 -1.03 0.00 0.00 54.13 55.55 1jz4 s LEU 726 Cb -0.19 -4.08 0.01 0.00 0.03 0.00 0.00 46.19 41.95 1jz4 s LEU 726 CO -0.08 -1.09 1.05 -0.55 0.23 0.00 0.00 176.35 175.92 1jz4 s SER 727 N -0.91 7.11 0.00 2.29 0.15 -1.26 -4.85 113.70 116.22 1jz4 s SER 727 Ca 0.63 1.43 0.00 0.00 0.70 0.00 0.00 55.95 58.70 1jz4 s SER 727 Cb -0.37 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.40 1jz4 s SER 727 CO 0.46 -0.65 0.91 1.33 1.20 0.00 0.00 173.24 176.49 1jz4 n VAL 728 N 5.22 0.82 -3.40 4.45 0.24 -1.26 -5.01 118.33 119.39 1jz4 n VAL 728 Ca 0.12 -0.89 -0.38 0.00 -2.04 0.00 0.00 64.34 61.15 1jz4 n VAL 728 Cb 0.46 0.60 -0.06 0.00 -1.47 0.00 0.00 33.84 33.37 1jz4 n VAL 728 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1jz4 s THR 729 N -0.82 5.15 0.03 3.34 -4.23 -1.26 -5.04 115.64 112.81 1jz4 s THR 729 Ca 0.00 0.86 -0.30 0.00 -1.18 0.00 0.00 61.69 61.07 1jz4 s THR 729 Cb 0.00 -3.76 -0.05 0.00 1.34 0.00 0.00 72.50 70.03 1jz4 s THR 729 CO 0.00 0.42 1.12 -0.76 -0.54 0.00 0.00 174.62 174.85 1jz4 s LEU 730 N 0.05 4.37 0.59 4.79 1.02 -1.26 -5.00 118.68 123.24 1jz4 s LEU 730 Ca 0.24 1.87 -0.19 0.00 0.02 0.00 0.00 54.13 56.07 1jz4 s LEU 730 Cb -0.15 -3.57 -0.05 0.00 0.02 0.00 0.00 46.19 42.44 1jz4 s LEU 730 CO 0.10 -0.40 1.03 -0.81 0.02 0.00 0.00 176.35 176.30 1jz4 n PRO 731 N 3.98 1.00 -1.70 1.29 -0.04 -1.26 -4.86 135.00 133.41 1jz4 n PRO 731 Ca 0.08 0.38 -0.43 0.00 -0.04 0.00 0.00 63.50 63.49 1jz4 n PRO 731 Cb 0.48 -2.23 -0.02 0.00 -0.04 0.00 0.00 33.50 31.70 1jz4 n PRO 731 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1jz4 n ALA 732 N -1.64 1.54 -1.82 0.55 0.00 -1.26 -4.91 120.51 112.98 1jz4 n ALA 732 Ca 0.13 0.38 -0.41 0.00 0.00 0.00 0.00 53.44 53.55 1jz4 n ALA 732 Cb 0.47 -2.32 -0.02 0.00 0.00 0.00 0.00 19.45 17.58 1jz4 n ALA 732 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jz4 s ALA 733 N -0.43 3.63 -0.25 0.00 0.00 -1.26 -4.98 121.76 118.47 1jz4 s ALA 733 Ca 0.62 1.42 -0.28 0.00 0.00 0.00 0.00 51.96 53.72 1jz4 s ALA 733 Cb -0.58 -3.58 -0.04 0.00 0.00 0.00 0.00 23.12 18.92 1jz4 s ALA 733 CO 0.54 -0.84 1.99 -1.54 0.00 0.00 0.00 175.76 175.91 1jz4 s SER 734 N 0.20 5.76 0.00 0.00 1.04 -1.26 -4.94 113.70 114.50 1jz4 s SER 734 Ca 0.58 1.67 0.00 0.00 0.48 0.00 0.00 55.95 58.68 1jz4 s SER 734 Cb -0.44 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.16 1jz4 s SER 734 CO 0.49 -1.75 0.95 1.41 0.98 0.00 0.00 173.24 175.31 1jz4 n HIS 735 N 10.64 0.00 -0.50 5.02 8.25 -1.26 -4.84 115.22 132.53 1jz4 n HIS 735 Ca 0.26 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.72 1jz4 n HIS 735 Cb 0.45 -0.45 0.00 0.00 1.12 0.00 0.00 29.99 31.12 1jz4 n HIS 735 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1jz4 n ALA 736 N -2.14 0.00 -3.65 -1.41 0.00 -1.26 -5.08 120.51 106.97 1jz4 n ALA 736 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1jz4 n ALA 736 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 1jz4 n ALA 736 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1jz4 s ILE 737 N -0.71 -0.85 0.55 0.00 2.07 -1.26 -4.42 121.20 116.58 1jz4 s ILE 737 Ca 0.00 0.01 -0.21 0.00 -1.41 0.00 0.00 60.65 59.04 1jz4 s ILE 737 Cb 0.00 -0.99 -0.05 0.00 0.13 0.00 0.00 42.46 41.56 1jz4 s ILE 737 CO 0.00 0.00 1.26 -2.16 -1.91 0.00 0.00 174.94 172.13 1jz4 s PRO 738 N 2.72 3.19 -0.08 3.50 0.05 -1.26 -4.98 135.00 138.14 1jz4 s PRO 738 Ca -0.06 1.97 -0.00 0.00 0.05 0.00 0.00 61.00 62.96 1jz4 s PRO 738 Cb -0.11 -2.15 -0.03 0.00 0.05 0.00 0.00 34.50 32.26 1jz4 s PRO 738 CO -0.19 -1.07 -0.04 -1.01 0.05 0.00 0.00 177.00 174.74 1jz4 s HIS 739 N -1.47 3.03 -0.20 0.56 3.76 -0.40 -4.78 115.29 115.79 1jz4 s HIS 739 Ca 0.72 0.08 -0.09 0.00 -0.15 0.00 0.00 55.06 55.63 1jz4 s HIS 739 Cb -0.34 -1.75 -0.04 0.00 1.11 0.00 0.00 32.58 31.56 1jz4 s HIS 739 CO 0.39 0.38 0.10 -1.17 -0.85 0.00 0.00 174.74 173.59 1jz4 s LEU 740 N -0.82 3.92 -0.15 0.89 2.96 -1.26 -0.07 118.68 124.15 1jz4 s LEU 740 Ca 0.12 0.09 0.01 0.00 -0.22 0.00 0.00 54.13 54.14 1jz4 s LEU 740 Cb -0.11 -2.02 0.01 0.00 0.50 0.00 0.00 46.19 44.57 1jz4 s LEU 740 CO 0.02 0.13 -0.19 -0.89 -1.32 0.00 0.00 176.35 174.10 1jz4 s THR 741 N 0.64 2.33 0.06 3.68 2.01 0.26 -4.97 115.64 119.65 1jz4 s THR 741 Ca 0.05 -0.88 0.02 0.00 0.31 0.00 0.00 61.69 61.20 1jz4 s THR 741 Cb -0.13 -1.97 -0.04 0.00 0.01 0.00 0.00 72.50 70.38 1jz4 s THR 741 CO 0.01 0.53 0.08 -0.89 -0.69 0.00 0.00 174.62 173.66 1jz4 s THR 742 N 0.91 4.58 0.13 -0.82 2.01 -1.26 -0.73 115.64 120.46 1jz4 s THR 742 Ca -0.04 -0.68 -0.03 0.00 0.31 0.00 0.00 61.69 61.25 1jz4 s THR 742 Cb -0.15 -3.18 -0.03 0.00 0.01 0.00 0.00 72.50 69.15 1jz4 s THR 742 CO -0.03 0.18 0.11 -0.94 -0.69 0.00 0.00 174.62 173.25 1jz4 s SER 743 N -2.23 0.26 0.50 3.53 1.04 0.82 -4.99 113.70 112.63 1jz4 s SER 743 Ca 0.28 -1.09 0.15 0.00 0.48 0.00 0.00 55.95 55.78 1jz4 s SER 743 Cb -0.12 0.32 1.20 0.00 0.10 0.00 0.00 66.02 67.52 1jz4 s SER 743 CO 0.20 -0.75 2.11 -0.08 0.98 0.00 0.00 173.24 175.70 1jz4 h GLU 744 N 2.81 0.01 0.00 4.02 4.81 -2.02 -3.08 114.58 121.13 1jz4 h GLU 744 Ca -0.34 -0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 58.69 1jz4 h GLU 744 Cb 1.20 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.54 1jz4 h GLU 744 CO 0.57 0.05 -1.47 1.98 -0.73 0.00 0.00 179.01 179.41 1jz4 h MET 745 N 0.01 0.00 -3.51 1.92 4.05 -1.95 -3.43 114.93 112.01 1jz4 h MET 745 Ca 0.00 0.00 -0.11 0.00 -0.28 0.00 0.00 59.70 59.31 1jz4 h MET 745 Cb 0.07 0.00 -0.17 0.00 -0.80 0.00 0.00 31.60 30.69 1jz4 h MET 745 CO 0.00 0.36 -0.38 -0.51 0.23 0.00 0.00 176.91 176.61 1jz4 s ASP 746 N -5.89 0.01 -0.22 1.39 1.01 -1.16 0.24 116.67 112.05 1jz4 s ASP 746 Ca -0.03 -0.33 -0.02 0.00 0.71 0.00 0.00 52.55 52.88 1jz4 s ASP 746 Cb 0.08 0.29 0.01 0.00 1.01 0.00 0.00 42.92 44.32 1jz4 s ASP 746 CO 0.81 -0.55 -0.10 -0.36 0.21 0.00 0.00 175.17 175.18 1jz4 s PHE 747 N -2.49 2.95 -0.06 4.23 2.99 0.42 -0.13 117.98 125.90 1jz4 s PHE 747 Ca -0.06 -1.38 0.04 0.00 0.00 0.00 0.00 56.93 55.53 1jz4 s PHE 747 Cb -0.01 -2.03 -0.02 0.00 0.00 0.00 0.00 43.02 40.96 1jz4 s PHE 747 CO -0.03 -0.69 -0.19 0.00 -0.00 0.00 0.00 175.22 174.30 1jz4 s ILE 749 N -0.40 2.67 -0.00 0.00 1.09 0.03 -0.58 121.20 124.02 1jz4 s ILE 749 Ca 0.04 -1.01 0.05 0.00 -1.10 0.00 0.00 60.65 58.63 1jz4 s ILE 749 Cb -0.12 -2.04 -0.01 0.00 -1.06 0.00 0.00 42.46 39.22 1jz4 s ILE 749 CO 0.02 0.49 -0.16 -0.70 -0.10 0.00 0.00 174.94 174.49 1jz4 s GLU 750 N -0.96 1.25 -0.27 2.79 2.12 0.90 -0.57 118.70 123.95 1jz4 s GLU 750 Ca 0.12 -0.61 -0.02 0.00 0.36 0.00 0.00 54.97 54.82 1jz4 s GLU 750 Cb -0.10 -1.22 0.16 0.00 0.26 0.00 0.00 34.13 33.23 1jz4 s GLU 750 CO 0.02 0.33 0.49 -1.17 -0.54 0.00 0.00 175.26 174.39 1jz4 s LEU 751 N -0.52 -1.02 0.00 2.70 2.96 0.71 -1.27 118.68 122.24 1jz4 s LEU 751 Ca 0.06 0.56 0.00 0.00 -0.22 0.00 0.00 54.13 54.53 1jz4 s LEU 751 Cb -0.06 1.65 0.00 0.00 0.50 0.00 0.00 46.19 48.28 1jz4 s LEU 751 CO -0.00 -0.28 0.00 0.61 -1.32 0.00 0.00 176.35 175.36 1jz4 n GLY 752 N 5.40 3.33 0.55 7.98 0.00 -1.26 0.42 105.19 121.61 1jz4 n GLY 752 Ca -0.02 -0.20 0.06 0.00 0.00 0.00 0.00 46.02 45.86 1jz4 n GLY 752 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1jz4 n ASN 753 N 3.94 1.62 -4.83 1.61 6.94 -1.26 -4.85 115.26 118.43 1jz4 n ASN 753 Ca 0.00 -1.92 -0.37 0.00 -0.02 0.00 0.00 54.58 52.27 1jz4 n ASN 753 Cb 0.00 -0.18 -0.06 0.00 -2.36 0.00 0.00 39.78 37.18 1jz4 n ASN 753 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1jz4 s LYS 754 N -1.64 3.78 -0.03 -3.83 1.02 0.17 0.97 119.74 120.18 1jz4 s LYS 754 Ca 0.24 0.11 -0.02 0.00 0.02 0.00 0.00 55.97 56.32 1jz4 s LYS 754 Cb 0.12 -3.25 0.01 0.00 -0.52 0.00 0.00 37.83 34.20 1jz4 s LYS 754 CO 0.17 0.64 0.07 -0.98 -0.92 0.00 0.00 175.35 174.34 1jz4 s ARG 755 N -0.76 0.06 0.02 1.68 1.70 -0.74 0.26 118.95 121.17 1jz4 s ARG 755 Ca 0.18 0.15 0.06 0.00 -0.47 0.00 0.00 55.73 55.65 1jz4 s ARG 755 Cb -0.14 -0.04 -0.02 0.00 -0.57 0.00 0.00 34.95 34.18 1jz4 s ARG 755 CO 0.07 -0.06 -0.19 -1.58 -1.08 0.00 0.00 175.30 172.47 1jz4 s TRP 756 N 0.37 1.65 -0.10 5.89 0.51 0.26 -1.65 118.94 125.86 1jz4 s TRP 756 Ca -0.03 -0.34 0.02 0.00 -2.12 0.00 0.00 56.10 53.63 1jz4 s TRP 756 Cb -0.04 -1.02 0.01 0.00 -0.81 0.00 0.00 33.47 31.62 1jz4 s TRP 756 CO -0.01 0.03 -0.15 -1.14 -0.51 0.00 0.00 176.95 175.17 1jz4 s GLN 757 N -0.83 2.17 -0.23 4.98 0.74 0.23 -0.79 119.66 125.94 1jz4 s GLN 757 Ca 0.06 -0.55 -0.01 0.00 0.05 0.00 0.00 55.36 54.91 1jz4 s GLN 757 Cb -0.08 -1.84 0.02 0.00 1.10 0.00 0.00 33.01 32.21 1jz4 s GLN 757 CO 0.01 -0.05 -0.08 -0.06 -0.55 0.00 0.00 175.29 174.55 1jz4 s PHE 758 N 0.95 3.01 -0.13 1.67 0.40 0.94 0.84 117.98 125.66 1jz4 s PHE 758 Ca -0.08 -1.51 -0.29 0.00 -0.60 0.00 0.00 56.93 54.45 1jz4 s PHE 758 Cb -0.15 -2.04 -0.03 0.00 0.51 0.00 0.00 43.02 41.31 1jz4 s PHE 758 CO -0.01 -0.72 1.42 1.21 0.70 0.00 0.00 175.22 177.82 1jz4 s ASN 759 N 1.33 6.80 0.14 1.36 3.84 -0.83 -0.43 114.94 127.15 1jz4 s ASN 759 Ca 0.01 1.86 0.24 0.00 0.21 0.00 0.00 52.86 55.19 1jz4 s ASN 759 Cb -0.16 -2.54 0.92 0.00 -0.55 0.00 0.00 41.25 38.92 1jz4 s ASN 759 CO -0.06 -0.86 1.74 0.54 -2.79 0.00 0.00 177.10 175.67 1jz4 n ARG 760 N 6.88 0.14 -0.03 0.43 1.74 0.66 -0.23 116.66 126.26 1jz4 n ARG 760 Ca 0.15 0.23 -0.11 0.00 -0.77 0.00 0.00 57.85 57.36 1jz4 n ARG 760 Cb 0.44 -1.71 -0.14 0.00 -1.02 0.00 0.00 32.46 30.03 1jz4 n ARG 760 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 1jz4 n GLN 761 N -1.96 0.66 0.01 5.56 7.27 -1.24 -4.32 117.38 123.36 1jz4 n GLN 761 Ca 0.05 0.25 0.01 0.00 0.07 0.00 0.00 57.00 57.38 1jz4 n GLN 761 Cb 0.31 -1.74 -0.10 0.00 2.41 0.00 0.00 30.24 31.12 1jz4 n GLN 761 CO 0.00 0.00 0.00 -1.13 0.07 0.00 0.00 177.06 176.00 1jz4 n SER 762 N -3.08 0.58 -0.16 1.69 3.41 -1.20 -4.76 113.62 110.09 1jz4 n SER 762 Ca -0.22 0.25 -0.02 0.00 -0.26 0.00 0.00 58.87 58.62 1jz4 n SER 762 Cb 1.06 0.63 -0.01 0.00 -0.26 0.00 0.00 64.21 65.63 1jz4 n SER 762 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1jz4 n GLY 763 N 1.41 0.56 3.48 5.00 0.00 0.68 -4.84 105.19 111.48 1jz4 n GLY 763 Ca -0.12 -0.71 -0.26 0.00 0.00 0.00 0.00 46.02 44.93 1jz4 n GLY 763 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1jz4 s PHE 764 N -2.05 2.39 -0.35 1.61 0.40 -1.23 -4.91 117.98 113.84 1jz4 s PHE 764 Ca 0.00 -0.32 -0.27 0.00 -0.60 0.00 0.00 56.93 55.74 1jz4 s PHE 764 Cb 0.00 -1.14 -0.05 0.00 0.51 0.00 0.00 43.02 42.34 1jz4 s PHE 764 CO 0.00 0.56 2.20 -1.17 0.70 0.00 0.00 175.22 177.52 1jz4 s LEU 765 N -2.97 3.42 0.04 -0.37 2.96 -1.26 -1.97 118.68 118.53 1jz4 s LEU 765 Ca 0.25 1.43 0.22 0.00 -0.22 0.00 0.00 54.13 55.81 1jz4 s LEU 765 Cb -0.07 -3.11 -0.08 0.00 0.50 0.00 0.00 46.19 43.42 1jz4 s LEU 765 CO 0.13 -2.27 0.88 -1.54 -1.32 0.00 0.00 176.35 172.23 1jz4 n SER 766 N 13.00 0.54 -3.47 3.68 3.41 0.25 -1.98 113.62 129.04 1jz4 n SER 766 Ca 0.31 -0.20 -0.14 0.00 -0.26 0.00 0.00 58.87 58.58 1jz4 n SER 766 Cb 0.49 1.07 -0.04 0.00 -0.26 0.00 0.00 64.21 65.47 1jz4 n SER 766 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 1jz4 s GLN 767 N -3.27 1.18 -0.07 4.33 2.00 -1.01 -4.45 119.66 118.38 1jz4 s GLN 767 Ca 0.01 -0.22 -0.10 0.00 -2.00 0.00 0.00 55.36 53.05 1jz4 s GLN 767 Cb 0.14 0.55 0.02 0.00 0.80 0.00 0.00 33.01 34.52 1jz4 s GLN 767 CO 0.83 -0.47 0.25 -1.64 -0.50 0.00 0.00 175.29 173.77 1jz4 s MET 768 N -2.82 0.38 0.02 1.67 -1.94 -1.26 0.78 119.30 116.13 1jz4 s MET 768 Ca -0.03 0.17 0.02 0.00 -1.71 0.00 0.00 55.69 54.14 1jz4 s MET 768 Cb -0.01 0.17 -0.01 0.00 2.01 0.00 0.00 34.83 36.99 1jz4 s MET 768 CO -0.05 -0.07 -0.08 -1.58 -0.01 0.00 0.00 175.02 173.24 1jz4 s TRP 769 N -0.28 0.66 -0.28 -0.03 0.23 -0.66 -0.21 118.94 118.38 1jz4 s TRP 769 Ca -0.04 -0.28 -0.04 0.00 -2.03 0.00 0.00 56.10 53.70 1jz4 s TRP 769 Cb -0.03 -0.41 0.02 0.00 0.03 0.00 0.00 33.47 33.08 1jz4 s TRP 769 CO 0.01 -0.03 0.02 0.42 0.96 0.00 0.00 176.95 178.33 1jz4 s ILE 770 N -0.70 3.46 0.00 2.03 1.01 -0.41 -1.78 121.20 124.80 1jz4 s ILE 770 Ca -0.03 -0.88 0.00 0.00 0.00 0.00 0.00 60.65 59.75 1jz4 s ILE 770 Cb -0.06 -2.79 0.00 0.00 0.01 0.00 0.00 42.46 39.62 1jz4 s ILE 770 CO 0.00 0.11 0.00 0.61 0.00 0.00 0.00 174.94 175.66 1jz4 n GLY 771 N 4.77 2.42 0.52 6.18 0.00 0.27 -0.26 105.19 119.10 1jz4 n GLY 771 Ca -0.15 -0.47 0.12 0.00 0.00 0.00 0.00 46.02 45.52 1jz4 n GLY 771 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1jz4 n ASP 772 N 0.77 1.58 -4.68 1.61 5.68 -1.26 -4.88 116.55 115.37 1jz4 n ASP 772 Ca 0.00 -1.63 -0.41 0.00 -0.50 0.00 0.00 54.79 52.24 1jz4 n ASP 772 Cb 0.00 -0.07 -0.04 0.00 -1.14 0.00 0.00 41.12 39.87 1jz4 n ASP 772 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 1jz4 s LYS 773 N -1.86 4.36 0.33 0.11 2.47 0.65 -5.05 119.74 120.75 1jz4 s LYS 773 Ca 0.34 1.08 -0.27 0.00 -1.56 0.00 0.00 55.97 55.56 1jz4 s LYS 773 Cb 0.19 -3.54 -0.09 0.00 -1.46 0.00 0.00 37.83 32.92 1jz4 s LYS 773 CO 0.29 -0.24 1.05 0.15 0.16 0.00 0.00 175.35 176.75 1jz4 s LYS 774 N 1.82 4.44 -0.02 4.03 1.02 -1.26 -1.29 119.74 128.48 1jz4 s LYS 774 Ca 0.41 1.59 0.13 0.00 0.02 0.00 0.00 55.97 58.12 1jz4 s LYS 774 Cb -0.17 -2.87 -0.20 0.00 -0.52 0.00 0.00 37.83 34.07 1jz4 s LYS 774 CO 0.15 0.09 0.29 1.04 -0.92 0.00 0.00 175.35 176.01 1jz4 n GLN 775 N 0.59 0.50 -4.90 1.68 1.13 0.71 -4.73 117.38 112.35 1jz4 n GLN 775 Ca 0.02 -0.11 -0.33 0.00 -1.94 0.00 0.00 57.00 54.64 1jz4 n GLN 775 Cb 0.48 -1.29 -0.13 0.00 0.11 0.00 0.00 30.24 29.40 1jz4 n GLN 775 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1jz4 s LEU 776 N -3.83 2.71 -0.21 1.08 1.43 -1.26 0.58 118.68 119.18 1jz4 s LEU 776 Ca -0.04 -0.21 0.12 0.00 -1.03 0.00 0.00 54.13 52.97 1jz4 s LEU 776 Cb 0.08 -1.55 -0.22 0.00 0.03 0.00 0.00 46.19 44.53 1jz4 s LEU 776 CO 0.53 0.34 0.01 0.18 0.23 0.00 0.00 176.35 177.64 1jz4 n LEU 777 N 2.34 1.11 -3.92 1.79 4.77 0.17 -4.71 117.00 118.55 1jz4 n LEU 777 Ca -0.17 -0.02 -0.19 0.00 -0.03 0.00 0.00 56.01 55.60 1jz4 n LEU 777 Cb 0.52 -0.03 -0.16 0.00 -2.33 0.00 0.00 43.42 41.42 1jz4 n LEU 777 CO 0.25 0.65 -0.41 -0.89 -1.33 0.00 0.00 177.39 175.67 1jz4 s THR 778 N -2.51 0.52 0.86 -5.08 2.01 -1.14 -4.96 115.64 105.35 1jz4 s THR 778 Ca -0.18 -0.17 -0.13 0.00 0.31 0.00 0.00 61.69 61.52 1jz4 s THR 778 Cb 0.07 -0.52 0.05 0.00 0.01 0.00 0.00 72.50 72.12 1jz4 s THR 778 CO 0.75 0.20 0.81 -2.65 -0.69 0.00 0.00 174.62 173.04 1jz4 n PRO 779 N 3.69 -0.05 -2.61 4.92 -0.02 -1.26 -3.10 135.00 136.57 1jz4 n PRO 779 Ca -0.22 0.05 -0.43 0.00 -2.02 0.00 0.00 63.50 60.88 1jz4 n PRO 779 Cb 0.53 -2.12 -0.02 0.00 -0.02 0.00 0.00 33.50 31.86 1jz4 n PRO 779 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1jz4 s LEU 780 N -3.27 3.65 0.15 2.45 2.96 -0.84 -4.44 118.68 119.35 1jz4 s LEU 780 Ca 0.65 0.48 0.07 0.00 -0.22 0.00 0.00 54.13 55.11 1jz4 s LEU 780 Cb -0.27 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.84 1jz4 s LEU 780 CO 0.59 -1.24 -0.15 -0.13 -1.32 0.00 0.00 176.35 174.10 1jz4 s ARG 781 N 4.41 1.15 0.67 1.98 0.52 0.09 -4.18 118.95 123.59 1jz4 s ARG 781 Ca 0.48 -1.37 -0.16 0.00 -0.52 0.00 0.00 55.73 54.15 1jz4 s ARG 781 Cb -0.07 -1.03 0.01 0.00 0.52 0.00 0.00 34.95 34.38 1jz4 s ARG 781 CO 0.31 0.19 1.18 -0.51 0.02 0.00 0.00 175.30 176.49 1jz4 s ASP 782 N -2.75 4.75 -0.04 0.23 1.11 -1.26 -1.12 116.67 117.58 1jz4 s ASP 782 Ca 0.14 2.27 -0.01 0.00 0.18 0.00 0.00 52.55 55.13 1jz4 s ASP 782 Cb -0.04 -2.58 0.03 0.00 1.07 0.00 0.00 42.92 41.41 1jz4 s ASP 782 CO 0.04 -1.89 0.08 -1.58 1.18 0.00 0.00 175.17 173.01 1jz4 s GLN 783 N -3.77 0.00 0.00 8.23 0.74 0.79 -4.75 119.66 120.90 1jz4 s GLN 783 Ca 0.73 0.30 0.00 0.00 0.05 0.00 0.00 55.36 56.44 1jz4 s GLN 783 Cb -0.27 -0.26 0.00 0.00 1.10 0.00 0.00 33.01 33.57 1jz4 s GLN 783 CO 0.40 -0.20 0.55 1.19 -0.55 0.00 0.00 175.29 176.68 1jz4 n PHE 784 N 4.43 0.00 -4.36 1.67 3.01 -1.26 -1.53 117.46 119.42 1jz4 n PHE 784 Ca -0.23 -0.05 -0.19 0.00 1.01 0.00 0.00 57.45 58.00 1jz4 n PHE 784 Cb 0.50 -0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.87 1jz4 n PHE 784 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1jz4 s THR 785 N -0.10 1.64 -0.01 4.37 -4.23 -1.26 -3.00 115.64 113.05 1jz4 s THR 785 Ca 0.00 -2.17 0.03 0.00 -1.18 0.00 0.00 61.69 58.36 1jz4 s THR 785 Cb 0.00 -2.14 -0.00 0.00 1.34 0.00 0.00 72.50 71.69 1jz4 s THR 785 CO 0.00 -0.52 -0.09 0.00 -0.54 0.00 0.00 174.62 173.47 1jz4 s ARG 786 N -3.68 0.78 -0.10 3.99 1.70 -1.26 -4.74 118.95 115.63 1jz4 s ARG 786 Ca 0.24 -0.31 -0.30 0.00 -0.47 0.00 0.00 55.73 54.89 1jz4 s ARG 786 Cb 0.01 -0.75 -0.07 0.00 -0.57 0.00 0.00 34.95 33.57 1jz4 s ARG 786 CO 0.08 0.17 2.10 0.00 -1.08 0.00 0.00 175.30 176.57 1jz4 n ALA 787 N 2.96 1.62 -1.58 7.88 0.00 -1.26 -4.80 120.51 125.33 1jz4 n ALA 787 Ca -0.15 -0.01 -0.58 0.00 0.00 0.00 0.00 53.44 52.71 1jz4 n ALA 787 Cb 0.56 -2.78 -0.07 0.00 0.00 0.00 0.00 19.45 17.16 1jz4 n ALA 787 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1jz4 n PRO 788 N 8.08 0.49 -1.75 0.00 -0.04 -1.26 -0.64 135.00 139.87 1jz4 n PRO 788 Ca 0.26 0.18 -0.30 0.00 -0.04 0.00 0.00 63.50 63.59 1jz4 n PRO 788 Cb 0.41 -1.74 0.05 0.00 -0.04 0.00 0.00 33.50 32.18 1jz4 n PRO 788 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1jz4 s LEU 789 N 0.80 2.97 0.40 1.53 1.43 -1.26 -4.58 118.68 119.97 1jz4 s LEU 789 Ca 0.91 1.34 0.12 0.00 -1.03 0.00 0.00 54.13 55.47 1jz4 s LEU 789 Cb -1.17 -4.18 0.94 0.00 0.03 0.00 0.00 46.19 41.80 1jz4 s LEU 789 CO 0.57 -1.37 1.92 0.44 0.23 0.00 0.00 176.35 178.14 1jz4 h ASP 790 N -0.67 0.50 0.60 2.29 3.32 -1.88 0.47 116.42 121.06 1jz4 h ASP 790 Ca -0.45 0.02 -0.03 0.00 0.02 0.00 0.00 57.03 56.59 1jz4 h ASP 790 Cb 1.23 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 40.70 1jz4 h ASP 790 CO 0.61 0.27 -0.14 0.78 -1.72 0.00 0.00 179.24 179.04 1jz4 h ASN 791 N 0.54 0.00 1.58 6.45 2.35 -1.84 -1.62 115.58 123.03 1jz4 h ASN 791 Ca 0.37 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 56.04 1jz4 h ASN 791 Cb 0.69 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.05 1jz4 h ASN 791 CO -0.13 0.14 -0.38 0.44 -1.65 0.00 0.00 177.43 175.85 1jz4 h ASP 792 N 0.00 0.00 0.25 5.81 3.32 -0.41 -3.31 116.42 122.09 1jz4 h ASP 792 Ca -0.00 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.71 1jz4 h ASP 792 Cb 0.48 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.04 1jz4 h ASP 792 CO 0.02 0.38 -1.68 0.40 -1.72 0.00 0.00 179.24 176.64 1jz4 h ILE 793 N 0.00 1.02 0.00 0.35 2.04 -0.72 0.15 117.51 120.34 1jz4 h ILE 793 Ca -0.00 -2.59 0.00 0.00 1.00 0.00 0.00 64.86 63.27 1jz4 h ILE 793 Cb 1.27 2.80 0.00 0.00 -0.74 0.00 0.00 36.82 40.15 1jz4 h ILE 793 CO 0.05 0.84 0.00 0.61 0.00 0.00 0.00 178.15 179.65 1jz4 n GLY 794 N 1.81 2.21 1.16 5.37 0.00 -0.66 -1.67 105.19 113.41 1jz4 n GLY 794 Ca -0.22 -0.50 0.12 0.00 0.00 0.00 0.00 46.02 45.41 1jz4 n GLY 794 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1jz4 n VAL 795 N 0.00 0.53 -1.51 1.61 0.24 -1.26 -4.79 118.33 113.15 1jz4 n VAL 795 Ca 0.00 -0.75 -0.56 0.00 -2.04 0.00 0.00 64.34 60.99 1jz4 n VAL 795 Cb 0.00 0.92 -0.08 0.00 -1.47 0.00 0.00 33.84 33.21 1jz4 n VAL 795 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1jz4 n SER 796 N 1.47 1.89 -4.71 -1.34 2.88 -0.67 -4.86 113.62 108.28 1jz4 n SER 796 Ca 0.20 0.73 -0.24 0.00 -1.33 0.00 0.00 58.87 58.23 1jz4 n SER 796 Cb 0.60 -1.13 -0.08 0.00 -0.75 0.00 0.00 64.21 62.86 1jz4 n SER 796 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1jz4 s GLU 797 N 5.11 2.21 0.32 -1.46 2.02 -0.10 -4.90 118.70 121.90 1jz4 s GLU 797 Ca 1.08 -1.78 0.24 0.00 0.02 0.00 0.00 54.97 54.52 1jz4 s GLU 797 Cb -1.10 -1.99 0.43 0.00 0.10 0.00 0.00 34.13 31.58 1jz4 s GLU 797 CO 0.60 -0.02 1.57 0.00 0.02 0.00 0.00 175.26 177.43 1jz4 h ALA 798 N 1.54 0.91 0.00 5.21 0.00 -1.96 -1.96 119.26 123.00 1jz4 h ALA 798 Ca -0.43 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.42 1jz4 h ALA 798 Cb 1.25 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1jz4 h ALA 798 CO 0.69 0.00 -0.62 1.79 0.00 0.00 0.00 179.25 181.11 1jz4 h THR 799 N 0.00 0.34 -2.56 0.00 1.35 -2.00 -3.43 112.91 106.61 1jz4 h THR 799 Ca 0.00 -1.39 -0.61 0.00 -0.55 0.00 0.00 66.41 63.86 1jz4 h THR 799 Cb 0.91 0.78 -0.42 0.00 -1.73 0.00 0.00 68.15 67.68 1jz4 h THR 799 CO 0.00 0.12 -0.59 0.54 -0.25 0.00 0.00 175.52 175.33 1jz4 n ARG 800 N -4.59 2.21 -0.23 4.72 1.74 -1.24 -5.10 116.66 114.17 1jz4 n ARG 800 Ca -0.13 -4.57 -0.03 0.00 -0.77 0.00 0.00 57.85 52.35 1jz4 n ARG 800 Cb 0.35 -2.25 0.03 0.00 -1.02 0.00 0.00 32.46 29.57 1jz4 n ARG 800 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1jz4 n ILE 801 N 1.32 0.00 -2.72 0.55 2.08 -0.74 -0.92 119.36 118.94 1jz4 n ILE 801 Ca 0.26 0.00 -0.07 0.00 0.56 0.00 0.00 62.75 63.50 1jz4 n ILE 801 Cb 0.39 -0.09 0.07 0.00 -0.75 0.00 0.00 39.64 39.26 1jz4 n ILE 801 CO 0.00 0.00 0.00 -0.67 0.56 0.00 0.00 176.55 176.44 1jz4 n ASP 802 N -0.13 -2.32 -0.14 4.38 2.03 -1.26 -4.34 116.55 114.77 1jz4 n ASP 802 Ca 0.01 -2.90 0.13 0.00 0.52 0.00 0.00 54.79 52.54 1jz4 n ASP 802 Cb 0.05 1.54 0.21 0.00 -0.72 0.00 0.00 41.12 42.20 1jz4 n ASP 802 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1jz4 n PRO 803 N 1.34 -0.01 0.13 -0.67 -0.04 -1.26 0.22 135.00 134.71 1jz4 n PRO 803 Ca 0.06 0.41 0.13 0.00 -0.04 0.00 0.00 63.50 64.05 1jz4 n PRO 803 Cb 0.67 -0.79 0.29 0.00 -0.04 0.00 0.00 33.50 33.63 1jz4 n PRO 803 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 1jz4 h ASN 804 N 0.00 0.00 -4.05 3.54 -0.00 -1.96 -3.34 115.58 109.77 1jz4 h ASN 804 Ca 0.28 -0.03 -0.51 0.00 -0.00 0.00 0.00 56.30 56.05 1jz4 h ASN 804 Cb 0.88 0.00 0.08 0.00 -0.00 0.00 0.00 38.32 39.28 1jz4 h ASN 804 CO -0.17 0.01 0.47 0.00 -0.00 0.00 0.00 177.43 177.74 1jz4 s ALA 805 N -3.15 2.79 0.20 1.57 0.00 0.61 -4.69 121.76 119.09 1jz4 s ALA 805 Ca 0.09 0.92 -0.11 0.00 0.00 0.00 0.00 51.96 52.86 1jz4 s ALA 805 Cb 0.10 -3.39 0.23 0.00 0.00 0.00 0.00 23.12 20.06 1jz4 s ALA 805 CO 0.64 -0.81 1.74 -1.49 0.00 0.00 0.00 175.76 175.84 1jz4 h TRP 806 N 1.50 0.33 -0.12 0.00 4.06 -1.86 0.22 115.95 120.07 1jz4 h TRP 806 Ca -0.50 0.03 -0.04 0.00 2.06 0.00 0.00 58.89 60.44 1jz4 h TRP 806 Cb 1.26 -0.06 -0.01 0.00 -1.00 0.00 0.00 29.16 29.35 1jz4 h TRP 806 CO 0.51 0.08 -0.13 -0.24 -3.56 0.00 0.00 178.44 175.11 1jz4 h VAL 807 N 0.36 1.16 -0.16 1.49 3.04 -1.03 0.21 116.25 121.32 1jz4 h VAL 807 Ca 0.28 -0.71 -0.11 0.00 -1.01 0.00 0.00 66.70 65.15 1jz4 h VAL 807 Cb 0.34 1.21 0.00 0.00 -2.01 0.00 0.00 31.29 30.83 1jz4 h VAL 807 CO -0.29 0.22 -0.32 -0.33 -1.01 0.00 0.00 177.57 175.84 1jz4 h GLU 808 N 0.18 0.50 -0.55 4.17 4.39 -1.53 -0.85 114.58 120.89 1jz4 h GLU 808 Ca 0.04 -0.32 0.01 0.00 0.34 0.00 0.00 59.36 59.43 1jz4 h GLU 808 Cb 0.34 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.00 1jz4 h GLU 808 CO 0.02 0.93 0.35 0.00 -1.16 0.00 0.00 179.01 179.15 1jz4 h ARG 809 N 0.13 0.70 -0.59 2.33 3.08 -0.25 -0.24 114.38 119.53 1jz4 h ARG 809 Ca 0.00 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 1jz4 h ARG 809 Cb 0.92 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.78 1jz4 h ARG 809 CO 0.07 0.46 0.20 -1.49 -1.07 0.00 0.00 179.97 178.14 1jz4 h TRP 810 N 0.72 0.95 -0.20 3.04 6.55 -0.82 -2.26 115.95 123.93 1jz4 h TRP 810 Ca 0.21 -0.09 -0.02 0.00 0.95 0.00 0.00 58.89 59.94 1jz4 h TRP 810 Cb -0.05 -0.28 -0.01 0.00 -0.86 0.00 0.00 29.16 27.97 1jz4 h TRP 810 CO -0.04 0.78 0.04 0.87 -1.05 0.00 0.00 178.44 179.03 1jz4 h LYS 811 N 0.84 0.33 -0.53 0.49 1.57 -0.72 -1.68 116.57 116.86 1jz4 h LYS 811 Ca 0.19 -0.08 0.09 0.00 -1.87 0.00 0.00 60.65 58.98 1jz4 h LYS 811 Cb 0.27 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.51 1jz4 h LYS 811 CO -0.01 0.47 0.36 0.00 -0.57 0.00 0.00 179.45 179.70 1jz4 h ALA 812 N 0.84 2.06 -0.00 3.86 0.00 -1.00 0.67 119.26 125.70 1jz4 h ALA 812 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1jz4 h ALA 812 Cb 0.30 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1jz4 h ALA 812 CO 0.00 -0.18 -0.15 0.00 0.00 0.00 0.00 179.25 178.92 1jz4 n ALA 813 N -2.53 2.71 -1.00 0.00 0.00 -0.86 -4.92 120.51 113.91 1jz4 n ALA 813 Ca 0.08 -0.18 -0.00 0.00 0.00 0.00 0.00 53.44 53.34 1jz4 n ALA 813 Cb 0.37 -1.36 -0.00 0.00 0.00 0.00 0.00 19.45 18.45 1jz4 n ALA 813 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jz4 n GLY 814 N 1.49 0.49 0.37 0.00 0.00 0.23 -4.83 105.19 102.94 1jz4 n GLY 814 Ca 0.07 -0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.17 1jz4 n GLY 814 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1jz4 h HIS 815 N 0.00 1.00 0.00 1.61 3.86 -1.54 0.70 115.15 120.79 1jz4 h HIS 815 Ca -0.00 0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 59.18 1jz4 h HIS 815 Cb 0.02 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 28.16 1jz4 h HIS 815 CO 0.01 0.43 -0.26 1.88 0.86 0.00 0.00 177.93 180.85 1jz4 h TYR 816 N 0.90 0.00 -0.46 2.45 -1.99 -1.86 -3.27 116.97 112.73 1jz4 h TYR 816 Ca 0.45 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.18 1jz4 h TYR 816 Cb 0.48 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.21 1jz4 h TYR 816 CO -0.00 0.26 0.00 1.04 -0.00 0.00 0.00 178.16 179.46 1jz4 n GLN 817 N -3.37 2.73 -1.96 4.88 6.02 0.12 -5.02 117.38 120.77 1jz4 n GLN 817 Ca 0.00 -2.22 -0.41 0.00 -0.01 0.00 0.00 57.00 54.36 1jz4 n GLN 817 Cb 0.47 -1.37 -0.01 0.00 1.02 0.00 0.00 30.24 30.35 1jz4 n GLN 817 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1jz4 s ALA 818 N -1.02 3.49 -0.02 -1.58 0.00 -0.50 -5.00 121.76 117.13 1jz4 s ALA 818 Ca 0.32 1.40 0.00 0.00 0.00 0.00 0.00 51.96 53.68 1jz4 s ALA 818 Cb 0.17 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.71 1jz4 s ALA 818 CO 0.22 -0.86 0.01 -1.21 0.00 0.00 0.00 175.76 173.92 1jz4 s GLU 819 N -2.00 2.87 -0.90 0.00 0.41 -1.23 -4.89 118.70 112.96 1jz4 s GLU 819 Ca 0.52 -0.55 -0.20 0.00 -0.41 0.00 0.00 54.97 54.33 1jz4 s GLU 819 Cb -0.43 -2.73 0.11 0.00 -1.78 0.00 0.00 34.13 29.31 1jz4 s GLU 819 CO 0.57 0.64 1.14 0.00 -0.49 0.00 0.00 175.26 177.12 1jz4 s ALA 820 N -1.06 3.25 0.11 5.21 0.00 -1.26 -2.94 121.76 125.06 1jz4 s ALA 820 Ca 0.19 -2.56 -0.31 0.00 0.00 0.00 0.00 51.96 49.28 1jz4 s ALA 820 Cb -0.12 -4.07 -0.08 0.00 0.00 0.00 0.00 23.12 18.85 1jz4 s ALA 820 CO 0.09 -3.02 1.38 0.00 0.00 0.00 0.00 175.76 174.21 1jz4 s ALA 821 N 3.18 3.58 -0.07 0.00 0.00 0.03 -4.82 121.76 123.65 1jz4 s ALA 821 Ca 0.33 1.10 -0.30 0.00 0.00 0.00 0.00 51.96 53.09 1jz4 s ALA 821 Cb -0.06 -3.54 -0.02 0.00 0.00 0.00 0.00 23.12 19.50 1jz4 s ALA 821 CO -0.06 -0.62 1.09 -1.17 0.00 0.00 0.00 175.76 175.00 1jz4 s LEU 822 N 1.14 4.27 -0.07 0.00 2.96 -1.26 -0.94 118.68 124.78 1jz4 s LEU 822 Ca 0.64 1.67 0.17 0.00 -0.22 0.00 0.00 54.13 56.39 1jz4 s LEU 822 Cb -0.36 -3.56 -0.25 0.00 0.50 0.00 0.00 46.19 42.51 1jz4 s LEU 822 CO 0.30 -0.50 0.28 0.18 -1.32 0.00 0.00 176.35 175.30 1jz4 n LEU 823 N 5.01 0.00 -3.63 -0.68 4.77 0.52 -4.93 117.00 118.05 1jz4 n LEU 823 Ca 0.10 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.99 1jz4 n LEU 823 Cb 0.48 0.13 -0.07 0.00 -2.33 0.00 0.00 43.42 41.63 1jz4 n LEU 823 CO 0.53 0.13 0.82 -1.58 -1.33 0.00 0.00 177.39 175.97 1jz4 s GLN 824 N -2.97 0.43 -0.22 3.23 0.74 -0.03 -4.87 119.66 115.96 1jz4 s GLN 824 Ca -0.07 0.45 -0.03 0.00 0.05 0.00 0.00 55.36 55.76 1jz4 s GLN 824 Cb 0.09 0.21 0.11 0.00 1.10 0.00 0.00 33.01 34.52 1jz4 s GLN 824 CO 0.72 -0.06 0.28 0.00 -0.55 0.00 0.00 175.29 175.68 1jz4 s THR 826 N 2.41 1.03 -0.08 0.00 -4.23 0.31 -4.95 115.64 110.14 1jz4 s THR 826 Ca 0.09 -2.03 0.02 0.00 -1.18 0.00 0.00 61.69 58.59 1jz4 s THR 826 Cb -0.15 -1.95 0.01 0.00 1.34 0.00 0.00 72.50 71.74 1jz4 s THR 826 CO -0.15 -0.65 -0.13 0.00 -0.54 0.00 0.00 174.62 173.15 1jz4 s ALA 827 N -3.42 1.38 -0.00 3.99 0.00 -1.26 0.70 121.76 123.15 1jz4 s ALA 827 Ca 0.19 -0.50 0.03 0.00 0.00 0.00 0.00 51.96 51.68 1jz4 s ALA 827 Cb 0.04 -0.63 -0.01 0.00 0.00 0.00 0.00 23.12 22.52 1jz4 s ALA 827 CO 0.02 0.08 -0.09 -0.51 0.00 0.00 0.00 175.76 175.25 1jz4 s ASP 828 N 0.73 1.11 -0.20 0.00 1.01 0.19 -4.97 116.67 114.54 1jz4 s ASP 828 Ca -0.13 -0.19 -0.17 0.00 0.71 0.00 0.00 52.55 52.77 1jz4 s ASP 828 Cb -0.16 -0.12 -0.04 0.00 1.01 0.00 0.00 42.92 43.62 1jz4 s ASP 828 CO 0.03 0.11 0.45 -0.89 0.21 0.00 0.00 175.17 175.08 1jz4 s THR 829 N -0.26 5.16 0.45 -1.27 2.01 -1.26 -0.27 115.64 120.19 1jz4 s THR 829 Ca 0.03 0.83 0.07 0.00 0.31 0.00 0.00 61.69 62.93 1jz4 s THR 829 Cb -0.04 -3.78 -0.02 0.00 0.01 0.00 0.00 72.50 68.67 1jz4 s THR 829 CO -0.00 0.22 0.29 -0.76 -0.69 0.00 0.00 174.62 173.68 1jz4 s LEU 830 N 1.42 3.08 0.20 4.42 1.43 0.62 -4.99 118.68 124.87 1jz4 s LEU 830 Ca 0.22 -1.04 -0.10 0.00 -1.03 0.00 0.00 54.13 52.18 1jz4 s LEU 830 Cb -0.15 -1.54 0.27 0.00 0.03 0.00 0.00 46.19 44.80 1jz4 s LEU 830 CO 0.09 -0.72 1.73 0.00 0.23 0.00 0.00 176.35 177.68 1jz4 h ALA 831 N 1.14 0.72 0.00 4.21 0.00 -2.02 -3.17 119.26 120.16 1jz4 h ALA 831 Ca -0.41 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1jz4 h ALA 831 Cb 1.27 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.16 1jz4 h ALA 831 CO 0.63 -0.25 0.00 -0.40 0.00 0.00 0.00 179.25 179.24 1jz4 n ASP 832 N -5.05 1.43 -2.93 0.00 5.75 -1.26 -4.96 116.55 109.53 1jz4 n ASP 832 Ca 0.08 -1.66 -0.10 0.00 -0.01 0.00 0.00 54.79 53.10 1jz4 n ASP 832 Cb 0.28 0.00 0.02 0.00 -1.03 0.00 0.00 41.12 40.39 1jz4 n ASP 832 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1jz4 s ALA 833 N -0.66 -0.50 -0.07 2.12 0.00 -1.20 -1.68 121.76 119.77 1jz4 s ALA 833 Ca 0.00 -0.88 0.04 0.00 0.00 0.00 0.00 51.96 51.11 1jz4 s ALA 833 Cb 0.00 0.74 0.00 0.00 0.00 0.00 0.00 23.12 23.86 1jz4 s ALA 833 CO 0.00 -0.96 -0.19 0.08 0.00 0.00 0.00 175.76 174.69 1jz4 s VAL 834 N -2.35 1.65 -0.21 0.00 1.01 -0.76 0.23 120.40 119.96 1jz4 s VAL 834 Ca 0.18 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.38 1jz4 s VAL 834 Cb -0.04 -1.44 0.04 0.00 0.00 0.00 0.00 36.38 34.94 1jz4 s VAL 834 CO 0.13 0.47 -0.13 -0.22 0.00 0.00 0.00 175.10 175.35 1jz4 s LEU 835 N 0.34 2.61 -0.22 3.92 2.96 0.62 -0.65 118.68 128.27 1jz4 s LEU 835 Ca -0.13 -0.99 -0.09 0.00 -0.22 0.00 0.00 54.13 52.70 1jz4 s LEU 835 Cb -0.16 -1.40 -0.04 0.00 0.50 0.00 0.00 46.19 45.09 1jz4 s LEU 835 CO 0.06 -0.12 0.11 -0.63 -1.32 0.00 0.00 176.35 174.44 1jz4 s ILE 836 N 1.28 5.02 -0.10 6.68 -1.09 -0.46 0.52 121.20 133.05 1jz4 s ILE 836 Ca -0.02 0.06 0.03 0.00 -2.23 0.00 0.00 60.65 58.49 1jz4 s ILE 836 Cb -0.17 -3.31 -0.01 0.00 -1.58 0.00 0.00 42.46 37.40 1jz4 s ILE 836 CO -0.08 0.39 -0.21 -0.89 -1.23 0.00 0.00 174.94 172.92 1jz4 s THR 837 N 0.82 2.37 0.11 2.92 2.01 0.22 -0.60 115.64 123.49 1jz4 s THR 837 Ca 0.06 -0.92 0.05 0.00 0.31 0.00 0.00 61.69 61.18 1jz4 s THR 837 Cb -0.13 -1.92 -0.04 0.00 0.01 0.00 0.00 72.50 70.42 1jz4 s THR 837 CO 0.02 0.55 -0.12 0.42 -0.69 0.00 0.00 174.62 174.81 1jz4 s THR 838 N 0.19 1.12 -0.11 -0.82 -4.23 -0.20 0.12 115.64 111.71 1jz4 s THR 838 Ca -0.12 -1.73 -0.05 0.00 -1.18 0.00 0.00 61.69 58.60 1jz4 s THR 838 Cb -0.16 -1.49 0.05 0.00 1.34 0.00 0.00 72.50 72.23 1jz4 s THR 838 CO 0.07 -0.53 0.26 0.00 -0.54 0.00 0.00 174.62 173.87 1jz4 s ALA 839 N -2.45 -0.59 0.04 3.99 0.00 0.52 -0.31 121.76 122.96 1jz4 s ALA 839 Ca 0.08 1.02 0.03 0.00 0.00 0.00 0.00 51.96 53.10 1jz4 s ALA 839 Cb -0.03 -0.70 -0.02 0.00 0.00 0.00 0.00 23.12 22.37 1jz4 s ALA 839 CO 0.01 -0.26 -0.10 -1.01 0.00 0.00 0.00 175.76 174.40 1jz4 s HIS 840 N 1.41 0.90 -0.10 0.00 3.76 0.22 0.19 115.29 121.69 1jz4 s HIS 840 Ca -0.08 -0.39 0.04 0.00 -0.15 0.00 0.00 55.06 54.48 1jz4 s HIS 840 Cb -0.10 -0.53 -0.00 0.00 1.11 0.00 0.00 32.58 33.05 1jz4 s HIS 840 CO -0.09 -0.01 -0.24 0.00 -0.85 0.00 0.00 174.74 173.55 1jz4 s ALA 841 N -1.03 2.18 -0.26 -1.40 0.00 -0.12 -0.33 121.76 120.82 1jz4 s ALA 841 Ca -0.03 -0.97 -0.10 0.00 0.00 0.00 0.00 51.96 50.85 1jz4 s ALA 841 Cb -0.08 -0.81 -0.04 0.00 0.00 0.00 0.00 23.12 22.19 1jz4 s ALA 841 CO 0.01 0.30 0.14 -1.58 0.00 0.00 0.00 175.76 174.63 1jz4 s TRP 842 N 0.29 3.20 0.11 0.00 0.51 0.20 -0.79 118.94 122.46 1jz4 s TRP 842 Ca -0.17 -0.01 0.06 0.00 -2.12 0.00 0.00 56.10 53.85 1jz4 s TRP 842 Cb -0.18 -2.30 -0.04 0.00 -0.81 0.00 0.00 33.47 30.15 1jz4 s TRP 842 CO 0.08 -0.15 -0.14 -0.65 -0.51 0.00 0.00 176.95 175.58 1jz4 s GLN 843 N 1.49 0.99 -0.12 4.98 -0.21 -1.15 0.22 119.66 125.84 1jz4 s GLN 843 Ca 0.07 -1.18 -0.00 0.00 0.02 0.00 0.00 55.36 54.26 1jz4 s GLN 843 Cb -0.15 -0.90 0.03 0.00 1.00 0.00 0.00 33.01 32.98 1jz4 s GLN 843 CO 0.07 0.18 -0.08 -1.58 -2.12 0.00 0.00 175.29 171.76 1jz4 s HIS 844 N -1.94 1.57 -1.44 0.91 2.46 0.35 -3.57 115.29 113.63 1jz4 s HIS 844 Ca 0.07 -0.82 -0.02 0.00 0.47 0.00 0.00 55.06 54.76 1jz4 s HIS 844 Cb -0.06 -1.28 0.00 0.00 -0.13 0.00 0.00 32.58 31.12 1jz4 s HIS 844 CO 0.03 -0.54 0.29 1.04 -2.47 0.00 0.00 174.74 173.09 1jz4 n GLN 845 N 4.92 -2.23 -0.57 2.88 1.13 -1.26 0.13 117.38 122.37 1jz4 n GLN 845 Ca -0.13 0.28 0.00 0.00 -1.94 0.00 0.00 57.00 55.21 1jz4 n GLN 845 Cb 0.50 -4.08 0.00 0.00 0.11 0.00 0.00 30.24 26.76 1jz4 n GLN 845 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1jz4 n GLY 846 N -2.19 1.64 3.73 1.08 0.00 -1.26 -4.98 105.19 103.20 1jz4 n GLY 846 Ca -0.30 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 1jz4 n GLY 846 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1jz4 s LYS 847 N -0.05 4.09 -0.35 1.61 2.47 0.34 -5.03 119.74 122.81 1jz4 s LYS 847 Ca 0.00 -0.23 -0.25 0.00 -1.56 0.00 0.00 55.97 53.92 1jz4 s LYS 847 Cb 0.00 -3.37 0.01 0.00 -1.46 0.00 0.00 37.83 33.02 1jz4 s LYS 847 CO 0.00 0.34 0.90 0.99 0.16 0.00 0.00 175.35 177.74 1jz4 s THR 848 N 0.25 4.63 -0.17 3.43 2.01 -1.26 0.13 115.64 124.65 1jz4 s THR 848 Ca 0.08 1.22 -0.23 0.00 0.31 0.00 0.00 61.69 63.06 1jz4 s THR 848 Cb -0.11 -4.30 -0.21 0.00 0.01 0.00 0.00 72.50 67.89 1jz4 s THR 848 CO -0.01 -0.47 0.45 -0.07 -0.69 0.00 0.00 174.62 173.82 1jz4 h LEU 849 N 9.93 0.00 -8.37 4.42 3.38 0.22 -3.42 115.31 121.48 1jz4 h LEU 849 Ca -0.23 -0.69 -0.41 0.00 0.09 0.00 0.00 57.88 56.64 1jz4 h LEU 849 Cb 1.08 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.61 1jz4 h LEU 849 CO 0.96 1.17 -0.78 -0.36 0.09 0.00 0.00 178.44 179.52 1jz4 s PHE 850 N -2.24 1.17 -0.07 1.13 0.40 -1.12 -0.94 117.98 116.31 1jz4 s PHE 850 Ca -0.22 -0.43 0.02 0.00 -0.60 0.00 0.00 56.93 55.70 1jz4 s PHE 850 Cb 0.01 -0.67 0.02 0.00 0.51 0.00 0.00 43.02 42.88 1jz4 s PHE 850 CO 0.59 0.04 -0.11 0.42 0.70 0.00 0.00 175.22 176.86 1jz4 s ILE 851 N -1.15 1.07 -0.10 0.64 1.01 0.31 0.59 121.20 123.57 1jz4 s ILE 851 Ca -0.01 -0.42 0.03 0.00 0.00 0.00 0.00 60.65 60.25 1jz4 s ILE 851 Cb -0.09 -1.01 -0.00 0.00 0.01 0.00 0.00 42.46 41.37 1jz4 s ILE 851 CO 0.02 0.35 -0.22 -0.55 0.00 0.00 0.00 174.94 174.53 1jz4 s SER 852 N 0.89 3.23 -0.18 3.58 0.15 0.55 -0.22 113.70 121.70 1jz4 s SER 852 Ca -0.10 -0.53 0.00 0.00 0.70 0.00 0.00 55.95 56.02 1jz4 s SER 852 Cb -0.15 -1.44 0.01 0.00 -1.71 0.00 0.00 66.02 62.73 1jz4 s SER 852 CO 0.01 0.16 -0.16 -0.13 1.20 0.00 0.00 173.24 174.32 1jz4 s ARG 853 N 0.34 3.09 0.24 5.44 0.52 -0.36 -0.61 118.95 127.62 1jz4 s ARG 853 Ca -0.18 -0.78 0.02 0.00 -0.52 0.00 0.00 55.73 54.27 1jz4 s ARG 853 Cb -0.18 -2.66 -0.05 0.00 0.52 0.00 0.00 34.95 32.58 1jz4 s ARG 853 CO 0.08 -0.18 0.04 0.15 0.02 0.00 0.00 175.30 175.42 1jz4 s LYS 854 N 1.27 1.37 -0.14 3.54 1.02 0.57 -1.13 119.74 126.24 1jz4 s LYS 854 Ca 0.04 -1.72 -0.13 0.00 0.02 0.00 0.00 55.97 54.18 1jz4 s LYS 854 Cb -0.14 -0.45 0.04 0.00 -0.52 0.00 0.00 37.83 36.76 1jz4 s LYS 854 CO -0.09 -0.19 0.37 0.95 -0.92 0.00 0.00 175.35 175.47 1jz4 s THR 855 N -3.57 0.00 -0.17 2.17 -4.23 -1.00 -1.03 115.64 107.81 1jz4 s THR 855 Ca 0.32 -0.01 0.01 0.00 -1.18 0.00 0.00 61.69 60.83 1jz4 s THR 855 Cb 0.07 -0.53 0.02 0.00 1.34 0.00 0.00 72.50 73.41 1jz4 s THR 855 CO 0.11 -0.00 -0.16 -0.31 -0.54 0.00 0.00 174.62 173.71 1jz4 s TYR 856 N 0.17 2.44 -0.25 3.99 1.51 0.23 0.89 117.35 126.33 1jz4 s TYR 856 Ca -0.00 -1.43 -0.01 0.00 -1.01 0.00 0.00 57.07 54.62 1jz4 s TYR 856 Cb -0.03 -1.73 0.03 0.00 -0.11 0.00 0.00 41.96 40.13 1jz4 s TYR 856 CO 0.01 -0.73 -0.07 0.50 -1.11 0.00 0.00 175.55 174.15 1jz4 s ARG 857 N 1.40 2.70 -0.24 -0.62 3.52 0.58 -1.35 118.95 124.94 1jz4 s ARG 857 Ca 0.04 -1.07 -0.10 0.00 -0.13 0.00 0.00 55.73 54.48 1jz4 s ARG 857 Cb -0.13 -2.98 -0.05 0.00 -1.56 0.00 0.00 34.95 30.23 1jz4 s ARG 857 CO -0.11 -0.45 0.14 0.42 -0.81 0.00 0.00 175.30 174.49 1jz4 s ILE 858 N 1.28 5.20 0.35 4.11 1.01 0.18 -1.18 121.20 132.15 1jz4 s ILE 858 Ca -0.02 0.12 0.03 0.00 0.00 0.00 0.00 60.65 60.78 1jz4 s ILE 858 Cb -0.17 -3.42 0.03 0.00 0.01 0.00 0.00 42.46 38.90 1jz4 s ILE 858 CO -0.04 0.35 0.22 -0.90 0.00 0.00 0.00 174.94 174.56 1jz4 n ASP 859 N 4.34 2.27 0.00 3.58 5.68 -0.95 -1.83 116.55 129.65 1jz4 n ASP 859 Ca -0.15 -2.27 0.06 0.00 -0.50 0.00 0.00 54.79 51.93 1jz4 n ASP 859 Cb 0.52 0.02 0.34 0.00 -1.14 0.00 0.00 41.12 40.86 1jz4 n ASP 859 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1jz4 n GLY 860 N 0.76 -0.62 0.45 6.12 0.00 -0.68 -0.97 105.19 110.25 1jz4 n GLY 860 Ca -0.03 -0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.03 1jz4 n GLY 860 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1jz4 n SER 861 N -1.20 1.80 0.00 1.61 3.41 -1.26 -4.31 113.62 113.67 1jz4 n SER 861 Ca 0.07 -1.38 0.00 0.00 -0.26 0.00 0.00 58.87 57.31 1jz4 n SER 861 Cb 0.08 0.36 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 1jz4 n SER 861 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1jz4 n GLY 862 N 1.39 0.79 3.77 5.00 0.00 -0.15 -5.03 105.19 110.97 1jz4 n GLY 862 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 1jz4 n GLY 862 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1jz4 s GLN 863 N -0.34 4.41 -0.40 1.61 -0.21 -1.26 -4.73 119.66 118.73 1jz4 s GLN 863 Ca 0.00 0.94 -0.04 0.00 0.02 0.00 0.00 55.36 56.28 1jz4 s GLN 863 Cb 0.00 -3.30 0.10 0.00 1.00 0.00 0.00 33.01 30.81 1jz4 s GLN 863 CO 0.00 0.47 0.20 1.41 -2.12 0.00 0.00 175.29 175.25 1jz4 s MET 864 N -0.65 2.15 -0.25 2.91 -2.45 0.36 -2.23 119.30 119.14 1jz4 s MET 864 Ca 0.34 -1.71 -0.23 0.00 -1.25 0.00 0.00 55.69 52.84 1jz4 s MET 864 Cb -0.20 -3.58 -0.01 0.00 1.25 0.00 0.00 34.83 32.28 1jz4 s MET 864 CO 0.22 -1.02 0.76 0.00 1.05 0.00 0.00 175.02 176.03 1jz4 s ALA 865 N 1.20 3.64 -0.15 4.11 0.00 -0.33 -1.63 121.76 128.60 1jz4 s ALA 865 Ca 0.06 -0.24 -0.05 0.00 0.00 0.00 0.00 51.96 51.73 1jz4 s ALA 865 Cb -0.23 -3.20 -0.03 0.00 0.00 0.00 0.00 23.12 19.66 1jz4 s ALA 865 CO -0.03 -0.89 0.02 0.42 0.00 0.00 0.00 175.76 175.28 1jz4 s ILE 866 N 2.72 4.43 -0.13 0.00 1.01 0.57 -0.30 121.20 129.50 1jz4 s ILE 866 Ca 0.32 -0.18 0.01 0.00 0.00 0.00 0.00 60.65 60.80 1jz4 s ILE 866 Cb -0.15 -2.94 -0.01 0.00 0.01 0.00 0.00 42.46 39.37 1jz4 s ILE 866 CO 0.08 0.52 -0.16 -0.89 0.00 0.00 0.00 174.94 174.48 1jz4 s THR 867 N -0.03 2.69 -0.03 2.92 2.01 0.26 -1.12 115.64 122.34 1jz4 s THR 867 Ca 0.04 -0.78 0.03 0.00 0.31 0.00 0.00 61.69 61.30 1jz4 s THR 867 Cb -0.13 -2.11 -0.00 0.00 0.01 0.00 0.00 72.50 70.27 1jz4 s THR 867 CO 0.02 0.53 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.66 1jz4 s VAL 868 N 0.53 1.07 -0.17 3.82 1.01 0.29 -2.37 120.40 124.58 1jz4 s VAL 868 Ca -0.10 -0.53 -0.01 0.00 0.00 0.00 0.00 61.98 61.33 1jz4 s VAL 868 Cb -0.16 -0.93 0.05 0.00 0.00 0.00 0.00 36.38 35.34 1jz4 s VAL 868 CO 0.04 0.32 -0.03 -1.81 0.00 0.00 0.00 175.10 173.61 1jz4 s ASP 869 N 0.02 2.90 0.01 3.32 1.01 -0.28 -1.39 116.67 122.26 1jz4 s ASP 869 Ca -0.01 -0.72 0.03 0.00 0.71 0.00 0.00 52.55 52.55 1jz4 s ASP 869 Cb -0.09 -0.86 -0.03 0.00 1.01 0.00 0.00 42.92 42.94 1jz4 s ASP 869 CO 0.01 -0.21 -0.05 -0.69 0.21 0.00 0.00 175.17 174.44 1jz4 s VAL 870 N 1.66 3.78 -0.15 -1.27 1.01 0.70 -1.22 120.40 124.91 1jz4 s VAL 870 Ca -0.00 -0.74 0.01 0.00 0.00 0.00 0.00 61.98 61.25 1jz4 s VAL 870 Cb -0.16 -2.66 0.00 0.00 0.00 0.00 0.00 36.38 33.56 1jz4 s VAL 870 CO -0.07 0.38 -0.18 -0.70 0.00 0.00 0.00 175.10 174.53 1jz4 s GLU 871 N -1.48 3.15 -0.14 2.72 2.12 0.69 -0.50 118.70 125.26 1jz4 s GLU 871 Ca 0.18 -0.79 0.03 0.00 0.36 0.00 0.00 54.97 54.75 1jz4 s GLU 871 Cb -0.11 -2.55 0.01 0.00 0.26 0.00 0.00 34.13 31.73 1jz4 s GLU 871 CO 0.08 0.01 -0.22 0.08 -0.54 0.00 0.00 175.26 174.68 1jz4 s VAL 872 N 0.80 2.05 0.02 3.70 1.01 0.41 -0.53 120.40 127.86 1jz4 s VAL 872 Ca -0.06 -0.98 -0.36 0.00 0.00 0.00 0.00 61.98 60.58 1jz4 s VAL 872 Cb -0.15 -1.81 -0.15 0.00 0.00 0.00 0.00 36.38 34.27 1jz4 s VAL 872 CO -0.00 0.55 1.52 0.00 0.00 0.00 0.00 175.10 177.16 1jz4 n ALA 873 N 4.02 -0.13 -0.11 5.51 0.00 -0.12 -4.67 120.51 125.02 1jz4 n ALA 873 Ca -0.20 0.46 0.04 0.00 0.00 0.00 0.00 53.44 53.74 1jz4 n ALA 873 Cb 0.52 -2.20 0.36 0.00 0.00 0.00 0.00 19.45 18.12 1jz4 n ALA 873 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1jz4 h SER 874 N 5.77 0.63 0.30 0.00 4.64 -1.94 -2.50 113.55 120.44 1jz4 h SER 874 Ca -0.47 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1jz4 h SER 874 Cb 1.31 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1jz4 h SER 874 CO 0.85 0.44 -0.06 -0.90 -0.87 0.00 0.00 176.83 176.29 1jz4 n ASP 875 N -4.46 0.37 -4.86 4.97 5.75 -1.26 -4.82 116.55 112.25 1jz4 n ASP 875 Ca 0.07 -0.65 -0.34 0.00 -0.01 0.00 0.00 54.79 53.85 1jz4 n ASP 875 Cb 0.10 -0.09 -0.06 0.00 -1.03 0.00 0.00 41.12 40.04 1jz4 n ASP 875 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 1jz4 s THR 876 N -2.36 4.89 0.18 2.12 -1.32 -0.94 -5.02 115.64 113.19 1jz4 s THR 876 Ca 0.33 0.68 -0.32 0.00 -1.21 0.00 0.00 61.69 61.17 1jz4 s THR 876 Cb 0.21 -3.68 -0.15 0.00 -1.51 0.00 0.00 72.50 67.36 1jz4 s THR 876 CO 0.44 0.11 1.18 -2.65 -2.21 0.00 0.00 174.62 171.49 1jz4 n PRO 877 N 0.41 1.26 -1.61 7.08 -0.02 -1.26 -4.82 135.00 136.04 1jz4 n PRO 877 Ca -0.03 0.45 -0.49 0.00 -2.02 0.00 0.00 63.50 61.41 1jz4 n PRO 877 Cb 0.52 -1.96 -0.04 0.00 -0.02 0.00 0.00 33.50 32.00 1jz4 n PRO 877 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1jz4 n HIS 878 N 1.48 1.67 -2.19 6.00 8.25 -1.26 -4.90 115.22 124.27 1jz4 n HIS 878 Ca 0.14 0.56 -0.33 0.00 -0.26 0.00 0.00 57.72 57.84 1jz4 n HIS 878 Cb 0.26 -2.37 -0.01 0.00 1.12 0.00 0.00 29.99 28.99 1jz4 n HIS 878 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1jz4 s PRO 879 N 0.06 3.55 0.36 -0.41 0.04 -1.26 -4.86 135.00 132.47 1jz4 s PRO 879 Ca 0.76 1.14 0.03 0.00 0.04 0.00 0.00 61.00 62.97 1jz4 s PRO 879 Cb -0.82 -2.07 0.68 0.00 0.04 0.00 0.00 34.50 32.33 1jz4 s PRO 879 CO 0.48 -0.62 2.01 0.00 0.04 0.00 0.00 177.00 178.91 1jz4 h ALA 880 N 0.66 1.56 -2.95 8.56 0.00 -1.88 -3.40 119.26 121.81 1jz4 h ALA 880 Ca -0.47 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.42 1jz4 h ALA 880 Cb 1.21 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.70 1jz4 h ALA 880 CO 0.59 0.39 0.13 -0.98 0.00 0.00 0.00 179.25 179.38 1jz4 s ARG 881 N -5.63 1.69 -0.35 0.00 1.70 -1.21 -0.73 118.95 114.43 1jz4 s ARG 881 Ca -0.10 -1.05 -0.00 0.00 -0.47 0.00 0.00 55.73 54.12 1jz4 s ARG 881 Cb 0.17 0.57 0.13 0.00 -0.57 0.00 0.00 34.95 35.25 1jz4 s ARG 881 CO 0.76 -0.76 0.19 0.42 -1.08 0.00 0.00 175.30 174.83 1jz4 s ILE 882 N -3.94 0.46 0.00 4.99 1.01 -0.09 -4.11 121.20 119.51 1jz4 s ILE 882 Ca 0.14 -1.67 0.00 0.00 0.00 0.00 0.00 60.65 59.12 1jz4 s ILE 882 Cb -0.04 -1.34 0.00 0.00 0.01 0.00 0.00 42.46 41.09 1jz4 s ILE 882 CO 0.07 -0.88 0.00 0.61 0.00 0.00 0.00 174.94 174.74 1jz4 n GLY 883 N 4.27 2.86 3.41 6.18 0.00 -0.58 -0.58 105.19 120.75 1jz4 n GLY 883 Ca 0.06 -0.77 -0.22 0.00 0.00 0.00 0.00 46.02 45.08 1jz4 n GLY 883 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jz4 s LEU 884 N 0.00 2.54 0.07 0.99 1.43 0.12 -0.15 118.68 123.68 1jz4 s LEU 884 Ca 0.00 -0.98 -0.12 0.00 -1.03 0.00 0.00 54.13 52.00 1jz4 s LEU 884 Cb 0.00 -0.95 0.01 0.00 0.03 0.00 0.00 46.19 45.29 1jz4 s LEU 884 CO 0.00 -0.02 0.27 0.54 0.23 0.00 0.00 176.35 177.37 1jz4 s ASN 885 N -3.21 -0.05 -0.08 2.29 4.22 -0.28 0.36 114.94 118.20 1jz4 s ASN 885 Ca 0.24 -0.38 -0.32 0.00 -2.14 0.00 0.00 52.86 50.27 1jz4 s ASN 885 Cb -0.04 0.36 0.12 0.00 1.28 0.00 0.00 41.25 42.97 1jz4 s ASN 885 CO 0.11 -0.69 1.11 0.00 -2.04 0.00 0.00 177.10 175.59 1jz4 s GLN 887 N -2.70 2.68 0.31 0.00 0.74 -1.18 -1.74 119.66 117.77 1jz4 s GLN 887 Ca 0.09 -1.13 -0.28 0.00 0.05 0.00 0.00 55.36 54.10 1jz4 s GLN 887 Cb -0.00 -3.38 -0.09 0.00 1.10 0.00 0.00 33.01 30.64 1jz4 s GLN 887 CO -0.05 -0.61 1.01 -0.51 -0.55 0.00 0.00 175.29 174.58 1jz4 s LEU 888 N 1.39 4.44 0.31 3.68 1.43 0.81 0.45 118.68 131.19 1jz4 s LEU 888 Ca -0.01 2.03 0.00 0.00 -1.03 0.00 0.00 54.13 55.12 1jz4 s LEU 888 Cb -0.19 -3.84 0.49 0.00 0.03 0.00 0.00 46.19 42.68 1jz4 s LEU 888 CO 0.02 -0.12 1.88 0.00 0.23 0.00 0.00 176.35 178.36 1jz4 h ALA 889 N 3.46 1.33 -2.86 4.21 0.00 -0.14 0.08 119.26 125.34 1jz4 h ALA 889 Ca -0.47 -0.16 -0.54 0.00 0.00 0.00 0.00 54.91 53.75 1jz4 h ALA 889 Cb 1.20 -0.22 0.10 0.00 0.00 0.00 0.00 17.79 18.87 1jz4 h ALA 889 CO 0.66 0.50 0.80 0.94 0.00 0.00 0.00 179.25 182.14 1jz4 n GLN 890 N -4.32 2.66 -3.77 0.00 -0.06 -1.26 -4.21 117.38 106.42 1jz4 n GLN 890 Ca 0.04 0.94 -0.29 0.00 -2.00 0.00 0.00 57.00 55.69 1jz4 n GLN 890 Cb 0.17 -2.68 -0.15 0.00 -4.06 0.00 0.00 30.24 23.52 1jz4 n GLN 890 CO 0.00 0.00 0.00 0.08 -0.20 0.00 0.00 177.06 176.94 1jz4 s VAL 891 N -0.74 0.90 0.27 1.69 1.01 -1.26 -3.30 120.40 118.97 1jz4 s VAL 891 Ca 0.57 -1.17 0.08 0.00 0.00 0.00 0.00 61.98 61.46 1jz4 s VAL 891 Cb -0.49 -1.54 -0.04 0.00 0.00 0.00 0.00 36.38 34.32 1jz4 s VAL 891 CO 0.59 -0.47 0.14 0.00 0.00 0.00 0.00 175.10 175.36 1jz4 s ALA 892 N 1.64 3.48 0.06 5.51 0.00 -1.26 -5.05 121.76 126.15 1jz4 s ALA 892 Ca 0.05 -1.55 -0.15 0.00 0.00 0.00 0.00 51.96 50.31 1jz4 s ALA 892 Cb -0.17 -1.08 -0.22 0.00 0.00 0.00 0.00 23.12 21.65 1jz4 s ALA 892 CO -0.18 0.21 1.19 1.49 0.00 0.00 0.00 175.76 178.48 1jz4 h GLU 893 N 1.58 0.66 -6.04 0.00 4.57 -2.00 -3.43 114.58 109.92 1jz4 h GLU 893 Ca -0.46 -0.67 -0.55 0.00 -1.18 0.00 0.00 59.36 56.50 1jz4 h GLU 893 Cb 1.24 0.18 -0.07 0.00 -0.16 0.00 0.00 28.75 29.94 1jz4 h GLU 893 CO 0.61 1.26 -0.51 1.03 -1.18 0.00 0.00 179.01 180.22 1jz4 s ARG 894 N -3.39 2.34 -0.07 1.92 1.81 -1.26 -0.80 118.95 119.49 1jz4 s ARG 894 Ca -0.11 -1.64 -0.01 0.00 -1.72 0.00 0.00 55.73 52.25 1jz4 s ARG 894 Cb 0.06 -2.13 0.03 0.00 -0.45 0.00 0.00 34.95 32.46 1jz4 s ARG 894 CO 0.90 0.01 -0.01 0.08 -0.68 0.00 0.00 175.30 175.60 1jz4 s VAL 895 N -2.48 0.45 -0.09 3.52 1.01 0.63 -4.60 120.40 118.83 1jz4 s VAL 895 Ca 0.40 0.06 0.03 0.00 0.00 0.00 0.00 61.98 62.47 1jz4 s VAL 895 Cb -0.01 -0.58 0.01 0.00 0.00 0.00 0.00 36.38 35.80 1jz4 s VAL 895 CO 0.23 0.27 -0.17 0.21 0.00 0.00 0.00 175.10 175.64 1jz4 s ASN 896 N 1.85 2.39 0.03 3.32 3.84 -1.05 -1.68 114.94 123.64 1jz4 s ASN 896 Ca 0.03 -0.42 -0.07 0.00 0.21 0.00 0.00 52.86 52.61 1jz4 s ASN 896 Cb -0.12 -1.09 -0.00 0.00 -0.55 0.00 0.00 41.25 39.48 1jz4 s ASN 896 CO -0.05 0.08 0.14 -1.66 -2.79 0.00 0.00 177.10 172.82 1jz4 s TRP 897 N 0.60 0.12 -0.40 0.43 -2.14 -0.32 -0.67 118.94 116.56 1jz4 s TRP 897 Ca -0.15 -0.37 -0.05 0.00 2.66 0.00 0.00 56.10 58.19 1jz4 s TRP 897 Cb -0.16 -0.09 0.09 0.00 -3.10 0.00 0.00 33.47 30.21 1jz4 s TRP 897 CO 0.05 -0.38 0.20 -1.17 -2.66 0.00 0.00 176.95 172.99 1jz4 s LEU 898 N -2.00 5.02 0.00 -4.66 2.96 -0.32 0.75 118.68 120.44 1jz4 s LEU 898 Ca -0.06 -1.71 0.00 0.00 -0.22 0.00 0.00 54.13 52.14 1jz4 s LEU 898 Cb -0.02 -1.88 0.00 0.00 0.50 0.00 0.00 46.19 44.79 1jz4 s LEU 898 CO -0.03 -0.50 0.00 0.61 -1.32 0.00 0.00 176.35 175.10 1jz4 n GLY 899 N 4.73 -0.67 3.73 7.98 0.00 -0.01 -0.89 105.19 120.07 1jz4 n GLY 899 Ca -0.07 -0.48 -0.41 0.00 0.00 0.00 0.00 46.02 45.06 1jz4 n GLY 899 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jz4 s LEU 900 N 0.00 4.49 0.00 0.99 1.43 -0.93 -0.51 118.68 124.16 1jz4 s LEU 900 Ca 0.00 1.71 0.00 0.00 -1.03 0.00 0.00 54.13 54.81 1jz4 s LEU 900 Cb 0.00 -3.49 0.00 0.00 0.03 0.00 0.00 46.19 42.73 1jz4 s LEU 900 CO 0.00 -0.03 0.00 0.61 0.23 0.00 0.00 176.35 177.16 1jz4 n GLY 901 N 2.25 -0.78 0.07 -3.19 0.00 0.10 -4.47 105.19 99.17 1jz4 n GLY 901 Ca 0.01 -0.66 0.12 0.00 0.00 0.00 0.00 46.02 45.49 1jz4 n GLY 901 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1jz4 n PRO 902 N 0.00 0.29 -1.73 1.61 -0.04 -1.26 0.51 135.00 134.37 1jz4 n PRO 902 Ca 0.00 0.11 -0.31 0.00 -0.04 0.00 0.00 63.50 63.26 1jz4 n PRO 902 Cb 0.00 -1.71 0.03 0.00 -0.04 0.00 0.00 33.50 31.78 1jz4 n PRO 902 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1jz4 s GLN 903 N -3.15 3.23 0.19 0.54 -0.21 -1.26 -5.00 119.66 114.00 1jz4 s GLN 903 Ca 0.07 0.83 -0.31 0.00 0.02 0.00 0.00 55.36 55.97 1jz4 s GLN 903 Cb 0.13 -2.03 -0.16 0.00 1.00 0.00 0.00 33.01 31.95 1jz4 s GLN 903 CO 0.70 -0.85 0.98 -1.91 -2.12 0.00 0.00 175.29 172.08 1jz4 n GLU 904 N -2.95 0.88 -3.75 2.91 2.13 -1.26 -4.88 120.64 113.71 1jz4 n GLU 904 Ca 0.07 0.31 -0.13 0.00 0.66 0.00 0.00 57.16 58.07 1jz4 n GLU 904 Cb 0.54 -1.67 -0.10 0.00 0.27 0.00 0.00 31.44 30.48 1jz4 n GLU 904 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1jz4 s ASN 905 N -0.36 -0.36 0.30 4.31 2.20 0.21 -4.94 114.94 116.30 1jz4 s ASN 905 Ca 0.69 0.68 0.07 0.00 -0.94 0.00 0.00 52.86 53.36 1jz4 s ASN 905 Cb -0.86 0.70 -0.06 0.00 -2.00 0.00 0.00 41.25 39.03 1jz4 s ASN 905 CO 0.55 -0.16 -0.07 -0.31 -2.94 0.00 0.00 177.10 174.18 1jz4 s TYR 906 N 0.05 2.07 0.32 1.54 1.51 -0.98 -3.76 117.35 118.10 1jz4 s TYR 906 Ca -0.01 -0.65 0.09 0.00 -1.01 0.00 0.00 57.07 55.49 1jz4 s TYR 906 Cb -0.03 -1.19 0.88 0.00 -0.11 0.00 0.00 41.96 41.51 1jz4 s TYR 906 CO 0.01 0.36 1.72 -1.35 -1.11 0.00 0.00 175.55 175.18 1jz4 h PRO 907 N 2.20 0.53 -0.69 -1.71 0.11 -1.87 1.11 132.00 131.69 1jz4 h PRO 907 Ca -0.41 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1jz4 h PRO 907 Cb 1.24 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1jz4 h PRO 907 CO 0.68 0.35 0.00 -0.40 -0.21 0.00 0.00 178.00 178.42 1jz4 n ASP 908 N -4.91 4.25 -3.07 -2.05 5.75 -1.26 -4.40 116.55 110.86 1jz4 n ASP 908 Ca 0.27 -2.20 -0.16 0.00 -0.01 0.00 0.00 54.79 52.68 1jz4 n ASP 908 Cb 0.75 -0.53 0.00 0.00 -1.03 0.00 0.00 41.12 40.31 1jz4 n ASP 908 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 1jz4 n ARG 909 N 1.39 0.98 0.00 0.11 0.63 0.38 -0.92 116.66 119.22 1jz4 n ARG 909 Ca 0.25 -3.01 0.00 0.00 -0.92 0.00 0.00 57.85 54.16 1jz4 n ARG 909 Cb 0.74 -1.54 0.00 0.00 0.45 0.00 0.00 32.46 32.11 1jz4 n ARG 909 CO 0.00 0.00 0.00 1.47 -2.51 0.00 0.00 177.63 176.59 1jz4 n LEU 910 N 0.30 0.26 0.20 6.15 -0.00 -0.86 -2.31 117.00 120.73 1jz4 n LEU 910 Ca 0.20 -0.26 0.05 0.00 -0.00 0.00 0.00 56.01 56.01 1jz4 n LEU 910 Cb 0.67 0.00 0.51 0.00 -0.00 0.00 0.00 43.42 44.60 1jz4 n LEU 910 CO 0.17 0.06 0.96 0.71 -0.00 0.00 0.00 177.39 179.29 1jz4 h THR 911 N 2.54 1.10 0.00 1.47 1.35 -1.91 -2.71 112.91 114.76 1jz4 h THR 911 Ca 0.00 -0.46 -0.09 0.00 -0.55 0.00 0.00 66.41 65.31 1jz4 h THR 911 Cb 0.92 1.17 -0.01 0.00 -1.73 0.00 0.00 68.15 68.49 1jz4 h THR 911 CO 0.00 0.14 -0.43 0.00 -0.25 0.00 0.00 175.52 174.98 1jz4 h ALA 912 N 1.83 0.79 -2.70 6.62 0.00 -1.88 -3.46 119.26 120.46 1jz4 h ALA 912 Ca 0.02 -0.39 -0.51 0.00 0.00 0.00 0.00 54.91 54.02 1jz4 h ALA 912 Cb 0.22 -0.07 0.08 0.00 0.00 0.00 0.00 17.79 18.02 1jz4 h ALA 912 CO 0.01 0.54 0.47 0.00 0.00 0.00 0.00 179.25 180.27 1jz4 s ALA 913 N -3.19 2.76 0.01 0.00 0.00 -1.02 -5.00 121.76 115.31 1jz4 s ALA 913 Ca 0.03 0.93 0.08 0.00 0.00 0.00 0.00 51.96 53.00 1jz4 s ALA 913 Cb 0.09 -3.40 -0.02 0.00 0.00 0.00 0.00 23.12 19.78 1jz4 s ALA 913 CO 0.72 -0.85 -0.26 0.00 0.00 0.00 0.00 175.76 175.36 1jz4 s PHE 915 N -0.70 3.24 0.00 0.00 5.36 -1.25 0.02 117.98 124.66 1jz4 s PHE 915 Ca 0.11 1.37 0.00 0.00 -0.96 0.00 0.00 56.93 57.45 1jz4 s PHE 915 Cb -0.10 -3.35 0.00 0.00 -0.34 0.00 0.00 43.02 39.23 1jz4 s PHE 915 CO 0.00 -0.69 0.00 -3.47 -1.46 0.00 0.00 175.22 169.60 1jz4 n ASP 916 N 6.43 0.00 -4.52 6.13 -0.08 0.33 -4.89 116.55 119.95 1jz4 n ASP 916 Ca 0.12 -0.64 -0.38 0.00 -1.51 0.00 0.00 54.79 52.38 1jz4 n ASP 916 Cb 0.46 0.00 -0.11 0.00 2.34 0.00 0.00 41.12 43.81 1jz4 n ASP 916 CO 0.00 0.00 0.00 -0.60 0.12 0.00 0.00 177.20 176.72 1jz4 s ARG 917 N -0.92 3.72 0.24 -0.67 6.06 -1.26 -0.83 118.95 125.30 1jz4 s ARG 917 Ca 0.00 -0.46 0.08 0.00 -2.50 0.00 0.00 55.73 52.85 1jz4 s ARG 917 Cb 0.00 -3.59 -0.04 0.00 0.06 0.00 0.00 34.95 31.38 1jz4 s ARG 917 CO 0.00 -0.25 0.05 -1.58 -2.50 0.00 0.00 175.30 171.02 1jz4 s TRP 918 N 1.70 2.84 -0.29 5.12 0.52 0.23 -4.97 118.94 124.10 1jz4 s TRP 918 Ca 0.06 -0.17 -0.01 0.00 0.02 0.00 0.00 56.10 56.00 1jz4 s TRP 918 Cb -0.16 -1.29 0.18 0.00 -1.15 0.00 0.00 33.47 31.05 1jz4 s TRP 918 CO 0.08 0.57 0.54 0.34 0.02 0.00 0.00 176.95 178.51 1jz4 s ASP 919 N -3.58 -0.96 0.21 2.95 -1.08 -1.26 -1.18 116.67 111.78 1jz4 s ASP 919 Ca 0.31 0.63 0.02 0.00 -0.52 0.00 0.00 52.55 52.99 1jz4 s ASP 919 Cb -0.07 1.87 -0.05 0.00 -1.46 0.00 0.00 42.92 43.21 1jz4 s ASP 919 CO 0.21 -0.28 0.02 -0.76 0.52 0.00 0.00 175.17 174.89 1jz4 s LEU 920 N 2.77 2.01 0.45 -1.34 1.43 -0.68 -4.96 118.68 118.36 1jz4 s LEU 920 Ca 0.18 -1.24 -0.23 0.00 -1.03 0.00 0.00 54.13 51.81 1jz4 s LEU 920 Cb -0.15 -0.08 -0.08 0.00 0.03 0.00 0.00 46.19 45.91 1jz4 s LEU 920 CO -0.20 -0.60 1.14 -2.16 0.23 0.00 0.00 176.35 174.76 1jz4 s PRO 921 N -3.93 3.82 0.21 1.29 0.04 -1.26 -0.27 135.00 134.90 1jz4 s PRO 921 Ca 0.28 1.70 -0.13 0.00 0.04 0.00 0.00 61.00 62.90 1jz4 s PRO 921 Cb 0.06 -2.40 0.26 0.00 0.04 0.00 0.00 34.50 32.47 1jz4 s PRO 921 CO 0.07 -0.48 1.63 1.25 0.04 0.00 0.00 177.00 179.51 1jz4 h LEU 922 N 2.07 -0.53 -2.13 -3.56 5.85 -1.25 -1.62 115.31 114.14 1jz4 h LEU 922 Ca -0.49 0.19 0.08 0.00 0.84 0.00 0.00 57.88 58.49 1jz4 h LEU 922 Cb 1.24 0.37 -0.01 0.00 0.37 0.00 0.00 40.66 42.63 1jz4 h LEU 922 CO 0.60 -0.20 0.29 0.77 -0.34 0.00 0.00 178.44 179.57 1jz4 h SER 923 N 0.02 0.00 0.58 1.25 4.64 -1.91 0.83 113.55 118.96 1jz4 h SER 923 Ca 0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 1jz4 h SER 923 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1jz4 h SER 923 CO -0.64 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 175.79 1jz4 n ASP 924 N -3.79 0.40 -0.86 4.97 8.00 -0.61 -1.71 116.55 122.96 1jz4 n ASP 924 Ca 0.04 0.61 0.09 0.00 0.71 0.00 0.00 54.79 56.24 1jz4 n ASP 924 Cb 0.43 -0.69 0.26 0.00 -0.02 0.00 0.00 41.12 41.11 1jz4 n ASP 924 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 1jz4 n MET 925 N -1.95 2.09 -4.74 -1.24 2.81 0.28 -4.79 117.12 109.59 1jz4 n MET 925 Ca 0.02 -1.68 -0.29 0.00 -1.81 0.00 0.00 57.70 53.94 1jz4 n MET 925 Cb 0.19 -1.41 -0.17 0.00 -0.71 0.00 0.00 33.22 31.12 1jz4 n MET 925 CO 0.00 0.00 0.00 -0.47 1.51 0.00 0.00 175.97 177.01 1jz4 s TYR 926 N -1.50 2.16 -0.29 2.03 5.04 -0.69 -4.35 117.35 119.74 1jz4 s TYR 926 Ca 0.34 -0.96 -0.09 0.00 -2.44 0.00 0.00 57.07 53.92 1jz4 s TYR 926 Cb 0.18 -1.50 -0.01 0.00 0.35 0.00 0.00 41.96 40.98 1jz4 s TYR 926 CO 0.25 -0.45 0.13 0.99 -1.34 0.00 0.00 175.55 175.13 1jz4 s THR 927 N 0.71 4.51 -1.08 4.34 2.01 -1.26 -4.97 115.64 119.91 1jz4 s THR 927 Ca -0.12 -0.34 -0.08 0.00 0.31 0.00 0.00 61.69 61.46 1jz4 s THR 927 Cb -0.16 -3.24 -0.12 0.00 0.01 0.00 0.00 72.50 68.98 1jz4 s THR 927 CO 0.02 0.15 2.89 -0.81 -0.69 0.00 0.00 174.62 176.19 1jz4 n PRO 928 N 4.96 2.91 -1.67 4.92 -0.04 -1.26 -4.89 135.00 139.94 1jz4 n PRO 928 Ca -0.15 -1.72 -0.45 0.00 -0.04 0.00 0.00 63.50 61.14 1jz4 n PRO 928 Cb 0.50 -2.51 -0.03 0.00 -0.04 0.00 0.00 33.50 31.41 1jz4 n PRO 928 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1jz4 n TYR 929 N 3.43 2.22 -0.32 0.54 4.02 -1.26 -4.84 117.16 120.94 1jz4 n TYR 929 Ca 0.62 0.36 0.05 0.00 -0.01 0.00 0.00 57.90 58.92 1jz4 n TYR 929 Cb 0.36 -2.50 0.24 0.00 -0.02 0.00 0.00 39.34 37.43 1jz4 n TYR 929 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 1jz4 h VAL 930 N 3.30 1.02 -3.52 -0.72 2.07 -1.96 -3.30 116.25 113.14 1jz4 h VAL 930 Ca -0.45 -0.35 -0.72 0.00 0.82 0.00 0.00 66.70 66.00 1jz4 h VAL 930 Cb 1.27 -0.09 -0.22 0.00 -1.52 0.00 0.00 31.29 30.72 1jz4 h VAL 930 CO 0.81 0.19 -0.46 0.12 0.02 0.00 0.00 177.57 178.25 1jz4 s PHE 931 N -5.92 3.24 0.62 1.57 5.36 -1.26 -1.41 117.98 120.19 1jz4 s PHE 931 Ca -0.12 -0.76 -0.19 0.00 -0.96 0.00 0.00 56.93 54.91 1jz4 s PHE 931 Cb 0.21 -2.57 -0.02 0.00 -0.34 0.00 0.00 43.02 40.30 1jz4 s PHE 931 CO 0.80 -0.63 1.31 -2.14 -1.46 0.00 0.00 175.22 173.11 1jz4 s PRO 932 N 1.63 2.68 0.32 10.12 0.02 -1.24 -4.95 135.00 143.57 1jz4 s PRO 932 Ca 0.04 2.12 -0.16 0.00 0.02 0.00 0.00 61.00 63.01 1jz4 s PRO 932 Cb -0.19 -1.94 0.06 0.00 0.02 0.00 0.00 34.50 32.45 1jz4 s PRO 932 CO 0.09 -1.51 0.82 -1.13 -0.33 0.00 0.00 177.00 174.93 1jz4 n SER 933 N -1.71 -2.05 -4.66 2.53 3.41 -1.26 -4.75 113.62 105.13 1jz4 n SER 933 Ca 0.15 -2.33 -0.43 0.00 -0.26 0.00 0.00 58.87 55.99 1jz4 n SER 933 Cb 0.47 3.39 -0.01 0.00 -0.26 0.00 0.00 64.21 67.80 1jz4 n SER 933 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1jz4 n GLU 934 N -0.56 1.89 -3.74 4.33 4.07 0.19 -4.94 120.64 121.87 1jz4 n GLU 934 Ca -0.07 0.66 -0.05 0.00 -0.06 0.00 0.00 57.16 57.64 1jz4 n GLU 934 Cb 0.56 -2.18 -0.02 0.00 -0.06 0.00 0.00 31.44 29.75 1jz4 n GLU 934 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1jz4 s ASN 935 N -0.39 -0.23 -0.66 4.31 2.20 -1.26 -4.90 114.94 114.01 1jz4 s ASN 935 Ca 0.56 -0.40 0.00 0.00 -0.94 0.00 0.00 52.86 52.09 1jz4 s ASN 935 Cb -0.61 0.54 0.00 0.00 -2.00 0.00 0.00 41.25 39.18 1jz4 s ASN 935 CO 0.62 -0.98 0.00 0.61 -2.94 0.00 0.00 177.10 174.40 1jz4 n GLY 936 N -0.44 0.76 3.69 0.45 0.00 -1.26 -4.81 105.19 103.57 1jz4 n GLY 936 Ca -0.06 -0.21 -0.36 0.00 0.00 0.00 0.00 46.02 45.39 1jz4 n GLY 936 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1jz4 n LEU 937 N -0.70 4.97 -3.91 0.99 7.94 -1.26 -4.61 117.00 120.41 1jz4 n LEU 937 Ca -0.06 0.74 -0.21 0.00 -1.11 0.00 0.00 56.01 55.37 1jz4 n LEU 937 Cb 0.36 -1.50 -0.16 0.00 0.53 0.00 0.00 43.42 42.64 1jz4 n LEU 937 CO 0.09 -1.45 -0.42 -0.13 -1.11 0.00 0.00 177.39 174.38 1jz4 s ARG 938 N -3.50 0.96 0.55 1.96 3.00 0.26 0.67 118.95 122.85 1jz4 s ARG 938 Ca 0.78 -0.15 0.08 0.00 0.00 0.00 0.00 55.73 56.44 1jz4 s ARG 938 Cb -0.35 -0.92 0.08 0.00 0.00 0.00 0.00 34.95 33.75 1jz4 s ARG 938 CO 0.45 -0.06 0.65 0.00 0.00 0.00 0.00 175.30 176.34 1jz4 n GLY 940 N -1.67 -0.50 3.72 0.00 0.00 -1.13 -2.18 105.19 103.44 1jz4 n GLY 940 Ca 0.10 0.14 -0.35 0.00 0.00 0.00 0.00 46.02 45.91 1jz4 n GLY 940 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jz4 s THR 941 N -3.13 5.40 -0.29 2.61 2.01 -0.46 -3.77 115.64 118.01 1jz4 s THR 941 Ca 0.49 0.21 0.17 0.00 0.31 0.00 0.00 61.69 62.87 1jz4 s THR 941 Cb -0.24 -3.48 -0.24 0.00 0.01 0.00 0.00 72.50 68.54 1jz4 s THR 941 CO 0.60 0.42 0.50 0.54 -0.69 0.00 0.00 174.62 175.99 1jz4 n ARG 942 N 3.64 0.81 -3.64 4.92 5.12 -0.07 -0.44 116.66 127.00 1jz4 n ARG 942 Ca -0.16 -0.11 -0.13 0.00 -1.93 0.00 0.00 57.85 55.52 1jz4 n ARG 942 Cb 0.52 -1.38 -0.07 0.00 -1.16 0.00 0.00 32.46 30.36 1jz4 n ARG 942 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 1jz4 s GLU 943 N -3.02 0.79 -0.01 5.56 2.12 -1.19 -2.06 118.70 120.89 1jz4 s GLU 943 Ca -0.02 0.98 0.00 0.00 0.36 0.00 0.00 54.97 56.29 1jz4 s GLU 943 Cb 0.12 0.36 0.00 0.00 0.26 0.00 0.00 34.13 34.88 1jz4 s GLU 943 CO 0.72 -0.10 -0.01 -1.17 -0.54 0.00 0.00 175.26 174.16 1jz4 s LEU 944 N 0.50 1.86 -0.06 2.70 2.96 -0.11 -1.17 118.68 125.35 1jz4 s LEU 944 Ca -0.01 -0.02 0.04 0.00 -0.22 0.00 0.00 54.13 53.91 1jz4 s LEU 944 Cb -0.05 -0.09 0.00 0.00 0.50 0.00 0.00 46.19 46.56 1jz4 s LEU 944 CO -0.01 -0.00 -0.17 0.20 -1.32 0.00 0.00 176.35 175.04 1jz4 s ASN 945 N 0.14 2.27 -0.24 3.68 0.01 0.16 0.18 114.94 121.14 1jz4 s ASN 945 Ca -0.01 -0.39 -0.05 0.00 -0.71 0.00 0.00 52.86 51.70 1jz4 s ASN 945 Cb -0.03 -0.85 0.12 0.00 0.41 0.00 0.00 41.25 40.91 1jz4 s ASN 945 CO -0.00 0.12 0.47 -0.47 -1.51 0.00 0.00 177.10 175.71 1jz4 s TYR 946 N 0.29 -1.02 0.00 2.20 5.04 -0.35 -2.52 117.35 120.99 1jz4 s TYR 946 Ca -0.10 1.50 0.00 0.00 -2.44 0.00 0.00 57.07 56.02 1jz4 s TYR 946 Cb -0.14 0.35 0.00 0.00 0.35 0.00 0.00 41.96 42.52 1jz4 s TYR 946 CO 0.04 -0.64 0.00 0.41 -1.34 0.00 0.00 175.55 174.02 1jz4 n GLY 947 N 5.40 2.39 0.04 8.97 0.00 -1.26 -1.03 105.19 119.70 1jz4 n GLY 947 Ca -0.07 -0.43 0.13 0.00 0.00 0.00 0.00 46.02 45.65 1jz4 n GLY 947 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1jz4 n PRO 948 N 13.41 0.12 -2.62 1.61 -0.04 -1.26 -4.90 135.00 141.32 1jz4 n PRO 948 Ca 0.00 0.08 -0.39 0.00 -0.04 0.00 0.00 63.50 63.15 1jz4 n PRO 948 Cb 0.00 -1.62 -0.05 0.00 -0.04 0.00 0.00 33.50 31.79 1jz4 n PRO 948 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1jz4 s HIS 949 N -3.05 3.68 -0.06 0.54 3.76 -0.19 0.30 115.29 120.27 1jz4 s HIS 949 Ca 0.12 1.77 0.00 0.00 -0.15 0.00 0.00 55.06 56.80 1jz4 s HIS 949 Cb 0.16 -3.11 0.02 0.00 1.11 0.00 0.00 32.58 30.76 1jz4 s HIS 949 CO 0.60 -0.13 -0.03 -1.14 -0.85 0.00 0.00 174.74 173.19 1jz4 s GLN 950 N -1.60 0.82 -0.08 1.40 0.74 -0.19 -1.21 119.66 119.54 1jz4 s GLN 950 Ca 0.46 -0.05 0.03 0.00 0.05 0.00 0.00 55.36 55.85 1jz4 s GLN 950 Cb -0.27 -0.93 -0.02 0.00 1.10 0.00 0.00 33.01 32.89 1jz4 s GLN 950 CO 0.34 -0.16 -0.18 -1.58 -0.55 0.00 0.00 175.29 173.16 1jz4 s TRP 951 N 1.28 2.65 0.11 1.67 0.51 0.13 -1.47 118.94 123.82 1jz4 s TRP 951 Ca -0.05 -0.53 0.08 0.00 -2.12 0.00 0.00 56.10 53.47 1jz4 s TRP 951 Cb -0.14 -1.69 -0.04 0.00 -0.81 0.00 0.00 33.47 30.80 1jz4 s TRP 951 CO -0.02 -0.10 -0.18 1.03 -0.51 0.00 0.00 176.95 177.17 1jz4 s ARG 952 N -0.16 1.10 0.00 4.98 0.52 0.23 -0.93 118.95 124.69 1jz4 s ARG 952 Ca -0.02 -1.19 0.00 0.00 -0.52 0.00 0.00 55.73 54.00 1jz4 s ARG 952 Cb -0.14 -1.23 0.00 0.00 0.52 0.00 0.00 34.95 34.10 1jz4 s ARG 952 CO 0.04 0.27 0.00 0.41 0.02 0.00 0.00 175.30 176.04 1jz4 n GLY 953 N 0.88 -0.53 2.55 -3.53 0.00 -0.88 -1.43 105.19 102.25 1jz4 n GLY 953 Ca -0.18 -0.19 -0.16 0.00 0.00 0.00 0.00 46.02 45.48 1jz4 n GLY 953 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1jz4 n ASP 954 N 0.00 -1.80 -2.85 1.61 2.03 -1.22 -4.07 116.55 110.26 1jz4 n ASP 954 Ca 0.00 -2.67 -0.15 0.00 0.52 0.00 0.00 54.79 52.49 1jz4 n ASP 954 Cb 0.00 0.52 -0.05 0.00 -0.72 0.00 0.00 41.12 40.87 1jz4 n ASP 954 CO 0.00 0.00 0.00 2.22 -1.92 0.00 0.00 177.20 177.50 1jz4 n PHE 955 N 2.72 -0.03 -4.55 -0.67 1.16 0.42 -4.86 117.46 111.64 1jz4 n PHE 955 Ca 0.23 -1.65 -0.26 0.00 -1.87 0.00 0.00 57.45 53.90 1jz4 n PHE 955 Cb 0.52 0.03 -0.14 0.00 -1.61 0.00 0.00 39.48 38.29 1jz4 n PHE 955 CO 0.00 0.00 0.00 -0.65 -1.87 0.00 0.00 176.76 174.24 1jz4 s GLN 956 N -2.94 1.38 0.09 3.97 -1.52 0.83 -1.36 119.66 120.11 1jz4 s GLN 956 Ca 0.15 -1.08 -0.24 0.00 -1.95 0.00 0.00 55.36 52.24 1jz4 s GLN 956 Cb 0.01 -1.60 0.06 0.00 -0.22 0.00 0.00 33.01 31.26 1jz4 s GLN 956 CO 0.11 0.40 0.59 -0.59 -0.25 0.00 0.00 175.29 175.55 1jz4 s PHE 957 N -0.93 -0.53 0.03 0.91 -0.12 -0.61 0.87 117.98 117.60 1jz4 s PHE 957 Ca 0.09 0.50 0.00 0.00 -0.05 0.00 0.00 56.93 57.47 1jz4 s PHE 957 Cb -0.09 0.47 -0.03 0.00 -0.63 0.00 0.00 43.02 42.74 1jz4 s PHE 957 CO 0.03 -0.75 -0.04 0.54 -0.05 0.00 0.00 175.22 174.95 1jz4 s ASN 958 N -2.28 0.43 -0.10 1.98 2.20 -0.62 -0.57 114.94 115.97 1jz4 s ASN 958 Ca -0.03 -0.63 -0.06 0.00 -0.94 0.00 0.00 52.86 51.20 1jz4 s ASN 958 Cb -0.01 0.11 0.04 0.00 -2.00 0.00 0.00 41.25 39.39 1jz4 s ASN 958 CO -0.06 -0.35 0.23 -0.51 -2.94 0.00 0.00 177.10 173.47 1jz4 s ILE 959 N -2.04 -0.03 0.05 0.54 2.07 -1.26 -0.97 121.20 119.56 1jz4 s ILE 959 Ca -0.09 0.10 -0.26 0.00 -1.41 0.00 0.00 60.65 58.99 1jz4 s ILE 959 Cb -0.06 -0.35 0.09 0.00 0.13 0.00 0.00 42.46 42.27 1jz4 s ILE 959 CO -0.03 0.04 1.20 -0.94 -1.91 0.00 0.00 174.94 173.31 1jz4 s SER 960 N 0.90 0.01 0.00 4.50 1.04 0.75 -4.63 113.70 116.27 1jz4 s SER 960 Ca -0.06 -0.36 0.15 0.00 0.48 0.00 0.00 55.95 56.15 1jz4 s SER 960 Cb -0.08 0.26 0.87 0.00 0.10 0.00 0.00 66.02 67.18 1jz4 s SER 960 CO -0.06 -0.52 1.56 0.54 0.98 0.00 0.00 173.24 175.74 1jz4 n ARG 961 N -0.83 1.03 -5.06 4.02 5.12 -1.26 -0.42 116.66 119.25 1jz4 n ARG 961 Ca 0.01 -0.04 -0.29 0.00 -1.93 0.00 0.00 57.85 55.60 1jz4 n ARG 961 Cb 0.59 -1.24 -0.17 0.00 -1.16 0.00 0.00 32.46 30.49 1jz4 n ARG 961 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 1jz4 s TYR 962 N -1.99 2.18 0.73 -1.55 1.51 -1.26 -1.18 117.35 115.79 1jz4 s TYR 962 Ca 0.22 -0.75 -0.11 0.00 -1.01 0.00 0.00 57.07 55.42 1jz4 s TYR 962 Cb 0.10 -1.46 0.03 0.00 -0.11 0.00 0.00 41.96 40.52 1jz4 s TYR 962 CO 0.17 -0.28 1.08 -1.54 -1.11 0.00 0.00 175.55 173.87 1jz4 s SER 963 N 0.16 4.92 0.36 2.29 1.04 -1.26 -4.82 113.70 116.38 1jz4 s SER 963 Ca -0.10 1.75 0.06 0.00 0.48 0.00 0.00 55.95 58.14 1jz4 s SER 963 Cb -0.15 -2.51 0.68 0.00 0.10 0.00 0.00 66.02 64.14 1jz4 s SER 963 CO 0.05 -1.75 1.90 1.56 0.98 0.00 0.00 173.24 175.98 1jz4 h GLN 964 N -0.86 0.42 -0.70 4.02 1.08 -1.99 -1.59 115.11 115.49 1jz4 h GLN 964 Ca -0.44 -0.09 -0.06 0.00 -1.45 0.00 0.00 58.65 56.61 1jz4 h GLN 964 Cb 1.22 -0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 28.56 1jz4 h GLN 964 CO 0.54 0.48 0.19 0.37 -0.95 0.00 0.00 178.83 179.45 1jz4 h GLN 965 N 0.41 1.12 -0.39 1.46 4.15 -1.99 -1.52 115.11 118.35 1jz4 h GLN 965 Ca 0.09 -0.26 -0.04 0.00 0.77 0.00 0.00 58.65 59.21 1jz4 h GLN 965 Cb 0.32 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 27.84 1jz4 h GLN 965 CO 0.01 0.98 0.09 0.37 -1.93 0.00 0.00 178.83 178.35 1jz4 h GLN 966 N 1.05 0.63 -0.30 1.69 4.15 -1.72 -1.58 115.11 119.03 1jz4 h GLN 966 Ca 0.22 -0.16 0.04 0.00 0.77 0.00 0.00 58.65 59.53 1jz4 h GLN 966 Cb 0.35 -0.08 -0.04 0.00 0.21 0.00 0.00 27.48 27.92 1jz4 h GLN 966 CO -0.00 0.66 0.08 -0.07 -1.93 0.00 0.00 178.83 177.57 1jz4 h LEU 967 N 0.48 0.05 -1.81 -2.39 3.38 -0.98 -0.32 115.31 113.72 1jz4 h LEU 967 Ca 0.12 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 1jz4 h LEU 967 Cb 0.32 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 1jz4 h LEU 967 CO 0.00 0.06 -0.15 -0.03 0.09 0.00 0.00 178.44 178.42 1jz4 h MET 968 N 0.19 0.00 -0.10 1.13 4.05 -1.18 -2.67 114.93 116.35 1jz4 h MET 968 Ca 0.14 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.56 1jz4 h MET 968 Cb 0.14 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.94 1jz4 h MET 968 CO -0.17 0.15 0.00 0.39 0.23 0.00 0.00 176.91 177.51 1jz4 n GLU 969 N -3.91 2.02 -4.24 0.39 1.02 -0.20 -4.86 120.64 110.86 1jz4 n GLU 969 Ca -0.02 -1.50 -0.33 0.00 -0.02 0.00 0.00 57.16 55.29 1jz4 n GLU 969 Cb 0.24 -1.46 -0.16 0.00 -0.02 0.00 0.00 31.44 30.04 1jz4 n GLU 969 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1jz4 s THR 970 N -1.89 2.02 -0.18 2.62 2.01 -0.77 -5.01 115.64 114.44 1jz4 s THR 970 Ca 0.34 -0.92 0.25 0.00 0.31 0.00 0.00 61.69 61.67 1jz4 s THR 970 Cb 0.20 -1.82 0.31 0.00 0.01 0.00 0.00 72.50 71.21 1jz4 s THR 970 CO 0.31 0.53 1.73 0.77 -0.69 0.00 0.00 174.62 177.27 1jz4 h SER 971 N 7.81 0.00 -4.00 3.53 4.64 -1.89 -3.36 113.55 120.28 1jz4 h SER 971 Ca -0.42 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.42 1jz4 h SER 971 Cb 1.15 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 62.94 1jz4 h SER 971 CO 0.61 0.08 -0.81 -1.00 -0.87 0.00 0.00 176.83 174.84 1jz4 s HIS 972 N -3.37 1.24 0.46 4.77 3.76 -1.26 -4.25 115.29 116.64 1jz4 s HIS 972 Ca 0.04 -0.29 0.24 0.00 -0.15 0.00 0.00 55.06 54.90 1jz4 s HIS 972 Cb 0.07 -0.83 1.39 0.00 1.11 0.00 0.00 32.58 34.32 1jz4 s HIS 972 CO 0.64 -0.08 2.08 0.07 -0.85 0.00 0.00 174.74 176.60 1jz4 h ARG 973 N 6.10 0.00 0.00 1.40 0.11 -1.45 -1.23 114.38 119.31 1jz4 h ARG 973 Ca -0.33 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.75 1jz4 h ARG 973 Cb 1.17 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.25 1jz4 h ARG 973 CO 0.49 0.11 0.00 1.12 0.10 0.00 0.00 179.97 181.79 1jz4 h HIS 974 N 0.00 0.00 -0.01 4.08 2.07 -1.92 -2.28 115.15 117.09 1jz4 h HIS 974 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1jz4 h HIS 974 Cb 0.27 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.25 1jz4 h HIS 974 CO 0.00 0.00 -0.18 1.28 -3.07 0.00 0.00 177.93 175.96 1jz4 n LEU 975 N -2.33 1.04 -4.79 6.12 4.77 -0.47 -4.91 117.00 116.43 1jz4 n LEU 975 Ca 0.02 -0.27 -0.34 0.00 -0.03 0.00 0.00 56.01 55.39 1jz4 n LEU 975 Cb 0.27 -0.10 -0.02 0.00 -2.33 0.00 0.00 43.42 41.24 1jz4 n LEU 975 CO 0.22 0.19 0.73 -0.76 -1.33 0.00 0.00 177.39 176.44 1jz4 s LEU 976 N -2.39 3.74 -0.01 2.23 1.43 -0.86 -5.05 118.68 117.77 1jz4 s LEU 976 Ca 0.28 1.96 0.04 0.00 -1.03 0.00 0.00 54.13 55.38 1jz4 s LEU 976 Cb 0.20 -4.56 -0.01 0.00 0.03 0.00 0.00 46.19 41.85 1jz4 s LEU 976 CO 0.47 -0.97 -0.13 -1.38 0.23 0.00 0.00 176.35 174.58 1jz4 s HIS 977 N -2.04 1.14 0.24 0.29 -3.43 -1.26 -5.11 115.29 105.12 1jz4 s HIS 977 Ca 0.68 -0.22 -0.31 0.00 -0.80 0.00 0.00 55.06 54.41 1jz4 s HIS 977 Cb -0.18 -0.74 -0.11 0.00 -1.43 0.00 0.00 32.58 30.12 1jz4 s HIS 977 CO 0.25 -0.03 1.54 0.00 -2.00 0.00 0.00 174.74 174.51 1jz4 s ALA 978 N -0.27 3.73 0.89 -1.38 0.00 -1.26 -4.86 121.76 118.60 1jz4 s ALA 978 Ca 0.04 1.44 -0.10 0.00 0.00 0.00 0.00 51.96 53.35 1jz4 s ALA 978 Cb -0.05 -3.61 0.19 0.00 0.00 0.00 0.00 23.12 19.65 1jz4 s ALA 978 CO -0.00 -0.84 1.21 -1.21 0.00 0.00 0.00 175.76 174.91 1jz4 s GLU 979 N 0.07 0.86 0.40 0.00 2.02 -0.33 -5.00 118.70 116.73 1jz4 s GLU 979 Ca 0.64 -0.84 -0.26 0.00 0.02 0.00 0.00 54.97 54.53 1jz4 s GLU 979 Cb -0.45 -2.04 -0.09 0.00 0.10 0.00 0.00 34.13 31.65 1jz4 s GLU 979 CO 0.41 -2.15 1.24 -2.00 0.02 0.00 0.00 175.26 172.78 1jz4 s GLU 980 N -5.62 4.03 2.00 1.61 2.12 -1.26 -4.80 118.70 116.79 1jz4 s GLU 980 Ca 0.73 2.02 0.00 0.00 0.36 0.00 0.00 54.97 58.07 1jz4 s GLU 980 Cb -0.03 -2.75 0.00 0.00 0.26 0.00 0.00 34.13 31.61 1jz4 s GLU 980 CO 0.50 -0.39 0.00 0.41 -0.54 0.00 0.00 175.26 175.24 1jz4 n GLY 981 N 0.68 -0.80 3.22 -1.50 0.00 -1.26 -4.84 105.19 100.70 1jz4 n GLY 981 Ca 0.04 -0.96 -0.33 0.00 0.00 0.00 0.00 46.02 44.77 1jz4 n GLY 981 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jz4 s THR 982 N 0.00 2.28 -0.28 2.61 2.01 0.02 -4.72 115.64 117.55 1jz4 s THR 982 Ca 0.00 -0.92 -0.24 0.00 0.31 0.00 0.00 61.69 60.84 1jz4 s THR 982 Cb 0.00 -1.91 -0.00 0.00 0.01 0.00 0.00 72.50 70.60 1jz4 s THR 982 CO 0.00 0.54 0.83 0.26 -0.69 0.00 0.00 174.62 175.57 1jz4 s TRP 983 N 0.62 3.24 -0.18 4.92 0.52 0.44 -0.13 118.94 128.37 1jz4 s TRP 983 Ca -0.11 0.99 -0.03 0.00 0.02 0.00 0.00 56.10 56.97 1jz4 s TRP 983 Cb -0.16 -3.19 -0.02 0.00 -1.15 0.00 0.00 33.47 28.95 1jz4 s TRP 983 CO 0.03 -0.51 -0.05 -1.17 0.02 0.00 0.00 176.95 175.26 1jz4 s LEU 984 N 2.97 3.01 -0.21 2.99 2.96 -0.71 -0.18 118.68 129.51 1jz4 s LEU 984 Ca 0.35 -0.28 -0.01 0.00 -0.22 0.00 0.00 54.13 53.97 1jz4 s LEU 984 Cb -0.14 -1.74 0.02 0.00 0.50 0.00 0.00 46.19 44.83 1jz4 s LEU 984 CO 0.10 0.08 -0.12 0.20 -1.32 0.00 0.00 176.35 175.30 1jz4 s ASN 985 N 0.87 3.82 -0.18 3.68 0.01 -0.15 -2.61 114.94 120.39 1jz4 s ASN 985 Ca -0.01 -0.71 0.01 0.00 -0.71 0.00 0.00 52.86 51.44 1jz4 s ASN 985 Cb -0.15 -1.59 0.04 0.00 0.41 0.00 0.00 41.25 39.96 1jz4 s ASN 985 CO 0.01 -0.05 -0.11 -0.63 -1.51 0.00 0.00 177.10 174.81 1jz4 s ILE 986 N 1.33 1.54 -0.13 0.60 1.01 0.16 -1.59 121.20 124.12 1jz4 s ILE 986 Ca 0.03 -0.84 -0.05 0.00 0.00 0.00 0.00 60.65 59.79 1jz4 s ILE 986 Cb -0.15 -1.58 -0.04 0.00 0.01 0.00 0.00 42.46 40.71 1jz4 s ILE 986 CO -0.08 0.25 0.04 -1.81 0.00 0.00 0.00 174.94 173.34 1jz4 s ASP 987 N 1.46 5.52 0.09 3.58 1.01 0.25 0.13 116.67 128.71 1jz4 s ASP 987 Ca 0.01 0.16 -0.09 0.00 0.71 0.00 0.00 52.55 53.35 1jz4 s ASP 987 Cb -0.15 -1.75 -0.22 0.00 1.01 0.00 0.00 42.92 41.81 1jz4 s ASP 987 CO -0.09 0.31 1.18 1.23 0.21 0.00 0.00 175.17 178.01 1jz4 h GLY 988 N 5.70 0.52 -5.06 0.21 0.00 -1.10 0.24 103.07 103.58 1jz4 h GLY 988 Ca -0.46 -1.08 -0.17 0.00 0.00 0.00 0.00 47.33 45.62 1jz4 h GLY 988 CO 0.60 0.95 -0.59 -1.36 0.00 0.00 0.00 176.54 176.14 1jz4 s PHE 989 N -3.00 0.06 -0.03 5.60 0.40 -0.81 -4.69 117.98 115.51 1jz4 s PHE 989 Ca -0.07 -0.13 -0.03 0.00 -0.60 0.00 0.00 56.93 56.10 1jz4 s PHE 989 Cb 0.07 -0.06 0.01 0.00 0.51 0.00 0.00 43.02 43.55 1jz4 s PHE 989 CO 0.90 -0.18 0.09 -1.58 0.70 0.00 0.00 175.22 175.15 1jz4 s HIS 990 N -0.94 -0.10 0.63 0.36 2.46 -1.26 -0.92 115.29 115.52 1jz4 s HIS 990 Ca -0.10 0.24 -0.16 0.00 0.47 0.00 0.00 55.06 55.50 1jz4 s HIS 990 Cb -0.06 0.03 -0.01 0.00 -0.13 0.00 0.00 32.58 32.40 1jz4 s HIS 990 CO 0.00 -0.05 1.12 1.41 -2.47 0.00 0.00 174.74 174.76 1jz4 s MET 991 N 0.06 2.93 1.10 2.88 1.75 0.09 -4.80 119.30 123.31 1jz4 s MET 991 Ca -0.00 1.47 -0.15 0.00 -1.25 0.00 0.00 55.69 55.75 1jz4 s MET 991 Cb -0.01 -1.96 0.24 0.00 2.84 0.00 0.00 34.83 35.94 1jz4 s MET 991 CO 0.00 -1.16 1.09 0.20 -0.65 0.00 0.00 175.02 174.50 1jz4 s GLY 992 N -2.34 1.56 -0.08 2.11 0.00 0.22 -4.76 107.32 104.04 1jz4 s GLY 992 Ca 0.69 -0.58 0.20 0.00 0.00 0.00 0.00 44.72 45.03 1jz4 s GLY 992 CO 0.38 0.15 0.38 0.29 0.00 0.00 0.00 173.10 174.29 1jz4 n ILE 993 N -4.49 0.54 -4.38 0.90 -5.35 -1.26 -4.96 119.36 100.37 1jz4 n ILE 993 Ca 0.08 -0.63 0.00 0.00 -0.27 0.00 0.00 62.75 61.93 1jz4 n ILE 993 Cb 0.58 -0.20 0.00 0.00 -1.74 0.00 0.00 39.64 38.28 1jz4 n ILE 993 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1jz4 n GLY 994 N 1.43 -0.56 0.00 3.28 0.00 -1.26 -4.78 105.19 103.29 1jz4 n GLY 994 Ca -0.14 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.76 1jz4 n GLY 994 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jz4 n GLY 995 N 0.00 0.53 0.38 -0.02 0.00 -1.25 -0.54 105.19 104.27 1jz4 n GLY 995 Ca 0.00 0.00 0.29 0.00 0.00 0.00 0.00 46.02 46.31 1jz4 n GLY 995 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1jz4 h ASP 996 N 0.00 0.40 -5.24 1.61 3.32 -1.78 -2.05 116.42 112.68 1jz4 h ASP 996 Ca 0.00 0.18 -0.08 0.00 0.02 0.00 0.00 57.03 57.14 1jz4 h ASP 996 Cb 0.00 0.15 -0.11 0.00 0.22 0.00 0.00 39.33 39.58 1jz4 h ASP 996 CO 0.00 -0.18 -0.23 1.51 -1.72 0.00 0.00 179.24 178.62 1jz4 s ASP 997 N -4.75 -0.03 -0.20 6.45 1.47 -1.26 -4.05 116.67 114.30 1jz4 s ASP 997 Ca -0.09 -0.83 0.14 0.00 1.18 0.00 0.00 52.55 52.95 1jz4 s ASP 997 Cb 0.30 0.49 0.42 0.00 -0.34 0.00 0.00 42.92 43.79 1jz4 s ASP 997 CO 0.80 -0.97 1.30 -1.20 0.68 0.00 0.00 175.17 175.78 1jz4 n SER 998 N -0.27 2.55 -0.30 2.11 7.64 -1.26 -4.64 113.62 119.45 1jz4 n SER 998 Ca -0.06 -3.43 0.01 0.00 1.01 0.00 0.00 58.87 56.40 1jz4 n SER 998 Cb 0.63 -0.53 0.02 0.00 -1.01 0.00 0.00 64.21 63.32 1jz4 n SER 998 CO 0.00 0.00 0.00 -2.67 -3.01 0.00 0.00 175.04 169.36 1jz4 n TRP 999 N -1.10 0.00 -3.51 1.43 2.14 -1.26 -3.64 117.44 111.51 1jz4 n TRP 999 Ca 0.22 -0.17 -0.14 0.00 2.07 0.00 0.00 57.50 59.48 1jz4 n TRP 999 Cb 0.80 -0.05 -0.04 0.00 -0.81 0.00 0.00 31.31 31.20 1jz4 n TRP 999 CO 0.00 0.00 0.00 -1.54 2.07 0.00 0.00 177.69 178.22 1jz4 s SER 1000N -1.03 -0.53 0.06 -0.67 1.04 -1.26 -4.48 113.70 106.83 1jz4 s SER 1000Ca 0.04 0.21 -0.33 0.00 0.48 0.00 0.00 55.95 56.35 1jz4 s SER 1000Cb 0.04 0.54 -0.12 0.00 0.10 0.00 0.00 66.02 66.58 1jz4 s SER 1000CO 0.00 -0.80 1.77 -2.65 0.98 0.00 0.00 173.24 172.54 1jz4 n PRO 1001N 0.19 2.37 0.00 4.02 -0.02 -1.26 -4.81 135.00 135.48 1jz4 n PRO 1001Ca -0.18 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 1jz4 n PRO 1001Cb 0.62 -2.70 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 1jz4 n PRO 1001CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1jz4 n SER 1002N 5.26 0.83 -4.65 2.55 3.41 -1.26 -5.00 113.62 114.76 1jz4 n SER 1002Ca 0.19 -1.36 -0.43 0.00 -0.26 0.00 0.00 58.87 57.02 1jz4 n SER 1002Cb 0.32 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.24 1jz4 n SER 1002CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1jz4 s VAL 1003N -0.36 4.72 0.67 -3.33 1.01 -1.26 -4.38 120.40 117.48 1jz4 s VAL 1003Ca 0.00 1.80 -0.17 0.00 0.00 0.00 0.00 61.98 63.61 1jz4 s VAL 1003Cb 0.00 -4.25 -0.01 0.00 0.00 0.00 0.00 36.38 32.12 1jz4 s VAL 1003CO 0.00 -0.18 1.05 -0.24 0.00 0.00 0.00 175.10 175.73 1jz4 n SER 1004N 6.26 0.94 -0.29 3.32 2.88 -1.26 -4.83 113.62 120.64 1jz4 n SER 1004Ca 0.09 0.74 0.08 0.00 -1.33 0.00 0.00 58.87 58.46 1jz4 n SER 1004Cb 0.47 -1.44 0.30 0.00 -0.75 0.00 0.00 64.21 62.79 1jz4 n SER 1004CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1jz4 h ALA 1005N 0.13 1.65 0.00 -1.46 0.00 -1.97 0.20 119.26 117.81 1jz4 h ALA 1005Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1jz4 h ALA 1005Cb 1.35 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1jz4 h ALA 1005CO 0.49 0.16 0.00 -0.85 0.00 0.00 0.00 179.25 179.05 1jz4 n GLU 1006N -4.54 0.21 -0.11 0.00 0.00 -1.26 -1.77 120.64 113.18 1jz4 n GLU 1006Ca 0.16 0.14 0.04 0.00 0.00 0.00 0.00 57.16 57.50 1jz4 n GLU 1006Cb 0.33 -1.50 0.10 0.00 0.00 0.00 0.00 31.44 30.37 1jz4 n GLU 1006CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 1jz4 n PHE 1007N -1.23 0.28 -3.21 -1.84 3.01 0.70 -4.98 117.46 110.19 1jz4 n PHE 1007Ca 0.06 -0.42 -0.38 0.00 1.01 0.00 0.00 57.45 57.72 1jz4 n PHE 1007Cb 0.09 -0.03 -0.06 0.00 -0.01 0.00 0.00 39.48 39.47 1jz4 n PHE 1007CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 1jz4 s GLN 1008N -0.95 4.25 -1.33 -1.08 -0.21 -0.73 -0.61 119.66 119.01 1jz4 s GLN 1008Ca 0.16 0.80 -0.16 0.00 0.02 0.00 0.00 55.36 56.17 1jz4 s GLN 1008Cb 0.08 -3.18 0.02 0.00 1.00 0.00 0.00 33.01 30.93 1jz4 s GLN 1008CO 0.11 0.59 2.04 1.28 -2.12 0.00 0.00 175.29 177.19 1jz4 n LEU 1009N 1.51 5.82 -0.66 2.90 4.77 -1.26 -4.69 117.00 125.40 1jz4 n LEU 1009Ca -0.08 -3.89 0.06 0.00 -0.03 0.00 0.00 56.01 52.06 1jz4 n LEU 1009Cb 0.50 -1.63 0.16 0.00 -2.33 0.00 0.00 43.42 40.12 1jz4 n LEU 1009CO 0.42 0.53 0.63 -1.54 -1.33 0.00 0.00 177.39 176.10 1jz4 n SER 1010N 7.33 2.98 0.30 -1.43 3.41 -1.26 -4.28 113.62 120.66 1jz4 n SER 1010Ca 0.51 -2.03 0.20 0.00 -0.26 0.00 0.00 58.87 57.28 1jz4 n SER 1010Cb 0.42 -0.25 0.92 0.00 -0.26 0.00 0.00 64.21 65.04 1jz4 n SER 1010CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1jz4 h ALA 1011N 2.05 1.00 0.00 7.33 0.00 -1.98 -3.46 119.26 124.20 1jz4 h ALA 1011Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1jz4 h ALA 1011Cb 0.76 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1jz4 h ALA 1011CO 0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.67 1jz4 n GLY 1012N -0.49 2.02 3.31 0.00 0.00 -1.26 -4.90 105.19 103.86 1jz4 n GLY 1012Ca -0.01 -0.31 -0.32 0.00 0.00 0.00 0.00 46.02 45.38 1jz4 n GLY 1012CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1jz4 s ARG 1013N 0.00 2.97 -0.04 1.61 0.52 -1.26 -0.44 118.95 122.31 1jz4 s ARG 1013Ca 0.00 -0.81 0.02 0.00 -0.52 0.00 0.00 55.73 54.42 1jz4 s ARG 1013Cb 0.00 -2.38 0.01 0.00 0.52 0.00 0.00 34.95 33.11 1jz4 s ARG 1013CO 0.00 0.29 -0.07 0.71 0.02 0.00 0.00 175.30 176.25 1jz4 s TYR 1014N 0.11 0.84 -0.01 -0.53 1.51 0.34 -4.98 117.35 114.62 1jz4 s TYR 1014Ca -0.09 -0.23 0.07 0.00 -1.01 0.00 0.00 57.07 55.80 1jz4 s TYR 1014Cb -0.16 -0.67 -0.02 0.00 -0.11 0.00 0.00 41.96 41.00 1jz4 s TYR 1014CO 0.06 -0.15 -0.22 -1.58 -1.11 0.00 0.00 175.55 172.54 1jz4 s HIS 1015N 0.59 2.44 -0.09 2.71 2.46 -1.26 -0.21 115.29 121.93 1jz4 s HIS 1015Ca -0.09 -0.35 -0.30 0.00 0.47 0.00 0.00 55.06 54.79 1jz4 s HIS 1015Cb -0.12 -1.52 0.12 0.00 -0.13 0.00 0.00 32.58 30.93 1jz4 s HIS 1015CO 0.01 0.06 0.97 1.52 -2.47 0.00 0.00 174.74 174.83 1jz4 s TYR 1016N -0.69 -0.33 0.01 3.88 -0.85 -0.49 -5.00 117.35 113.89 1jz4 s TYR 1016Ca 0.11 0.35 -0.17 0.00 -0.52 0.00 0.00 57.07 56.84 1jz4 s TYR 1016Cb -0.10 0.50 0.03 0.00 0.38 0.00 0.00 41.96 42.77 1jz4 s TYR 1016CO 0.00 -0.42 0.37 1.14 -1.52 0.00 0.00 175.55 175.12 1jz4 s GLN 1017N -2.25 0.79 0.02 -3.49 -2.07 -1.26 0.11 119.66 111.50 1jz4 s GLN 1017Ca 0.03 -0.24 -0.10 0.00 -1.82 0.00 0.00 55.36 53.23 1jz4 s GLN 1017Cb -0.01 0.35 0.01 0.00 -1.09 0.00 0.00 33.01 32.27 1jz4 s GLN 1017CO -0.04 -0.24 0.20 -0.51 -1.32 0.00 0.00 175.29 173.37 1jz4 s LEU 1018N -1.60 1.34 -0.20 2.60 1.43 -0.28 -4.43 118.68 117.55 1jz4 s LEU 1018Ca -0.10 -0.22 0.01 0.00 -1.03 0.00 0.00 54.13 52.79 1jz4 s LEU 1018Cb -0.03 0.91 0.02 0.00 0.03 0.00 0.00 46.19 47.13 1jz4 s LEU 1018CO 0.02 -0.47 -0.17 -0.69 0.23 0.00 0.00 176.35 175.28 1jz4 s VAL 1019N -1.88 2.22 -0.21 -1.59 1.01 -0.51 0.21 120.40 119.65 1jz4 s VAL 1019Ca -0.10 -1.00 -0.06 0.00 0.00 0.00 0.00 61.98 60.82 1jz4 s VAL 1019Cb -0.04 -2.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.31 1jz4 s VAL 1019CO -0.00 0.44 0.04 0.86 0.00 0.00 0.00 175.10 176.43 1jz4 s TRP 1020N 1.28 3.11 0.29 5.22 -0.11 -0.65 0.77 118.94 128.84 1jz4 s TRP 1020Ca 0.03 -0.29 -0.03 0.00 1.22 0.00 0.00 56.10 57.03 1jz4 s TRP 1020Cb -0.14 -2.12 -0.01 0.00 -1.50 0.00 0.00 33.47 29.69 1jz4 s TRP 1020CO -0.11 -0.16 0.37 0.00 -4.62 0.00 0.00 176.95 172.44 1jz4 s GLN 1022N -3.58 2.66 0.00 0.00 0.74 -1.26 -1.02 119.66 117.20 1jz4 s GLN 1022Ca 0.32 -0.76 0.00 0.00 0.05 0.00 0.00 55.36 54.96 1jz4 s GLN 1022Cb 0.02 -2.35 0.00 0.00 1.10 0.00 0.00 33.01 31.78 1jz4 s GLN 1022CO 0.17 0.48 0.00 1.63 -0.55 0.00 0.00 175.29 177.01