#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jhz s SER 61 N 0.00 2.99 -0.04 4.39 0.15 -1.26 -0.81 113.70 119.12 1jhz s SER 61 Ca 0.00 -0.46 0.04 0.00 0.70 0.00 0.00 55.95 56.23 1jhz s SER 61 Cb 0.00 -0.38 -0.00 0.00 -1.71 0.00 0.00 66.02 63.92 1jhz s SER 61 CO 0.00 0.31 -0.16 -0.63 1.20 0.00 0.00 173.24 173.95 1jhz s ILE 62 N -0.55 1.36 -0.10 6.45 -1.09 0.12 -1.79 121.20 125.60 1jhz s ILE 62 Ca 0.08 -0.68 -0.04 0.00 -2.23 0.00 0.00 60.65 57.79 1jhz s ILE 62 Cb -0.10 -1.17 -0.04 0.00 -1.58 0.00 0.00 42.46 39.57 1jhz s ILE 62 CO -0.01 0.39 0.05 -0.83 -1.23 0.00 0.00 174.94 173.32 1jhz s GLY 63 N 0.07 1.97 -0.20 6.18 0.00 -0.34 -0.55 107.32 114.45 1jhz s GLY 63 Ca -0.04 -0.74 -0.01 0.00 0.00 0.00 0.00 44.72 43.93 1jhz s GLY 63 CO 0.02 -0.50 -0.02 -2.27 0.00 0.00 0.00 173.10 170.33 1jhz s LEU 64 N -0.95 1.82 -0.30 0.66 2.96 -0.61 0.23 118.68 122.49 1jhz s LEU 64 Ca 0.14 -0.91 -0.07 0.00 -0.22 0.00 0.00 54.13 53.07 1jhz s LEU 64 Cb -0.12 -0.90 0.01 0.00 0.50 0.00 0.00 46.19 45.68 1jhz s LEU 64 CO 0.03 -0.25 0.10 -0.22 -1.32 0.00 0.00 176.35 174.69 1jhz s LEU 65 N 1.62 3.96 0.07 -0.68 2.96 -0.33 -2.35 118.68 123.94 1jhz s LEU 65 Ca -0.02 -0.73 0.04 0.00 -0.22 0.00 0.00 54.13 53.19 1jhz s LEU 65 Cb -0.17 -1.90 -0.03 0.00 0.50 0.00 0.00 46.19 44.58 1jhz s LEU 65 CO -0.07 -0.21 -0.11 0.00 -1.32 0.00 0.00 176.35 174.64 1jhz s ALA 66 N 1.51 0.97 0.07 5.97 0.00 -0.92 -3.03 121.76 126.32 1jhz s ALA 66 Ca 0.02 -1.01 -0.28 0.00 0.00 0.00 0.00 51.96 50.70 1jhz s ALA 66 Cb -0.17 -0.01 -0.17 0.00 0.00 0.00 0.00 23.12 22.77 1jhz s ALA 66 CO 0.03 0.03 1.60 1.15 0.00 0.00 0.00 175.76 178.57 1jhz h THR 67 N 4.06 0.65 -2.47 0.00 2.02 -1.88 -1.87 112.91 113.42 1jhz h THR 67 Ca -0.38 -0.12 -0.25 0.00 0.77 0.00 0.00 66.41 66.43 1jhz h THR 67 Cb 1.19 0.71 -0.33 0.00 -1.74 0.00 0.00 68.15 67.98 1jhz h THR 67 CO 0.45 0.02 -0.56 -0.55 0.37 0.00 0.00 175.52 175.25 1jhz s SER 68 N -4.81 0.82 0.05 4.18 0.15 -1.26 -2.97 113.70 109.84 1jhz s SER 68 Ca -0.15 0.12 -0.19 0.00 0.70 0.00 0.00 55.95 56.42 1jhz s SER 68 Cb 0.04 0.65 -0.14 0.00 -1.71 0.00 0.00 66.02 64.86 1jhz s SER 68 CO 0.62 -0.30 1.33 -1.28 1.20 0.00 0.00 173.24 174.82 1jhz h SER 69 N 8.27 0.46 0.00 5.45 0.87 -1.97 -2.91 113.55 123.73 1jhz h SER 69 Ca -0.17 -0.51 0.00 0.00 -1.23 0.00 0.00 61.79 59.88 1jhz h SER 69 Cb 1.14 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.97 1jhz h SER 69 CO 0.24 0.87 0.00 -0.62 -0.53 0.00 0.00 176.83 176.79 1jhz n GLU 70 N -4.47 0.65 -1.90 2.24 4.71 -1.26 -3.21 120.64 117.39 1jhz n GLU 70 Ca -0.06 0.00 -0.41 0.00 -0.01 0.00 0.00 57.16 56.68 1jhz n GLU 70 Cb 0.41 -1.46 -0.02 0.00 -1.01 0.00 0.00 31.44 29.37 1jhz n GLU 70 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1jhz s ALA 71 N -2.00 3.64 0.15 0.62 0.00 -1.10 -4.81 121.76 118.27 1jhz s ALA 71 Ca 0.29 1.45 -0.30 0.00 0.00 0.00 0.00 51.96 53.40 1jhz s ALA 71 Cb 0.13 -3.59 -0.05 0.00 0.00 0.00 0.00 23.12 19.62 1jhz s ALA 71 CO 0.22 -0.87 1.55 0.00 0.00 0.00 0.00 175.76 176.66 1jhz h ALA 72 N 4.35 -0.56 0.59 0.00 0.00 -1.90 0.14 119.26 121.87 1jhz h ALA 72 Ca -0.48 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 1jhz h ALA 72 Cb 1.22 1.17 -0.00 0.00 0.00 0.00 0.00 17.79 20.18 1jhz h ALA 72 CO 0.74 -0.96 -0.35 -0.92 0.00 0.00 0.00 179.25 177.76 1jhz h TYR 73 N -0.22 -0.93 -0.12 0.00 3.20 -1.96 -3.29 116.97 113.65 1jhz h TYR 73 Ca 0.14 -0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.88 1jhz h TYR 73 Cb 0.53 0.33 -0.01 0.00 1.54 0.00 0.00 36.73 39.12 1jhz h TYR 73 CO -0.83 -0.54 -0.43 0.74 -1.64 0.00 0.00 178.16 175.46 1jhz h PHE 74 N -0.89 0.33 -0.86 -3.82 0.04 -1.84 -3.33 116.94 106.57 1jhz h PHE 74 Ca -0.07 -0.09 0.20 0.00 2.80 0.00 0.00 57.97 60.81 1jhz h PHE 74 Cb 0.72 -0.07 -0.16 0.00 2.20 0.00 0.00 35.95 38.64 1jhz h PHE 74 CO -0.09 0.67 -0.04 0.00 -0.60 0.00 0.00 178.31 178.25 1jhz h ALA 75 N 1.32 0.86 0.00 2.45 0.00 -0.69 0.28 119.26 123.47 1jhz h ALA 75 Ca 0.02 0.30 -0.08 0.00 0.00 0.00 0.00 54.91 55.14 1jhz h ALA 75 Cb 0.86 0.53 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 1jhz h ALA 75 CO 0.07 -0.46 -0.40 0.93 0.00 0.00 0.00 179.25 179.39 1jhz h GLU 76 N 0.05 0.00 0.02 0.00 5.08 -1.73 -2.34 114.58 115.66 1jhz h GLU 76 Ca 0.48 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.74 1jhz h GLU 76 Cb 0.87 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.12 1jhz h GLU 76 CO -0.80 0.40 -0.37 0.82 -1.00 0.00 0.00 179.01 178.05 1jhz h ILE 77 N 0.00 1.54 -0.88 3.13 2.04 -0.77 -3.02 117.51 119.55 1jhz h ILE 77 Ca -0.00 -2.10 0.07 0.00 1.00 0.00 0.00 64.86 63.83 1jhz h ILE 77 Cb 0.71 2.86 -0.07 0.00 -0.74 0.00 0.00 36.82 39.59 1jhz h ILE 77 CO 0.05 0.58 0.54 0.40 0.00 0.00 0.00 178.15 179.73 1jhz h ILE 78 N -0.46 1.02 -0.53 -0.67 2.04 -0.78 -1.10 117.51 117.03 1jhz h ILE 78 Ca -0.05 -0.33 -0.06 0.00 1.00 0.00 0.00 64.86 65.42 1jhz h ILE 78 Cb 1.16 -0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 1jhz h ILE 78 CO 0.07 0.18 0.10 -0.33 0.00 0.00 0.00 178.15 178.17 1jhz h GLU 79 N 0.97 0.83 -0.76 2.37 5.08 -1.48 -0.49 114.58 121.10 1jhz h GLU 79 Ca 0.39 -0.18 -0.04 0.00 -1.00 0.00 0.00 59.36 58.53 1jhz h GLU 79 Cb 0.22 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 1jhz h GLU 79 CO -0.19 0.77 0.31 0.00 -1.00 0.00 0.00 179.01 178.90 1jhz h ALA 80 N 1.32 0.98 0.13 3.43 0.00 -1.10 -1.07 119.26 122.96 1jhz h ALA 80 Ca 0.17 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1jhz h ALA 80 Cb 0.34 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1jhz h ALA 80 CO 0.00 0.60 -0.06 0.28 0.00 0.00 0.00 179.25 180.07 1jhz h VAL 81 N 1.09 0.94 -0.48 0.00 2.07 -0.69 -1.49 116.25 117.69 1jhz h VAL 81 Ca 0.25 -0.30 0.09 0.00 0.82 0.00 0.00 66.70 67.56 1jhz h VAL 81 Cb 0.20 1.13 -0.08 0.00 -1.52 0.00 0.00 31.29 31.03 1jhz h VAL 81 CO -0.02 0.07 -0.02 -0.33 0.02 0.00 0.00 177.57 177.30 1jhz h GLU 82 N -0.32 0.10 -0.53 1.57 5.08 -0.90 0.49 114.58 120.06 1jhz h GLU 82 Ca -0.02 -0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.39 1jhz h GLU 82 Cb 0.26 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.44 1jhz h GLU 82 CO 0.03 0.06 0.25 -0.22 -1.00 0.00 0.00 179.01 178.14 1jhz h LYS 83 N 0.10 0.47 -0.11 2.33 3.64 -1.06 -1.59 116.57 120.34 1jhz h LYS 83 Ca 0.24 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.49 1jhz h LYS 83 Cb 0.36 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 1jhz h LYS 83 CO -0.41 0.31 -0.37 -0.91 -2.27 0.00 0.00 179.45 175.81 1jhz h ASN 84 N 0.49 0.24 0.69 4.20 2.35 -0.17 -2.20 115.58 121.17 1jhz h ASN 84 Ca 0.24 -0.09 -0.03 0.00 -0.55 0.00 0.00 56.30 55.86 1jhz h ASN 84 Cb 0.17 -0.07 0.01 0.00 0.05 0.00 0.00 38.32 38.48 1jhz h ASN 84 CO -0.18 0.59 -0.33 0.00 -1.65 0.00 0.00 177.43 175.86 1jhz h PHE 86 N -1.00 0.58 -0.89 0.00 0.04 -1.32 -1.25 116.94 113.10 1jhz h PHE 86 Ca -0.09 0.01 0.08 0.00 2.80 0.00 0.00 57.97 60.76 1jhz h PHE 86 Cb 0.73 -0.20 -0.06 0.00 2.20 0.00 0.00 35.95 38.62 1jhz h PHE 86 CO -0.01 0.38 0.57 0.37 -0.60 0.00 0.00 178.31 179.02 1jhz h GLN 87 N 0.62 0.92 -0.02 1.51 5.75 -1.19 -1.21 115.11 121.49 1jhz h GLN 87 Ca 0.17 -0.06 0.00 0.00 -0.15 0.00 0.00 58.65 58.61 1jhz h GLN 87 Cb -0.05 -0.21 0.00 0.00 1.07 0.00 0.00 27.48 28.29 1jhz h GLN 87 CO -0.03 0.61 -0.14 1.63 -2.65 0.00 0.00 178.83 178.25 1jhz n LYS 88 N -4.51 1.48 -0.83 1.69 5.02 -0.63 -4.95 118.16 115.43 1jhz n LYS 88 Ca 0.14 -1.00 0.00 0.00 -2.02 0.00 0.00 58.31 55.44 1jhz n LYS 88 Cb 0.25 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 1jhz n LYS 88 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1jhz n GLY 89 N 1.28 0.60 3.85 0.72 0.00 -0.46 -5.01 105.19 106.18 1jhz n GLY 89 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 1jhz n GLY 89 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1jhz s TYR 90 N -2.08 3.07 0.14 1.61 1.51 -0.57 -4.66 117.35 116.36 1jhz s TYR 90 Ca 0.00 1.07 0.06 0.00 -1.01 0.00 0.00 57.07 57.18 1jhz s TYR 90 Cb 0.00 -3.13 -0.04 0.00 -0.11 0.00 0.00 41.96 38.68 1jhz s TYR 90 CO 0.00 -1.50 0.04 0.99 -1.11 0.00 0.00 175.55 173.98 1jhz s THR 91 N -3.28 4.10 -0.07 -0.71 2.01 0.01 -4.33 115.64 113.37 1jhz s THR 91 Ca 0.60 -1.14 0.04 0.00 0.31 0.00 0.00 61.69 61.50 1jhz s THR 91 Cb -0.13 -3.03 -0.00 0.00 0.01 0.00 0.00 72.50 69.35 1jhz s THR 91 CO 0.53 -0.02 -0.20 -0.22 -0.69 0.00 0.00 174.62 174.01 1jhz s LEU 92 N -2.74 1.96 -0.30 4.42 0.20 -1.26 0.12 118.68 121.09 1jhz s LEU 92 Ca 0.28 -0.45 -0.03 0.00 0.69 0.00 0.00 54.13 54.63 1jhz s LEU 92 Cb -0.10 -1.18 0.04 0.00 -0.43 0.00 0.00 46.19 44.52 1jhz s LEU 92 CO 0.20 0.16 0.01 -0.63 -0.29 0.00 0.00 176.35 175.80 1jhz s ILE 93 N 0.16 3.17 -0.17 6.68 1.01 0.29 -4.94 121.20 127.40 1jhz s ILE 93 Ca -0.10 -1.22 -0.13 0.00 0.00 0.00 0.00 60.65 59.21 1jhz s ILE 93 Cb -0.15 -2.76 -0.05 0.00 0.01 0.00 0.00 42.46 39.51 1jhz s ILE 93 CO 0.05 -0.05 0.24 -0.76 0.00 0.00 0.00 174.94 174.42 1jhz s LEU 94 N 1.31 4.23 -0.13 2.97 1.43 -1.26 -1.57 118.68 125.66 1jhz s LEU 94 Ca -0.03 0.41 -0.04 0.00 -1.03 0.00 0.00 54.13 53.44 1jhz s LEU 94 Cb -0.19 -2.28 0.05 0.00 0.03 0.00 0.00 46.19 43.80 1jhz s LEU 94 CO -0.01 0.13 0.07 -0.83 0.23 0.00 0.00 176.35 175.94 1jhz s GLY 95 N 0.44 0.35 -0.52 -3.19 0.00 -0.99 -5.01 107.32 98.39 1jhz s GLY 95 Ca 0.14 -0.19 -0.17 0.00 0.00 0.00 0.00 44.72 44.50 1jhz s GLY 95 CO 0.02 1.57 0.52 -1.31 0.00 0.00 0.00 173.10 173.90 1jhz s ASN 96 N 2.11 6.18 0.02 1.64 0.02 -1.26 -2.18 114.94 121.48 1jhz s ASN 96 Ca 0.03 -1.44 -0.25 0.00 -1.02 0.00 0.00 52.86 50.18 1jhz s ASN 96 Cb -0.15 -2.23 -0.18 0.00 0.02 0.00 0.00 41.25 38.72 1jhz s ASN 96 CO -0.07 -0.84 1.39 0.00 0.02 0.00 0.00 177.10 177.61 1jhz h ALA 97 N 8.91 -0.16 -0.56 0.60 0.00 -1.52 -3.48 119.26 123.05 1jhz h ALA 97 Ca -0.29 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 1jhz h ALA 97 Cb 1.10 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1jhz h ALA 97 CO 0.99 -0.44 -0.01 0.91 0.00 0.00 0.00 179.25 180.70 1jhz n TRP 98 N -5.02 -0.03 -0.89 0.00 8.01 -1.16 -4.02 117.44 114.33 1jhz n TRP 98 Ca -0.09 0.01 0.00 0.00 -1.31 0.00 0.00 57.50 56.11 1jhz n TRP 98 Cb 0.20 -1.05 0.00 0.00 -2.01 0.00 0.00 31.31 28.45 1jhz n TRP 98 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.69 176.77 1jhz n ASN 99 N 1.69 -1.64 -4.48 -0.99 5.03 -1.26 -4.99 115.26 108.62 1jhz n ASN 99 Ca -0.00 0.00 -0.43 0.00 0.87 0.00 0.00 54.58 55.01 1jhz n ASN 99 Cb 0.50 -1.16 -0.07 0.00 -1.02 0.00 0.00 39.78 38.04 1jhz n ASN 99 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 1jhz s ASN 100 N -2.38 6.25 0.48 6.41 3.84 -1.26 -4.92 114.94 123.36 1jhz s ASN 100 Ca 0.00 -0.69 0.35 0.00 0.21 0.00 0.00 52.86 52.73 1jhz s ASN 100 Cb 0.00 -2.29 1.49 0.00 -0.55 0.00 0.00 41.25 39.90 1jhz s ASN 100 CO 0.00 -0.80 1.66 0.25 -2.79 0.00 0.00 177.10 175.42 1jhz h LEU 101 N 9.59 0.16 -0.06 3.21 7.12 -1.94 0.20 115.31 133.59 1jhz h LEU 101 Ca -0.27 0.07 -0.04 0.00 0.13 0.00 0.00 57.88 57.78 1jhz h LEU 101 Cb 1.10 0.06 -0.00 0.00 -0.53 0.00 0.00 40.66 41.29 1jhz h LEU 101 CO 0.91 -0.07 -0.10 -0.33 -0.13 0.00 0.00 178.44 178.71 1jhz h GLU 102 N 0.08 0.18 0.38 1.25 4.39 -1.98 -2.33 114.58 116.54 1jhz h GLU 102 Ca 0.78 -0.11 -0.02 0.00 0.34 0.00 0.00 59.36 60.35 1jhz h GLU 102 Cb 2.69 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 31.36 1jhz h GLU 102 CO -0.23 0.68 -0.18 -0.22 -1.16 0.00 0.00 179.01 177.90 1jhz h LYS 103 N -0.30 -0.49 -0.97 2.33 3.64 -0.98 -0.48 116.57 119.31 1jhz h LYS 103 Ca 0.00 0.03 0.12 0.00 -1.27 0.00 0.00 60.65 59.54 1jhz h LYS 103 Cb 0.66 0.11 -0.08 0.00 -0.41 0.00 0.00 32.23 32.52 1jhz h LYS 103 CO 0.02 -0.18 0.62 1.96 -2.27 0.00 0.00 179.45 179.60 1jhz h GLN 104 N -0.81 0.91 -0.27 1.90 4.20 -1.41 0.45 115.11 120.08 1jhz h GLN 104 Ca -0.05 -0.05 -0.10 0.00 0.06 0.00 0.00 58.65 58.51 1jhz h GLN 104 Cb 0.53 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 1jhz h GLN 104 CO 0.08 0.60 -0.24 -0.09 -0.67 0.00 0.00 178.83 178.52 1jhz h ARG 105 N 0.94 0.52 -0.06 1.46 2.43 -1.32 -0.67 114.38 117.68 1jhz h ARG 105 Ca 0.47 -0.19 -0.23 0.00 -0.81 0.00 0.00 59.98 59.23 1jhz h ARG 105 Cb 0.50 -0.03 0.01 0.00 -0.42 0.00 0.00 29.97 30.03 1jhz h ARG 105 CO -0.24 0.72 -0.87 0.00 -1.51 0.00 0.00 179.97 178.07 1jhz h ALA 106 N 1.29 0.35 -0.20 2.80 0.00 0.78 -2.75 119.26 121.52 1jhz h ALA 106 Ca 0.07 -0.65 -0.00 0.00 0.00 0.00 0.00 54.91 54.32 1jhz h ALA 106 Cb 0.66 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1jhz h ALA 106 CO 0.05 0.74 0.12 1.88 0.00 0.00 0.00 179.25 182.04 1jhz h TYR 107 N 0.37 0.26 -0.62 0.00 0.05 0.09 -2.39 116.97 114.72 1jhz h TYR 107 Ca -0.07 0.00 0.05 0.00 0.05 0.00 0.00 58.73 58.76 1jhz h TYR 107 Cb 1.50 -0.09 -0.05 0.00 1.01 0.00 0.00 36.73 39.10 1jhz h TYR 107 CO 0.07 0.20 0.34 -0.07 -1.05 0.00 0.00 178.16 177.65 1jhz h LEU 108 N 0.25 0.51 -0.22 3.88 4.07 -1.12 -1.47 115.31 121.20 1jhz h LEU 108 Ca 0.07 0.03 -0.00 0.00 0.08 0.00 0.00 57.88 58.06 1jhz h LEU 108 Cb 0.01 -0.07 -0.01 0.00 1.08 0.00 0.00 40.66 41.67 1jhz h LEU 108 CO -0.01 0.34 0.12 -1.28 -1.08 0.00 0.00 178.44 176.52 1jhz h SER 109 N 0.64 0.26 -0.29 -0.43 0.87 -1.28 -2.54 113.55 110.79 1jhz h SER 109 Ca 0.27 -0.07 -0.05 0.00 -1.23 0.00 0.00 61.79 60.71 1jhz h SER 109 Cb 0.16 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.03 1jhz h SER 109 CO -0.17 0.26 0.02 0.00 -0.53 0.00 0.00 176.83 176.41 1jhz h MET 110 N 0.25 0.61 0.00 2.24 -0.00 -1.18 -1.68 114.93 115.17 1jhz h MET 110 Ca 0.08 -0.13 -0.08 0.00 -0.00 0.00 0.00 59.70 59.57 1jhz h MET 110 Cb 0.05 -0.09 -0.01 0.00 -0.00 0.00 0.00 31.60 31.55 1jhz h MET 110 CO -0.01 0.62 -0.36 0.52 -0.00 0.00 0.00 176.91 177.67 1jhz h MET 111 N 0.58 0.00 0.01 -0.10 2.07 -1.05 0.61 114.93 117.05 1jhz h MET 111 Ca 0.12 0.00 -0.24 0.00 -2.07 0.00 0.00 59.70 57.51 1jhz h MET 111 Cb 0.34 0.00 0.01 0.00 -1.87 0.00 0.00 31.60 30.08 1jhz h MET 111 CO 0.01 0.36 -0.99 0.00 1.07 0.00 0.00 176.91 177.36 1jhz h ALA 112 N 1.64 0.27 0.21 6.32 0.00 -1.02 -2.42 119.26 124.25 1jhz h ALA 112 Ca -0.00 -0.71 -0.01 0.00 0.00 0.00 0.00 54.91 54.19 1jhz h ALA 112 Cb 0.67 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 1jhz h ALA 112 CO 0.05 0.78 -0.11 1.96 0.00 0.00 0.00 179.25 181.92 1jhz h GLN 113 N 0.28 -0.29 0.00 0.00 4.20 -0.76 0.75 115.11 119.30 1jhz h GLN 113 Ca -0.10 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.63 1jhz h GLN 113 Cb 1.64 0.07 0.00 0.00 0.30 0.00 0.00 27.48 29.48 1jhz h GLN 113 CO 0.18 -0.19 0.00 1.63 -0.67 0.00 0.00 178.83 179.78 1jhz n LYS 114 N -5.23 0.23 -3.94 1.46 4.76 0.16 -4.86 118.16 110.74 1jhz n LYS 114 Ca -0.09 0.03 -0.25 0.00 -2.87 0.00 0.00 58.31 55.13 1jhz n LYS 114 Cb 0.15 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 31.82 1jhz n LYS 114 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1jhz n ARG 115 N -1.04 -3.44 -1.76 1.97 5.12 0.26 -4.91 116.66 112.86 1jhz n ARG 115 Ca 0.06 0.42 -0.38 0.00 -1.93 0.00 0.00 57.85 56.02 1jhz n ARG 115 Cb 0.03 -4.61 0.05 0.00 -1.16 0.00 0.00 32.46 26.77 1jhz n ARG 115 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1jhz s VAL 116 N -3.91 2.03 -0.28 1.55 -7.23 -0.96 -4.92 120.40 106.68 1jhz s VAL 116 Ca 0.04 0.02 0.23 0.00 -1.81 0.00 0.00 61.98 60.46 1jhz s VAL 116 Cb -0.02 -3.01 0.29 0.00 0.56 0.00 0.00 36.38 34.20 1jhz s VAL 116 CO 0.88 -0.00 1.64 0.44 -0.31 0.00 0.00 175.10 177.75 1jhz h ASP 117 N 1.25 0.00 -5.01 4.85 5.19 -1.71 -3.47 116.42 117.53 1jhz h ASP 117 Ca -0.51 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 55.85 1jhz h ASP 117 Cb 1.31 0.00 -0.16 0.00 0.18 0.00 0.00 39.33 40.66 1jhz h ASP 117 CO 0.56 0.11 0.13 -0.83 -3.12 0.00 0.00 179.24 176.10 1jhz s GLY 118 N -4.26 -0.53 -0.09 2.75 0.00 -1.23 -4.41 107.32 99.56 1jhz s GLY 118 Ca 0.05 0.76 0.01 0.00 0.00 0.00 0.00 44.72 45.55 1jhz s GLY 118 CO 0.67 0.44 -0.12 -2.27 0.00 0.00 0.00 173.10 171.81 1jhz s LEU 119 N -2.00 1.55 -0.22 0.66 0.20 0.68 -1.20 118.68 118.35 1jhz s LEU 119 Ca -0.05 -0.33 -0.05 0.00 0.69 0.00 0.00 54.13 54.40 1jhz s LEU 119 Cb -0.01 -0.89 -0.01 0.00 -0.43 0.00 0.00 46.19 44.85 1jhz s LEU 119 CO -0.02 -0.01 -0.01 -0.22 -0.29 0.00 0.00 176.35 175.80 1jhz s LEU 120 N 0.99 3.06 -0.07 -0.68 0.20 0.14 -1.41 118.68 120.90 1jhz s LEU 120 Ca -0.08 -0.32 0.05 0.00 0.69 0.00 0.00 54.13 54.46 1jhz s LEU 120 Cb -0.15 -1.79 -0.00 0.00 -0.43 0.00 0.00 46.19 43.82 1jhz s LEU 120 CO -0.00 -0.01 -0.22 -0.69 -0.29 0.00 0.00 176.35 175.13 1jhz s VAL 121 N 1.43 1.87 -0.31 1.68 1.01 0.12 -1.18 120.40 125.03 1jhz s VAL 121 Ca 0.05 -0.95 0.03 0.00 0.00 0.00 0.00 61.98 61.11 1jhz s VAL 121 Cb -0.14 -1.61 0.16 0.00 0.00 0.00 0.00 36.38 34.79 1jhz s VAL 121 CO -0.01 0.52 0.42 0.00 0.00 0.00 0.00 175.10 176.04 1jhz s MET 122 N 0.09 0.48 0.38 2.72 0.23 -1.17 -0.28 119.30 121.75 1jhz s MET 122 Ca -0.09 -0.03 0.08 0.00 -1.03 0.00 0.00 55.69 54.62 1jhz s MET 122 Cb -0.15 -0.32 -0.05 0.00 -1.53 0.00 0.00 34.83 32.78 1jhz s MET 122 CO 0.05 -1.07 0.13 0.00 -2.03 0.00 0.00 175.02 172.10 1jhz h SER 124 N 1.55 0.32 -5.05 0.00 4.64 -1.99 -3.44 113.55 109.59 1jhz h SER 124 Ca -0.43 -0.21 -0.10 0.00 -0.47 0.00 0.00 61.79 60.59 1jhz h SER 124 Cb 1.25 -0.09 -0.17 0.00 -0.31 0.00 0.00 62.40 63.08 1jhz h SER 124 CO 0.68 0.92 -0.26 -1.83 -0.87 0.00 0.00 176.83 175.47 1jhz s GLU 125 N -3.60 0.79 -0.49 4.77 -1.05 -1.26 -4.89 118.70 112.97 1jhz s GLU 125 Ca -0.04 -0.47 0.03 0.00 -0.15 0.00 0.00 54.97 54.34 1jhz s GLU 125 Cb 0.11 0.34 0.13 0.00 -0.44 0.00 0.00 34.13 34.27 1jhz s GLU 125 CO 0.81 -0.25 0.25 0.71 0.95 0.00 0.00 175.26 177.74 1jhz s TYR 126 N -2.40 2.76 0.54 4.83 2.02 -1.26 -5.09 117.35 118.75 1jhz s TYR 126 Ca -0.06 -2.92 -0.19 0.00 -0.37 0.00 0.00 57.07 53.53 1jhz s TYR 126 Cb -0.01 -2.49 -0.06 0.00 -0.40 0.00 0.00 41.96 38.99 1jhz s TYR 126 CO -0.02 -0.75 1.10 -2.14 -1.57 0.00 0.00 175.55 172.16 1jhz s PRO 127 N -0.08 3.44 0.38 -1.71 0.01 -1.26 -4.84 135.00 130.95 1jhz s PRO 127 Ca 0.17 1.49 0.19 0.00 0.01 0.00 0.00 61.00 62.86 1jhz s PRO 127 Cb -0.25 -2.03 1.13 0.00 0.01 0.00 0.00 34.50 33.36 1jhz s PRO 127 CO 0.00 -0.75 1.72 0.93 0.01 0.00 0.00 177.00 178.91 1jhz h GLU 128 N 1.17 0.34 -0.67 5.54 4.39 -2.00 -1.04 114.58 122.31 1jhz h GLU 128 Ca -0.49 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.16 1jhz h GLU 128 Cb 1.25 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.79 1jhz h GLU 128 CO 0.57 0.22 0.33 -1.35 -1.16 0.00 0.00 179.01 177.62 1jhz h PRO 129 N 0.35 0.96 0.50 2.33 0.11 -1.99 -1.80 132.00 132.46 1jhz h PRO 129 Ca 0.67 -0.14 -0.02 0.00 0.11 0.00 0.00 66.00 66.62 1jhz h PRO 129 Cb 1.70 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.64 1jhz h PRO 129 CO -0.40 0.76 -0.24 1.25 -0.21 0.00 0.00 178.00 179.16 1jhz h LEU 130 N 0.92 -0.57 -1.54 2.35 6.46 -1.55 -1.63 115.31 119.76 1jhz h LEU 130 Ca 0.23 0.01 0.14 0.00 -0.12 0.00 0.00 57.88 58.13 1jhz h LEU 130 Cb 0.11 0.15 -0.05 0.00 -0.73 0.00 0.00 40.66 40.14 1jhz h LEU 130 CO -0.03 -0.39 0.50 -0.07 -0.62 0.00 0.00 178.44 177.83 1jhz h LEU 131 N -0.70 0.44 0.03 2.25 4.07 -1.47 0.35 115.31 120.28 1jhz h LEU 131 Ca -0.07 0.02 -0.00 0.00 0.08 0.00 0.00 57.88 57.91 1jhz h LEU 131 Cb 0.53 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.20 1jhz h LEU 131 CO 0.11 0.24 -0.02 0.00 -1.08 0.00 0.00 178.44 177.69 1jhz h ALA 132 N 1.64 -0.04 -0.33 1.53 0.00 -0.83 -1.97 119.26 119.25 1jhz h ALA 132 Ca 0.36 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 55.08 1jhz h ALA 132 Cb 0.76 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1jhz h ALA 132 CO -0.12 -0.43 -0.20 0.00 0.00 0.00 0.00 179.25 178.49 1jhz h MET 133 N -0.23 0.63 -0.58 0.00 -0.00 -0.26 -2.44 114.93 112.05 1jhz h MET 133 Ca -0.00 -0.23 0.08 0.00 -0.00 0.00 0.00 59.70 59.55 1jhz h MET 133 Cb 0.21 -0.04 -0.04 0.00 -0.00 0.00 0.00 31.60 31.73 1jhz h MET 133 CO 0.01 0.79 0.39 -0.07 -0.00 0.00 0.00 176.91 178.03 1jhz h LEU 134 N 0.56 0.40 -1.28 -0.10 3.38 -0.78 -0.46 115.31 117.03 1jhz h LEU 134 Ca 0.09 0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 1jhz h LEU 134 Cb 0.66 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 1jhz h LEU 134 CO 0.05 0.25 -0.36 -0.33 0.09 0.00 0.00 178.44 178.14 1jhz h GLU 135 N 0.45 0.00 0.00 1.13 5.08 -0.85 -2.76 114.58 117.63 1jhz h GLU 135 Ca 0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 1jhz h GLU 135 Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1jhz h GLU 135 CO -0.07 0.36 0.00 0.93 -1.00 0.00 0.00 179.01 179.22 1jhz h GLU 136 N 0.00 0.00 -0.35 2.33 5.08 -1.05 -2.92 114.58 117.67 1jhz h GLU 136 Ca -0.00 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 1jhz h GLU 136 Cb 0.66 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.88 1jhz h GLU 136 CO 0.05 0.00 0.02 0.66 -1.00 0.00 0.00 179.01 178.74 1jhz n TYR 137 N -2.69 1.19 0.54 4.33 4.01 -1.04 -4.66 117.16 118.84 1jhz n TYR 137 Ca 0.02 -1.04 0.04 0.00 -0.16 0.00 0.00 57.90 56.76 1jhz n TYR 137 Cb 0.31 -0.40 0.22 0.00 -0.31 0.00 0.00 39.34 39.16 1jhz n TYR 137 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1jhz n ARG 138 N -0.54 0.27 0.18 -0.72 1.74 -1.10 -1.62 116.66 114.87 1jhz n ARG 138 Ca 0.26 0.00 0.12 0.00 -0.77 0.00 0.00 57.85 57.46 1jhz n ARG 138 Cb 0.99 -1.44 0.17 0.00 -1.02 0.00 0.00 32.46 31.16 1jhz n ARG 138 CO 0.00 0.00 0.00 1.12 -1.52 0.00 0.00 177.63 177.23 1jhz h HIS 139 N 0.00 0.00 -3.18 -1.55 2.07 -1.87 -3.43 115.15 107.19 1jhz h HIS 139 Ca 0.00 0.00 -0.61 0.00 -2.85 0.00 0.00 60.37 56.91 1jhz h HIS 139 Cb 0.00 0.00 -0.10 0.00 2.57 0.00 0.00 27.41 29.88 1jhz h HIS 139 CO 0.00 0.00 -0.41 -1.50 -3.07 0.00 0.00 177.93 172.95 1jhz s ILE 140 N -3.22 5.36 0.36 6.12 1.10 -0.64 -5.05 121.20 125.24 1jhz s ILE 140 Ca 0.06 0.36 -0.28 0.00 -0.51 0.00 0.00 60.65 60.28 1jhz s ILE 140 Cb 0.07 -3.54 -0.11 0.00 0.15 0.00 0.00 42.46 39.04 1jhz s ILE 140 CO 0.68 0.45 1.49 -2.84 -2.11 0.00 0.00 174.94 172.61 1jhz s PRO 141 N 0.13 4.13 0.20 3.50 0.02 -1.26 -4.83 135.00 136.90 1jhz s PRO 141 Ca 0.13 2.55 -0.14 0.00 0.02 0.00 0.00 61.00 63.56 1jhz s PRO 141 Cb -0.12 -2.98 0.01 0.00 0.02 0.00 0.00 34.50 31.42 1jhz s PRO 141 CO 0.02 -0.52 0.44 0.00 -0.33 0.00 0.00 177.00 176.61 1jhz s MET 142 N -1.89 1.37 -0.07 5.54 0.23 -1.26 -0.23 119.30 122.99 1jhz s MET 142 Ca 0.54 -1.06 -0.01 0.00 -1.03 0.00 0.00 55.69 54.12 1jhz s MET 142 Cb -0.46 0.47 0.03 0.00 -1.53 0.00 0.00 34.83 33.33 1jhz s MET 142 CO 0.61 -0.56 0.01 0.08 -2.03 0.00 0.00 175.02 173.13 1jhz s VAL 143 N -3.94 0.34 -0.29 5.16 1.01 -0.50 -4.93 120.40 117.25 1jhz s VAL 143 Ca 0.15 0.13 0.03 0.00 0.00 0.00 0.00 61.98 62.29 1jhz s VAL 143 Cb 0.00 -0.52 0.07 0.00 0.00 0.00 0.00 36.38 35.94 1jhz s VAL 143 CO 0.01 0.24 -0.05 0.68 0.00 0.00 0.00 175.10 175.98 1jhz s VAL 144 N 1.99 2.19 -0.15 2.92 -7.23 -1.26 0.16 120.40 119.03 1jhz s VAL 144 Ca 0.05 -1.88 -0.26 0.00 -1.81 0.00 0.00 61.98 58.08 1jhz s VAL 144 Cb -0.12 -2.41 -0.02 0.00 0.56 0.00 0.00 36.38 34.39 1jhz s VAL 144 CO -0.05 -0.23 0.86 -0.04 -0.31 0.00 0.00 175.10 175.33 1jhz s MET 145 N 1.04 4.33 -0.22 4.82 -1.94 0.61 -0.81 119.30 127.14 1jhz s MET 145 Ca -0.02 1.09 -0.02 0.00 -1.71 0.00 0.00 55.69 55.03 1jhz s MET 145 Cb -0.20 -3.56 0.01 0.00 2.01 0.00 0.00 34.83 33.09 1jhz s MET 145 CO -0.06 -0.30 -0.08 0.34 -0.01 0.00 0.00 175.02 174.91 1jhz s ASP 146 N 1.12 4.07 0.07 3.03 -1.08 0.33 -4.20 116.67 120.01 1jhz s ASP 146 Ca 0.40 -0.58 0.25 0.00 -0.52 0.00 0.00 52.55 52.10 1jhz s ASP 146 Cb -0.17 -1.67 0.49 0.00 -1.46 0.00 0.00 42.92 40.11 1jhz s ASP 146 CO 0.14 -0.05 1.42 0.49 0.52 0.00 0.00 175.17 177.69 1jhz n PHE 147 N 4.73 0.34 -0.67 -5.34 3.01 -1.26 -1.01 117.46 117.25 1jhz n PHE 147 Ca -0.18 0.10 0.00 0.00 1.01 0.00 0.00 57.45 58.38 1jhz n PHE 147 Cb 0.50 -0.52 0.00 0.00 -0.01 0.00 0.00 39.48 39.45 1jhz n PHE 147 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1jhz n GLY 148 N 1.40 -0.70 3.74 1.37 0.00 -1.26 -4.82 105.19 104.92 1jhz n GLY 148 Ca 0.04 -1.69 -0.42 0.00 0.00 0.00 0.00 46.02 43.96 1jhz n GLY 148 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1jhz n GLU 149 N -0.50 2.63 -1.70 1.61 0.00 -1.26 -4.78 120.64 116.64 1jhz n GLU 149 Ca 0.00 0.93 -0.43 0.00 0.00 0.00 0.00 57.16 57.67 1jhz n GLU 149 Cb 0.00 -2.69 -0.03 0.00 0.00 0.00 0.00 31.44 28.71 1jhz n GLU 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1jhz n ALA 150 N 1.82 2.39 -2.46 -1.84 0.00 -1.26 -4.99 120.51 114.16 1jhz n ALA 150 Ca 0.08 0.38 -0.26 0.00 0.00 0.00 0.00 53.44 53.63 1jhz n ALA 150 Cb 0.37 -2.52 -0.11 0.00 0.00 0.00 0.00 19.45 17.18 1jhz n ALA 150 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1jhz s LYS 151 N 1.70 1.65 -1.53 0.00 1.02 -1.26 -5.03 119.74 116.29 1jhz s LYS 151 Ca 0.78 -1.55 -0.11 0.00 0.02 0.00 0.00 55.97 55.11 1jhz s LYS 151 Cb -0.53 -1.88 -0.05 0.00 -0.52 0.00 0.00 37.83 34.85 1jhz s LYS 151 CO 0.35 0.39 2.70 0.00 -0.92 0.00 0.00 175.35 177.87 1jhz n ALA 152 N -0.01 6.79 -4.01 5.17 0.00 -1.26 -4.83 120.51 122.37 1jhz n ALA 152 Ca -0.10 -3.54 -0.17 0.00 0.00 0.00 0.00 53.44 49.62 1jhz n ALA 152 Cb 0.57 -3.41 -0.05 0.00 0.00 0.00 0.00 19.45 16.56 1jhz n ALA 152 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1jhz n ASP 153 N 4.39 0.29 0.00 0.00 5.68 -1.26 -5.06 116.55 120.59 1jhz n ASP 153 Ca 0.69 -2.50 0.12 0.00 -0.50 0.00 0.00 54.79 52.60 1jhz n ASP 153 Cb 0.27 0.94 0.63 0.00 -1.14 0.00 0.00 41.12 41.82 1jhz n ASP 153 CO 0.00 0.00 0.00 2.22 -1.33 0.00 0.00 177.20 178.09 1jhz n PHE 154 N -0.53 0.00 -1.35 2.11 -1.74 -1.26 -4.91 117.46 109.78 1jhz n PHE 154 Ca 0.01 0.00 -0.31 0.00 -0.56 0.00 0.00 57.45 56.58 1jhz n PHE 154 Cb 0.42 -0.26 0.08 0.00 1.52 0.00 0.00 39.48 41.24 1jhz n PHE 154 CO 0.00 0.00 0.00 0.95 -0.56 0.00 0.00 176.76 177.15 1jhz s THR 155 N -2.52 3.32 -0.11 1.97 -4.23 -1.26 -4.60 115.64 108.22 1jhz s THR 155 Ca 0.25 0.46 -0.12 0.00 -1.18 0.00 0.00 61.69 61.09 1jhz s THR 155 Cb 0.16 -2.95 -0.05 0.00 1.34 0.00 0.00 72.50 71.00 1jhz s THR 155 CO 0.36 -0.53 0.28 -1.81 -0.54 0.00 0.00 174.62 172.38 1jhz s ASP 156 N -3.26 6.52 0.02 3.99 1.01 0.01 -4.54 116.67 120.41 1jhz s ASP 156 Ca 0.62 0.61 -0.14 0.00 0.71 0.00 0.00 52.55 54.35 1jhz s ASP 156 Cb -0.18 -2.17 -0.06 0.00 1.01 0.00 0.00 42.92 41.53 1jhz s ASP 156 CO 0.54 0.25 0.42 0.00 0.21 0.00 0.00 175.17 176.59 1jhz s ALA 157 N -0.35 3.69 -0.11 5.23 0.00 -0.34 -0.51 121.76 129.37 1jhz s ALA 157 Ca 0.18 -0.22 0.03 0.00 0.00 0.00 0.00 51.96 51.95 1jhz s ALA 157 Cb -0.14 -2.39 0.01 0.00 0.00 0.00 0.00 23.12 20.60 1jhz s ALA 157 CO 0.06 0.49 -0.18 0.54 0.00 0.00 0.00 175.76 176.66 1jhz s VAL 158 N -1.14 1.71 -0.28 0.00 0.11 -0.18 0.24 120.40 120.87 1jhz s VAL 158 Ca 0.26 -0.79 0.02 0.00 -2.93 0.00 0.00 61.98 58.54 1jhz s VAL 158 Cb -0.16 -1.52 0.06 0.00 -1.53 0.00 0.00 36.38 33.22 1jhz s VAL 158 CO 0.15 0.48 -0.07 -0.63 -3.33 0.00 0.00 175.10 171.70 1jhz s ILE 159 N 0.75 2.42 -0.74 7.04 1.01 0.78 -4.53 121.20 127.92 1jhz s ILE 159 Ca -0.11 -1.60 0.25 0.00 0.00 0.00 0.00 60.65 59.19 1jhz s ILE 159 Cb -0.16 -2.43 0.04 0.00 0.01 0.00 0.00 42.46 39.93 1jhz s ILE 159 CO 0.02 -0.08 1.36 -0.90 0.00 0.00 0.00 174.94 175.34 1jhz n ASP 160 N 4.48 0.63 -3.73 3.58 5.68 -1.26 -0.96 116.55 124.97 1jhz n ASP 160 Ca -0.13 0.05 -0.27 0.00 -0.50 0.00 0.00 54.79 53.94 1jhz n ASP 160 Cb 0.42 0.16 0.05 0.00 -1.14 0.00 0.00 41.12 40.62 1jhz n ASP 160 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1jhz n ASN 161 N -1.95 -5.61 -0.11 -1.12 3.02 -1.25 -4.52 115.26 103.72 1jhz n ASN 161 Ca 0.04 -0.64 0.04 0.00 -0.03 0.00 0.00 54.58 53.99 1jhz n ASN 161 Cb 0.41 -4.45 0.37 0.00 -0.61 0.00 0.00 39.78 35.50 1jhz n ASN 161 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1jhz h ALA 162 N 0.99 1.67 -0.82 5.41 0.00 -1.93 -2.17 119.26 122.42 1jhz h ALA 162 Ca -0.57 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.34 1jhz h ALA 162 Cb 1.37 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.91 1jhz h ALA 162 CO 0.61 0.27 0.53 0.35 0.00 0.00 0.00 179.25 181.01 1jhz h PHE 163 N 0.71 0.99 0.00 0.00 3.04 -1.90 -0.61 116.94 119.17 1jhz h PHE 163 Ca 0.23 0.03 -0.08 0.00 3.98 0.00 0.00 57.97 62.13 1jhz h PHE 163 Cb 0.06 -0.33 -0.01 0.00 2.56 0.00 0.00 35.95 38.23 1jhz h PHE 163 CO -0.00 0.57 -0.38 1.05 -2.02 0.00 0.00 178.31 177.53 1jhz h GLU 164 N 1.03 0.00 -0.23 1.11 4.11 -1.71 -2.00 114.58 116.89 1jhz h GLU 164 Ca 0.33 0.00 -0.17 0.00 0.07 0.00 0.00 59.36 59.59 1jhz h GLU 164 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1jhz h GLU 164 CO -0.11 0.38 -0.50 0.78 0.07 0.00 0.00 179.01 179.62 1jhz h GLY 165 N 1.84 0.82 0.93 1.06 0.00 -0.95 -2.21 103.07 104.54 1jhz h GLY 165 Ca -0.00 -0.99 -0.02 0.00 0.00 0.00 0.00 47.33 46.32 1jhz h GLY 165 CO 0.05 0.88 0.14 -1.33 0.00 0.00 0.00 176.54 176.28 1jhz h GLY 166 N 0.47 0.51 0.44 4.60 0.00 -0.98 -2.36 103.07 105.75 1jhz h GLY 166 Ca 0.00 -0.27 0.03 0.00 0.00 0.00 0.00 47.33 47.09 1jhz h GLY 166 CO 0.11 0.26 -0.24 -1.82 0.00 0.00 0.00 176.54 174.85 1jhz h TYR 167 N 0.37 -0.64 -0.80 5.60 3.20 -1.34 -1.69 116.97 121.68 1jhz h TYR 167 Ca 0.11 0.02 0.15 0.00 3.14 0.00 0.00 58.73 62.15 1jhz h TYR 167 Cb 0.17 0.29 -0.10 0.00 1.54 0.00 0.00 36.73 38.62 1jhz h TYR 167 CO -0.01 -0.33 0.34 0.52 -1.64 0.00 0.00 178.16 177.04 1jhz h MET 168 N -0.37 0.46 0.54 1.82 2.86 -1.22 0.00 114.93 119.02 1jhz h MET 168 Ca 0.06 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.66 1jhz h MET 168 Cb 0.46 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 1jhz h MET 168 CO -0.22 0.30 -0.36 0.00 1.06 0.00 0.00 176.91 177.69 1jhz h ALA 169 N 1.58 -0.89 -0.26 6.32 0.00 -0.79 -0.93 119.26 124.28 1jhz h ALA 169 Ca 0.45 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 55.23 1jhz h ALA 169 Cb 0.70 0.46 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 1jhz h ALA 169 CO -0.42 -1.02 -0.03 0.78 0.00 0.00 0.00 179.25 178.57 1jhz h GLY 170 N -0.87 0.22 0.81 0.00 0.00 -0.60 -1.85 103.07 100.78 1jhz h GLY 170 Ca -0.06 0.05 0.08 0.00 0.00 0.00 0.00 47.33 47.40 1jhz h GLY 170 CO 0.05 -0.07 0.58 3.21 0.00 0.00 0.00 176.54 180.31 1jhz h ARG 171 N 0.04 0.95 -0.09 4.80 2.47 -0.94 -0.73 114.38 120.88 1jhz h ARG 171 Ca 0.12 -0.06 -0.01 0.00 -1.26 0.00 0.00 59.98 58.78 1jhz h ARG 171 Cb 0.17 -0.21 -0.00 0.00 -1.65 0.00 0.00 29.97 28.28 1jhz h ARG 171 CO -0.23 0.63 0.03 -0.92 0.56 0.00 0.00 179.97 180.03 1jhz h TYR 172 N 0.98 0.15 -0.50 3.04 3.20 -0.42 0.41 116.97 123.83 1jhz h TYR 172 Ca 0.40 -0.02 0.05 0.00 3.14 0.00 0.00 58.73 62.30 1jhz h TYR 172 Cb 0.27 -0.04 -0.05 0.00 1.54 0.00 0.00 36.73 38.45 1jhz h TYR 172 CO -0.00 0.30 0.23 -0.07 -1.64 0.00 0.00 178.16 176.98 1jhz h LEU 173 N -0.05 0.30 -0.52 2.82 3.38 -0.83 0.16 115.31 120.57 1jhz h LEU 173 Ca 0.03 0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 1jhz h LEU 173 Cb 0.23 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1jhz h LEU 173 CO -0.00 0.21 0.18 0.40 0.09 0.00 0.00 178.44 179.32 1jhz h ILE 174 N 0.45 1.23 -0.66 1.22 2.04 -0.89 -2.42 117.51 118.47 1jhz h ILE 174 Ca 0.23 -0.73 0.03 0.00 1.00 0.00 0.00 64.86 65.39 1jhz h ILE 174 Cb 0.18 0.73 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 1jhz h ILE 174 CO -0.19 0.27 0.41 -0.33 0.00 0.00 0.00 178.15 178.31 1jhz h GLU 175 N 0.70 0.77 0.00 2.37 3.07 0.63 -2.09 114.58 120.04 1jhz h GLU 175 Ca 0.17 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.98 1jhz h GLU 175 Cb 0.24 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 27.98 1jhz h GLU 175 CO -0.01 0.51 0.00 0.54 -1.40 0.00 0.00 179.01 178.65 1jhz n ARG 176 N -4.70 0.24 -0.08 2.33 5.12 0.47 -4.84 116.66 115.21 1jhz n ARG 176 Ca 0.07 0.10 0.00 0.00 -1.93 0.00 0.00 57.85 56.09 1jhz n ARG 176 Cb 0.09 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 29.89 1jhz n ARG 176 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1jhz n GLY 177 N -0.34 0.96 3.87 -0.13 0.00 -0.78 0.38 105.19 109.15 1jhz n GLY 177 Ca 0.07 -0.03 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 1jhz n GLY 177 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1jhz s HIS 178 N -2.00 3.58 0.00 1.61 3.76 -1.00 -0.31 115.29 120.94 1jhz s HIS 178 Ca 0.00 0.70 0.00 0.00 -0.15 0.00 0.00 55.06 55.61 1jhz s HIS 178 Cb 0.00 -2.09 0.00 0.00 1.11 0.00 0.00 32.58 31.60 1jhz s HIS 178 CO 0.00 0.56 0.00 0.54 -0.85 0.00 0.00 174.74 174.99 1jhz n ARG 179 N 1.02 4.50 -3.46 1.40 1.74 -1.26 -4.42 116.66 116.18 1jhz n ARG 179 Ca -0.10 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.55 1jhz n ARG 179 Cb 0.52 -0.60 -0.06 0.00 -1.02 0.00 0.00 32.46 31.31 1jhz n ARG 179 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1jhz s GLU 180 N -0.45 2.89 -0.02 5.56 2.02 -1.26 -4.82 118.70 122.62 1jhz s GLU 180 Ca 0.00 -2.02 0.06 0.00 0.02 0.00 0.00 54.97 53.04 1jhz s GLU 180 Cb 0.00 -4.12 -0.02 0.00 0.10 0.00 0.00 34.13 30.09 1jhz s GLU 180 CO 0.00 -1.25 -0.21 0.42 0.02 0.00 0.00 175.26 174.24 1jhz s ILE 181 N 0.96 2.50 0.39 -1.63 1.01 -1.26 -0.58 121.20 122.58 1jhz s ILE 181 Ca 0.09 -0.99 0.08 0.00 0.00 0.00 0.00 60.65 59.83 1jhz s ILE 181 Cb -0.23 -1.94 -0.05 0.00 0.01 0.00 0.00 42.46 40.26 1jhz s ILE 181 CO -0.02 0.55 0.18 -0.83 0.00 0.00 0.00 174.94 174.82 1jhz s GLY 182 N -0.77 2.18 -0.12 6.18 0.00 -0.27 -4.77 107.32 109.75 1jhz s GLY 182 Ca 0.11 -1.99 -0.11 0.00 0.00 0.00 0.00 44.72 42.72 1jhz s GLY 182 CO 0.00 -1.84 0.33 0.14 0.00 0.00 0.00 173.10 171.73 1jhz s VAL 183 N -2.53 -0.00 -0.46 1.40 1.01 -0.59 -1.21 120.40 118.02 1jhz s VAL 183 Ca 0.41 0.01 0.03 0.00 0.00 0.00 0.00 61.98 62.42 1jhz s VAL 183 Cb 0.01 -0.47 0.13 0.00 0.00 0.00 0.00 36.38 36.05 1jhz s VAL 183 CO 0.23 0.00 0.22 -0.63 0.00 0.00 0.00 175.10 174.92 1jhz s ILE 184 N 0.24 2.06 0.60 2.22 1.01 -0.14 -1.73 121.20 125.46 1jhz s ILE 184 Ca -0.01 -2.84 -0.10 0.00 0.00 0.00 0.00 60.65 57.70 1jhz s ILE 184 Cb -0.03 -2.45 -0.03 0.00 0.01 0.00 0.00 42.46 39.96 1jhz s ILE 184 CO -0.00 -0.80 0.99 -2.16 0.00 0.00 0.00 174.94 172.97 1jhz s PRO 185 N 0.17 3.50 0.09 2.79 0.04 -1.25 -1.01 135.00 139.33 1jhz s PRO 185 Ca 0.16 0.60 -0.01 0.00 0.04 0.00 0.00 61.00 61.79 1jhz s PRO 185 Cb -0.24 -2.13 0.02 0.00 0.04 0.00 0.00 34.50 32.19 1jhz s PRO 185 CO -0.02 -0.56 0.12 0.41 0.04 0.00 0.00 177.00 176.99 1jhz n GLY 186 N -2.69 -0.46 2.49 0.56 0.00 -1.26 -0.86 105.19 102.98 1jhz n GLY 186 Ca 0.05 -1.78 -0.32 0.00 0.00 0.00 0.00 46.02 43.97 1jhz n GLY 186 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1jhz n PRO 187 N -1.25 3.29 0.00 1.61 -0.04 -1.25 -4.65 135.00 132.71 1jhz n PRO 187 Ca 0.02 -2.82 0.00 0.00 -0.04 0.00 0.00 63.50 60.65 1jhz n PRO 187 Cb 0.06 -2.33 0.00 0.00 -0.04 0.00 0.00 33.50 31.19 1jhz n PRO 187 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1jhz n ALA 194 N 1.15 0.00 0.09 0.55 0.00 -1.26 -5.15 120.51 115.89 1jhz n ALA 194 Ca 0.54 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.92 1jhz n ALA 194 Cb 0.43 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.96 1jhz n ALA 194 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1jhz h GLY 195 N 0.00 0.18 1.92 0.00 0.00 -1.97 0.13 103.07 103.34 1jhz h GLY 195 Ca 0.00 -0.26 -0.14 0.00 0.00 0.00 0.00 47.33 46.93 1jhz h GLY 195 CO 0.00 0.23 -0.62 0.07 0.00 0.00 0.00 176.54 176.22 1jhz h ARG 196 N 0.11 0.08 -0.04 4.80 0.11 -1.86 0.27 114.38 117.84 1jhz h ARG 196 Ca -0.02 -0.06 -0.22 0.00 0.10 0.00 0.00 59.98 59.79 1jhz h ARG 196 Cb 1.26 0.01 0.00 0.00 1.11 0.00 0.00 29.97 32.36 1jhz h ARG 196 CO 0.11 0.67 -0.88 1.25 0.10 0.00 0.00 179.97 181.22 1jhz h LEU 197 N 0.06 0.64 -0.69 0.08 5.85 -1.76 -2.07 115.31 117.42 1jhz h LEU 197 Ca -0.01 -0.47 -0.01 0.00 0.84 0.00 0.00 57.88 58.23 1jhz h LEU 197 Cb 1.11 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.95 1jhz h LEU 197 CO 0.09 1.26 -0.05 0.00 -0.34 0.00 0.00 178.44 179.40 1jhz h ALA 198 N 0.71 0.98 0.03 1.25 0.00 -0.43 -2.20 119.26 119.61 1jhz h ALA 198 Ca -0.07 -0.04 -0.25 0.00 0.00 0.00 0.00 54.91 54.55 1jhz h ALA 198 Cb 1.50 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.26 1jhz h ALA 198 CO 0.16 0.06 -1.24 0.78 0.00 0.00 0.00 179.25 179.01 1jhz h GLY 199 N 3.02 0.08 0.64 0.00 0.00 -0.31 -3.13 103.07 103.37 1jhz h GLY 199 Ca -0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 47.33 47.12 1jhz h GLY 199 CO 0.01 0.17 -0.16 -2.75 0.00 0.00 0.00 176.54 173.81 1jhz h PHE 200 N 0.02 -0.41 -0.95 5.60 3.57 -1.15 -3.01 116.94 120.60 1jhz h PHE 200 Ca -0.11 -0.01 0.15 0.00 3.53 0.00 0.00 57.97 61.53 1jhz h PHE 200 Cb 1.87 0.14 -0.08 0.00 2.79 0.00 0.00 35.95 40.67 1jhz h PHE 200 CO 0.02 -0.07 0.60 0.52 -2.23 0.00 0.00 178.31 177.15 1jhz h MET 201 N -0.81 0.78 -0.73 1.11 2.86 -1.53 0.56 114.93 117.18 1jhz h MET 201 Ca -0.05 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.54 1jhz h MET 201 Cb 0.52 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 31.97 1jhz h MET 201 CO 0.07 0.51 0.43 -0.22 1.06 0.00 0.00 176.91 178.77 1jhz h LYS 202 N 0.80 1.00 -0.79 1.72 1.63 -1.53 0.40 116.57 119.80 1jhz h LYS 202 Ca 0.49 -0.10 -0.00 0.00 -0.85 0.00 0.00 60.65 60.19 1jhz h LYS 202 Cb 0.69 -0.20 -0.04 0.00 -0.60 0.00 0.00 32.23 32.08 1jhz h LYS 202 CO -0.26 0.72 0.48 0.00 -3.45 0.00 0.00 179.45 176.94 1jhz h ALA 203 N 1.22 1.35 -0.17 5.00 0.00 -0.79 0.21 119.26 126.08 1jhz h ALA 203 Ca 0.26 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1jhz h ALA 203 Cb -0.01 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 1jhz h ALA 203 CO -0.05 0.56 0.01 1.98 0.00 0.00 0.00 179.25 181.75 1jhz h MET 204 N 1.09 0.29 0.29 0.00 4.05 -0.29 -3.09 114.93 117.26 1jhz h MET 204 Ca 0.28 -0.09 0.00 0.00 -0.28 0.00 0.00 59.70 59.62 1jhz h MET 204 Cb -0.05 -0.03 -0.03 0.00 -0.80 0.00 0.00 31.60 30.69 1jhz h MET 204 CO -0.05 0.49 -0.40 1.49 0.23 0.00 0.00 176.91 178.66 1jhz h GLU 205 N 0.05 -0.72 -0.23 0.39 4.57 0.65 -0.44 114.58 118.85 1jhz h GLU 205 Ca 0.05 0.05 0.07 0.00 -1.18 0.00 0.00 59.36 58.34 1jhz h GLU 205 Cb 0.35 0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 29.10 1jhz h GLU 205 CO 0.01 -0.48 0.54 1.49 -1.18 0.00 0.00 179.01 179.39 1jhz h GLU 206 N -0.75 0.00 -0.31 1.92 4.81 -0.97 0.41 114.58 119.69 1jhz h GLU 206 Ca -0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1jhz h GLU 206 Cb 0.70 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.08 1jhz h GLU 206 CO -0.13 0.00 0.00 0.00 -0.73 0.00 0.00 179.01 178.15 1jhz n ALA 207 N -2.01 2.82 -1.43 2.92 0.00 -0.93 -4.95 120.51 116.93 1jhz n ALA 207 Ca 0.04 -1.96 -0.16 0.00 0.00 0.00 0.00 53.44 51.36 1jhz n ALA 207 Cb 0.65 -0.67 -0.07 0.00 0.00 0.00 0.00 19.45 19.37 1jhz n ALA 207 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1jhz n MET 208 N -0.14 -1.51 -2.95 0.00 2.81 0.14 -4.96 117.12 110.52 1jhz n MET 208 Ca 0.19 0.99 -0.36 0.00 -1.81 0.00 0.00 57.70 56.72 1jhz n MET 208 Cb 0.78 -5.33 -0.06 0.00 -0.71 0.00 0.00 33.22 27.90 1jhz n MET 208 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1jhz s ILE 209 N -2.30 4.42 -0.05 2.02 1.01 -0.22 -4.99 121.20 121.09 1jhz s ILE 209 Ca 0.00 1.49 0.03 0.00 0.00 0.00 0.00 60.65 62.17 1jhz s ILE 209 Cb 0.00 -3.87 0.01 0.00 0.01 0.00 0.00 42.46 38.61 1jhz s ILE 209 CO 0.00 0.09 -0.12 -0.54 0.00 0.00 0.00 174.94 174.37 1jhz s LYS 210 N -2.23 1.45 -0.29 2.79 3.01 -1.26 -4.28 119.74 118.93 1jhz s LYS 210 Ca 0.49 -0.40 -0.09 0.00 -1.01 0.00 0.00 55.97 54.95 1jhz s LYS 210 Cb -0.16 -1.25 -0.02 0.00 -1.01 0.00 0.00 37.83 35.38 1jhz s LYS 210 CO 0.21 0.09 0.14 0.14 0.51 0.00 0.00 175.35 176.44 1jhz s VAL 211 N 0.41 4.65 0.70 3.17 -7.23 -1.26 -4.89 120.40 115.94 1jhz s VAL 211 Ca -0.09 -0.24 -0.16 0.00 -1.81 0.00 0.00 61.98 59.68 1jhz s VAL 211 Cb -0.13 -3.29 -0.01 0.00 0.56 0.00 0.00 36.38 33.52 1jhz s VAL 211 CO 0.02 0.18 0.96 -0.81 -0.31 0.00 0.00 175.10 175.14 1jhz n PRO 212 N 4.98 0.59 0.07 4.82 -0.04 -1.26 -4.87 135.00 139.28 1jhz n PRO 212 Ca -0.15 0.25 0.02 0.00 -0.04 0.00 0.00 63.50 63.59 1jhz n PRO 212 Cb 0.50 -2.20 0.38 0.00 -0.04 0.00 0.00 33.50 32.14 1jhz n PRO 212 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1jhz h GLU 213 N -0.10 0.37 0.00 0.54 4.57 -1.97 -1.91 114.58 116.08 1jhz h GLU 213 Ca -0.48 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 57.64 1jhz h GLU 213 Cb 1.34 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.87 1jhz h GLU 213 CO 0.48 0.40 0.00 -1.13 -1.18 0.00 0.00 179.01 177.58 1jhz n SER 214 N -4.33 0.40 -1.22 1.04 3.41 -1.26 -1.58 113.62 110.07 1jhz n SER 214 Ca 0.01 0.64 0.08 0.00 -0.26 0.00 0.00 58.87 59.34 1jhz n SER 214 Cb 0.21 -0.71 0.30 0.00 -0.26 0.00 0.00 64.21 63.75 1jhz n SER 214 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1jhz n TRP 215 N -1.99 1.25 -3.91 7.33 8.01 -0.72 -4.70 117.44 122.71 1jhz n TRP 215 Ca 0.01 -0.74 -0.29 0.00 -1.31 0.00 0.00 57.50 55.16 1jhz n TRP 215 Cb 0.12 -0.31 -0.16 0.00 -2.01 0.00 0.00 31.31 28.95 1jhz n TRP 215 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.69 177.10 1jhz s ILE 216 N -2.38 1.28 -0.06 -0.99 1.01 -0.62 -1.54 121.20 117.91 1jhz s ILE 216 Ca 0.44 -0.91 -0.01 0.00 0.00 0.00 0.00 60.65 60.17 1jhz s ILE 216 Cb 0.33 -1.52 0.03 0.00 0.01 0.00 0.00 42.46 41.30 1jhz s ILE 216 CO 0.14 0.00 0.01 -0.69 0.00 0.00 0.00 174.94 174.40 1jhz s VAL 217 N 1.53 0.30 0.74 2.92 1.01 -0.70 -5.00 120.40 121.19 1jhz s VAL 217 Ca -0.02 0.14 -0.11 0.00 0.00 0.00 0.00 61.98 61.99 1jhz s VAL 217 Cb -0.17 -0.45 0.03 0.00 0.00 0.00 0.00 36.38 35.80 1jhz s VAL 217 CO -0.07 0.23 1.07 0.00 0.00 0.00 0.00 175.10 176.33 1jhz s GLN 218 N 1.77 2.59 0.00 2.72 -2.07 -1.26 -3.75 119.66 119.66 1jhz s GLN 218 Ca 0.01 0.99 0.00 0.00 -1.82 0.00 0.00 55.36 54.54 1jhz s GLN 218 Cb -0.13 -1.95 0.00 0.00 -1.09 0.00 0.00 33.01 29.85 1jhz s GLN 218 CO -0.04 -1.36 0.00 0.41 -1.32 0.00 0.00 175.29 172.98 1jhz n GLY 219 N -1.73 4.18 0.22 2.60 0.00 -0.04 -4.86 105.19 105.57 1jhz n GLY 219 Ca 0.08 -1.90 0.02 0.00 0.00 0.00 0.00 46.02 44.22 1jhz n GLY 219 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1jhz n ASP 220 N -2.04 0.63 0.00 1.61 5.68 -1.26 -3.95 116.55 117.22 1jhz n ASP 220 Ca 0.00 -1.89 0.00 0.00 -0.50 0.00 0.00 54.79 52.40 1jhz n ASP 220 Cb 0.00 -0.16 0.00 0.00 -1.14 0.00 0.00 41.12 39.82 1jhz n ASP 220 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 1jhz n PHE 221 N -0.30 0.00 -2.34 2.11 3.72 -1.26 -4.89 117.46 114.49 1jhz n PHE 221 Ca 0.03 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.13 1jhz n PHE 221 Cb 0.58 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.11 1jhz n PHE 221 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1jhz s GLU 222 N -0.49 3.68 0.25 -1.08 0.41 -1.26 -3.69 118.70 116.52 1jhz s GLU 222 Ca 0.00 0.59 -0.06 0.00 -0.41 0.00 0.00 54.97 55.09 1jhz s GLU 222 Cb 0.00 -2.23 0.27 0.00 -1.78 0.00 0.00 34.13 30.40 1jhz s GLU 222 CO 0.00 -0.32 1.91 -1.35 -0.49 0.00 0.00 175.26 175.01 1jhz h PRO 223 N 0.32 1.24 -0.62 0.39 0.10 -1.90 -3.05 132.00 128.48 1jhz h PRO 223 Ca -0.46 -0.07 0.04 0.00 0.10 0.00 0.00 66.00 65.61 1jhz h PRO 223 Cb 1.19 -0.28 -0.05 0.00 0.10 0.00 0.00 31.00 31.97 1jhz h PRO 223 CO 0.62 0.82 0.36 1.49 0.10 0.00 0.00 178.00 181.39 1jhz h GLU 224 N 1.27 0.68 -0.64 1.05 4.22 -1.94 -0.15 114.58 119.08 1jhz h GLU 224 Ca 0.37 -0.04 -0.06 0.00 0.08 0.00 0.00 59.36 59.71 1jhz h GLU 224 Cb -0.08 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 28.99 1jhz h GLU 224 CO -0.10 0.45 0.17 0.66 -2.18 0.00 0.00 179.01 178.01 1jhz h SER 225 N 0.70 0.93 -0.55 1.04 4.64 -1.93 0.16 113.55 118.52 1jhz h SER 225 Ca 0.26 -0.18 -0.09 0.00 -0.47 0.00 0.00 61.79 61.31 1jhz h SER 225 Cb 0.10 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 61.92 1jhz h SER 225 CO -0.14 0.89 -0.01 1.23 -0.87 0.00 0.00 176.83 177.92 1jhz h GLY 226 N 1.04 1.09 0.71 -0.77 0.00 -1.33 -0.60 103.07 103.21 1jhz h GLY 226 Ca 0.21 -0.80 -0.03 0.00 0.00 0.00 0.00 47.33 46.71 1jhz h GLY 226 CO -0.00 0.74 -0.27 -1.82 0.00 0.00 0.00 176.54 175.19 1jhz h TYR 227 N 0.92 -0.69 -0.76 5.60 5.03 -0.54 -2.35 116.97 124.18 1jhz h TYR 227 Ca 0.16 -0.02 0.11 0.00 2.58 0.00 0.00 58.73 61.57 1jhz h TYR 227 Cb 0.56 0.23 -0.05 0.00 1.55 0.00 0.00 36.73 39.01 1jhz h TYR 227 CO 0.04 -0.36 0.50 0.00 -1.32 0.00 0.00 178.16 177.02 1jhz h ARG 228 N -1.05 0.59 -0.16 1.82 3.08 -0.66 -2.36 114.38 115.65 1jhz h ARG 228 Ca -0.08 -0.04 -0.23 0.00 0.07 0.00 0.00 59.98 59.71 1jhz h ARG 228 Cb 0.64 -0.13 0.01 0.00 0.08 0.00 0.00 29.97 30.56 1jhz h ARG 228 CO 0.12 0.39 -0.78 0.00 -1.07 0.00 0.00 179.97 178.63 1jhz h ALA 229 N 1.63 0.30 -0.57 0.04 0.00 -1.10 -3.10 119.26 116.46 1jhz h ALA 229 Ca 0.36 -0.60 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1jhz h ALA 229 Cb 0.58 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 1jhz h ALA 229 CO -0.13 0.68 0.31 1.98 0.00 0.00 0.00 179.25 182.09 1jhz h MET 230 N 0.55 0.80 -0.24 0.00 1.85 -0.91 -1.69 114.93 115.29 1jhz h MET 230 Ca -0.05 -0.10 -0.08 0.00 -0.61 0.00 0.00 59.70 58.85 1jhz h MET 230 Cb 1.41 -0.16 -0.01 0.00 0.43 0.00 0.00 31.60 33.27 1jhz h MET 230 CO 0.16 0.62 -0.22 -0.56 -0.40 0.00 0.00 176.91 176.52 1jhz h GLN 231 N 0.77 0.43 0.06 0.39 3.07 -1.53 -0.37 115.11 117.93 1jhz h GLN 231 Ca 0.20 -0.15 -0.00 0.00 0.09 0.00 0.00 58.65 58.79 1jhz h GLN 231 Cb 0.06 -0.03 0.00 0.00 0.08 0.00 0.00 27.48 27.58 1jhz h GLN 231 CO -0.03 0.63 -0.03 1.96 0.09 0.00 0.00 178.83 181.44 1jhz h GLN 232 N 0.39 -0.08 -0.40 0.06 1.08 -1.40 0.37 115.11 115.12 1jhz h GLN 232 Ca 0.06 0.01 -0.03 0.00 -1.45 0.00 0.00 58.65 57.24 1jhz h GLN 232 Cb 0.60 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 28.03 1jhz h GLN 232 CO 0.04 0.06 0.13 0.82 -0.95 0.00 0.00 178.83 178.93 1jhz h ILE 233 N -0.20 1.21 0.00 2.54 2.04 -1.22 -3.03 117.51 118.85 1jhz h ILE 233 Ca -0.01 -0.68 -0.01 0.00 1.00 0.00 0.00 64.86 65.16 1jhz h ILE 233 Cb 0.18 0.91 -0.00 0.00 -0.74 0.00 0.00 36.82 37.16 1jhz h ILE 233 CO 0.01 0.24 -0.07 -0.07 0.00 0.00 0.00 178.15 178.27 1jhz h LEU 234 N 0.50 0.00 -1.92 1.44 3.38 -0.88 -2.99 115.31 114.84 1jhz h LEU 234 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1jhz h LEU 234 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1jhz h LEU 234 CO -0.01 0.07 0.00 -1.54 0.09 0.00 0.00 178.44 177.05 1jhz n SER 235 N -3.19 2.85 -4.79 -0.43 3.41 0.13 -4.90 113.62 106.69 1jhz n SER 235 Ca 0.00 -2.22 -0.38 0.00 -0.26 0.00 0.00 58.87 56.02 1jhz n SER 235 Cb 0.35 -0.42 -0.06 0.00 -0.26 0.00 0.00 64.21 63.82 1jhz n SER 235 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1jhz s GLN 236 N -1.67 4.49 0.58 4.33 -1.52 -1.13 -4.92 119.66 119.83 1jhz s GLN 236 Ca 0.29 1.13 0.33 0.00 -1.95 0.00 0.00 55.36 55.16 1jhz s GLN 236 Cb 0.18 -3.04 1.35 0.00 -0.22 0.00 0.00 33.01 31.29 1jhz s GLN 236 CO 0.15 0.45 1.65 -1.35 -0.25 0.00 0.00 175.29 175.93 1jhz h PRO 237 N 3.76 0.00 -4.11 2.91 0.11 -1.91 -3.33 132.00 129.43 1jhz h PRO 237 Ca -0.47 0.00 -0.46 0.00 0.11 0.00 0.00 66.00 65.18 1jhz h PRO 237 Cb 1.20 0.00 -0.35 0.00 0.11 0.00 0.00 31.00 31.96 1jhz h PRO 237 CO 0.66 0.00 -0.79 -1.01 -0.21 0.00 0.00 178.00 176.65 1jhz s HIS 238 N -4.67 1.03 0.27 0.65 3.76 -1.26 -5.16 115.29 109.92 1jhz s HIS 238 Ca -0.04 -0.38 0.11 0.00 -0.15 0.00 0.00 55.06 54.60 1jhz s HIS 238 Cb 0.18 -0.89 -0.05 0.00 1.11 0.00 0.00 32.58 32.93 1jhz s HIS 238 CO 0.63 -0.30 -0.18 -0.98 -0.85 0.00 0.00 174.74 173.06 1jhz s ARG 239 N 1.23 1.61 0.69 1.40 1.70 -1.25 -5.02 118.95 119.31 1jhz s ARG 239 Ca -0.05 -1.75 -0.10 0.00 -0.47 0.00 0.00 55.73 53.36 1jhz s ARG 239 Cb -0.14 -1.60 0.02 0.00 -0.57 0.00 0.00 34.95 32.66 1jhz s ARG 239 CO -0.02 0.27 1.07 -1.25 -1.08 0.00 0.00 175.30 174.29 1jhz s PRO 240 N -3.55 2.77 0.07 3.89 0.04 -1.26 -5.00 135.00 131.96 1jhz s PRO 240 Ca 0.29 0.32 0.23 0.00 0.04 0.00 0.00 61.00 61.88 1jhz s PRO 240 Cb -0.03 -2.07 0.06 0.00 0.04 0.00 0.00 34.50 32.50 1jhz s PRO 240 CO 0.13 -1.03 1.03 0.25 0.04 0.00 0.00 177.00 177.42 1jhz n THR 241 N -2.96 0.24 -3.96 1.26 -2.24 0.25 -4.95 114.28 101.93 1jhz n THR 241 Ca 0.07 -0.30 -0.09 0.00 -2.27 0.00 0.00 64.05 61.46 1jhz n THR 241 Cb 0.58 0.08 -0.09 0.00 -2.10 0.00 0.00 70.33 68.79 1jhz n THR 241 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1jhz s ALA 242 N -3.24 0.07 -0.00 6.98 0.00 -1.16 -1.75 121.76 122.66 1jhz s ALA 242 Ca 0.03 -0.75 0.00 0.00 0.00 0.00 0.00 51.96 51.24 1jhz s ALA 242 Cb 0.14 0.30 0.00 0.00 0.00 0.00 0.00 23.12 23.55 1jhz s ALA 242 CO 0.80 -0.36 0.00 0.08 0.00 0.00 0.00 175.76 176.28 1jhz s VAL 243 N -3.15 0.01 -0.25 0.00 1.01 -0.60 -1.11 120.40 116.30 1jhz s VAL 243 Ca -0.00 0.01 -0.08 0.00 0.00 0.00 0.00 61.98 61.91 1jhz s VAL 243 Cb 0.02 -0.03 -0.03 0.00 0.00 0.00 0.00 36.38 36.34 1jhz s VAL 243 CO -0.07 0.01 0.08 0.12 0.00 0.00 0.00 175.10 175.24 1jhz s PHE 244 N 0.08 3.11 -0.24 5.22 5.36 -0.35 -2.36 117.98 128.80 1jhz s PHE 244 Ca -0.01 -0.33 -0.07 0.00 -0.96 0.00 0.00 56.93 55.56 1jhz s PHE 244 Cb -0.01 -2.25 -0.02 0.00 -0.34 0.00 0.00 43.02 40.40 1jhz s PHE 244 CO -0.00 -0.31 0.04 0.00 -1.46 0.00 0.00 175.22 173.49 1jhz n GLY 246 N 4.88 1.55 0.00 0.00 0.00 -0.18 -3.18 105.19 108.25 1jhz n GLY 246 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1jhz n GLY 246 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jhz n GLY 247 N 0.94 0.96 0.39 -0.02 0.00 -1.25 -4.60 105.19 101.61 1jhz n GLY 247 Ca 0.00 0.57 0.20 0.00 0.00 0.00 0.00 46.02 46.79 1jhz n GLY 247 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1jhz h ASP 248 N 0.00 0.51 -0.35 1.61 5.19 -1.46 0.43 116.42 122.35 1jhz h ASP 248 Ca 0.00 0.08 -0.04 0.00 -0.62 0.00 0.00 57.03 56.46 1jhz h ASP 248 Cb 0.00 -0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.50 1jhz h ASP 248 CO 0.00 0.13 0.07 0.40 -3.12 0.00 0.00 179.24 176.72 1jhz h ILE 249 N 0.47 1.23 -0.45 0.35 1.08 -1.86 -0.09 117.51 118.23 1jhz h ILE 249 Ca 0.58 -0.79 -0.11 0.00 -0.39 0.00 0.00 64.86 64.15 1jhz h ILE 249 Cb 1.34 1.08 -0.02 0.00 -3.07 0.00 0.00 36.82 36.15 1jhz h ILE 249 CO -0.31 0.27 -0.15 0.24 -0.69 0.00 0.00 178.15 177.51 1jhz h MET 250 N 0.41 0.86 -0.94 2.37 2.86 -1.12 -2.26 114.93 117.12 1jhz h MET 250 Ca 0.11 -0.31 0.12 0.00 -2.06 0.00 0.00 59.70 57.55 1jhz h MET 250 Cb 0.33 -0.06 -0.07 0.00 0.06 0.00 0.00 31.60 31.86 1jhz h MET 250 CO 0.00 0.95 0.60 0.00 1.06 0.00 0.00 176.91 179.52 1jhz h ALA 251 N 1.07 1.64 -0.99 6.32 0.00 0.35 -0.15 119.26 127.50 1jhz h ALA 251 Ca 0.12 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.07 1jhz h ALA 251 Cb 0.67 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.22 1jhz h ALA 251 CO 0.05 0.13 0.65 1.98 0.00 0.00 0.00 179.25 182.06 1jhz h MET 252 N 0.88 1.23 -0.39 0.00 -1.53 -0.40 -0.28 114.93 114.44 1jhz h MET 252 Ca 0.46 -0.07 -0.14 0.00 -3.44 0.00 0.00 59.70 56.50 1jhz h MET 252 Cb 0.53 -0.28 -0.01 0.00 -0.55 0.00 0.00 31.60 31.30 1jhz h MET 252 CO -0.22 0.82 -0.32 0.78 0.14 0.00 0.00 176.91 178.10 1jhz h GLY 253 N 1.27 0.94 0.96 1.39 0.00 -1.05 -2.49 103.07 104.10 1jhz h GLY 253 Ca 0.39 -0.90 -0.02 0.00 0.00 0.00 0.00 47.33 46.80 1jhz h GLY 253 CO -0.12 0.82 0.21 0.00 0.00 0.00 0.00 176.54 177.45 1jhz h ALA 254 N 0.90 0.58 -0.64 3.60 0.00 -0.50 -0.38 119.26 122.82 1jhz h ALA 254 Ca 0.08 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 54.92 1jhz h ALA 254 Cb 0.88 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.45 1jhz h ALA 254 CO 0.08 0.14 0.37 -0.07 0.00 0.00 0.00 179.25 179.77 1jhz h LEU 255 N 0.58 0.56 -0.44 0.00 4.07 -0.98 -1.07 115.31 118.03 1jhz h LEU 255 Ca 0.15 0.02 -0.07 0.00 0.08 0.00 0.00 57.88 58.07 1jhz h LEU 255 Cb 0.12 -0.09 -0.02 0.00 1.08 0.00 0.00 40.66 41.75 1jhz h LEU 255 CO -0.02 0.37 0.02 0.00 -1.08 0.00 0.00 178.44 177.73 1jhz h ALA 257 N 0.92 0.15 -0.32 0.00 0.00 -0.39 -2.16 119.26 117.45 1jhz h ALA 257 Ca 0.13 0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.15 1jhz h ALA 257 Cb 0.47 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 1jhz h ALA 257 CO 0.02 -0.46 0.07 0.00 0.00 0.00 0.00 179.25 178.88 1jhz h ALA 258 N 1.19 0.34 -0.25 0.00 0.00 -1.16 -2.70 119.26 116.68 1jhz h ALA 258 Ca 0.09 0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.11 1jhz h ALA 258 Cb 0.14 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 1jhz h ALA 258 CO -0.19 -0.33 -0.07 0.22 0.00 0.00 0.00 179.25 178.88 1jhz h ASP 259 N 0.19 -0.27 0.37 0.00 3.58 -1.16 -1.23 116.42 117.90 1jhz h ASP 259 Ca 0.15 0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.68 1jhz h ASP 259 Cb 0.15 0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.37 1jhz h ASP 259 CO -0.18 -0.10 0.00 -0.33 -2.88 0.00 0.00 179.24 175.75 1jhz h GLU 260 N -0.02 0.00 -0.43 0.28 5.08 -1.23 -1.39 114.58 116.87 1jhz h GLU 260 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1jhz h GLU 260 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1jhz h GLU 260 CO -0.27 0.00 0.00 -1.33 -1.00 0.00 0.00 179.01 176.41 1jhz n MET 261 N -2.40 2.35 -0.11 2.33 2.81 -0.51 -4.95 117.12 116.64 1jhz n MET 261 Ca -0.00 -2.06 0.00 0.00 -1.81 0.00 0.00 57.70 53.83 1jhz n MET 261 Cb 0.14 -1.48 0.00 0.00 -0.71 0.00 0.00 33.22 31.16 1jhz n MET 261 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1jhz n GLY 262 N 1.44 1.83 3.85 3.03 0.00 -0.52 -5.05 105.19 109.75 1jhz n GLY 262 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 1jhz n GLY 262 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jhz s LEU 263 N 0.00 4.07 -0.02 0.99 1.02 -0.92 -4.99 118.68 118.83 1jhz s LEU 263 Ca 0.00 1.31 -0.01 0.00 0.02 0.00 0.00 54.13 55.45 1jhz s LEU 263 Cb 0.00 -4.08 -0.04 0.00 0.02 0.00 0.00 46.19 42.09 1jhz s LEU 263 CO 0.00 -0.20 0.09 -0.13 0.02 0.00 0.00 176.35 176.13 1jhz s ARG 264 N -2.94 3.12 -0.14 1.70 0.52 -1.26 -3.81 118.95 116.14 1jhz s ARG 264 Ca 0.54 -0.44 0.02 0.00 -0.52 0.00 0.00 55.73 55.33 1jhz s ARG 264 Cb -0.10 -2.90 0.01 0.00 0.52 0.00 0.00 34.95 32.47 1jhz s ARG 264 CO 0.17 0.66 -0.21 0.08 0.02 0.00 0.00 175.30 176.02 1jhz s VAL 265 N -1.18 2.13 -1.13 3.52 1.01 -1.26 0.24 120.40 123.73 1jhz s VAL 265 Ca 0.22 -0.96 0.18 0.00 0.00 0.00 0.00 61.98 61.43 1jhz s VAL 265 Cb -0.12 -1.85 0.73 0.00 0.00 0.00 0.00 36.38 35.14 1jhz s VAL 265 CO 0.13 0.55 1.64 -0.81 0.00 0.00 0.00 175.10 176.61 1jhz n PRO 266 N 4.01 3.78 -0.19 2.72 -0.04 -1.24 -4.76 135.00 139.29 1jhz n PRO 266 Ca -0.20 -2.91 -0.03 0.00 -0.04 0.00 0.00 63.50 60.32 1jhz n PRO 266 Cb 0.52 -1.91 0.08 0.00 -0.04 0.00 0.00 33.50 32.14 1jhz n PRO 266 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1jhz h GLN 267 N 4.14 0.50 0.02 0.54 7.50 -1.94 -3.27 115.11 122.60 1jhz h GLN 267 Ca 0.00 -0.03 -0.40 0.00 0.50 0.00 0.00 58.65 58.72 1jhz h GLN 267 Cb 1.47 -0.11 -0.06 0.00 0.05 0.00 0.00 27.48 28.83 1jhz h GLN 267 CO 0.24 0.33 -2.35 -0.25 -1.50 0.00 0.00 178.83 175.30 1jhz n ASP 268 N -4.89 1.98 -3.93 1.46 8.00 0.14 -4.97 116.55 114.34 1jhz n ASP 268 Ca 0.06 0.11 -0.18 0.00 0.71 0.00 0.00 54.79 55.49 1jhz n ASP 268 Cb 0.18 -0.65 -0.15 0.00 -0.02 0.00 0.00 41.12 40.48 1jhz n ASP 268 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1jhz s VAL 269 N -2.51 0.45 0.07 2.53 1.01 -0.19 -4.83 120.40 116.93 1jhz s VAL 269 Ca -0.34 -0.17 -0.06 0.00 0.00 0.00 0.00 61.98 61.40 1jhz s VAL 269 Cb 0.10 -0.43 -0.05 0.00 0.00 0.00 0.00 36.38 36.00 1jhz s VAL 269 CO 0.58 0.16 0.33 -0.44 0.00 0.00 0.00 175.10 175.74 1jhz s SER 270 N 0.33 6.52 -0.05 3.32 0.01 -0.72 -3.58 113.70 119.53 1jhz s SER 270 Ca -0.04 0.61 -0.03 0.00 1.31 0.00 0.00 55.95 57.80 1jhz s SER 270 Cb -0.08 -2.10 0.02 0.00 0.21 0.00 0.00 66.02 64.07 1jhz s SER 270 CO -0.00 0.17 0.11 -0.22 0.41 0.00 0.00 173.24 173.71 1jhz s LEU 271 N -2.11 1.19 -0.03 2.44 2.96 0.52 -1.56 118.68 122.09 1jhz s LEU 271 Ca 0.33 0.23 0.03 0.00 -0.22 0.00 0.00 54.13 54.50 1jhz s LEU 271 Cb -0.13 0.32 0.00 0.00 0.50 0.00 0.00 46.19 46.88 1jhz s LEU 271 CO 0.20 -0.09 -0.13 -0.51 -1.32 0.00 0.00 176.35 174.50 1jhz s ILE 272 N 0.61 1.06 0.00 6.68 2.07 -0.99 -4.36 121.20 126.28 1jhz s ILE 272 Ca -0.05 -0.51 0.00 0.00 -1.41 0.00 0.00 60.65 58.68 1jhz s ILE 272 Cb -0.06 -0.93 0.00 0.00 0.13 0.00 0.00 42.46 41.60 1jhz s ILE 272 CO -0.03 0.32 0.00 0.61 -1.91 0.00 0.00 174.94 173.93 1jhz n GLY 273 N 3.23 2.74 3.60 1.50 0.00 -0.79 -0.60 105.19 114.87 1jhz n GLY 273 Ca -0.18 -1.97 -0.06 0.00 0.00 0.00 0.00 46.02 43.81 1jhz n GLY 273 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1jhz s TYR 274 N 2.26 -1.09 0.00 1.61 6.14 -1.19 -3.48 117.35 121.59 1jhz s TYR 274 Ca 0.00 2.10 0.00 0.00 0.64 0.00 0.00 57.07 59.81 1jhz s TYR 274 Cb 0.00 0.64 0.00 0.00 0.42 0.00 0.00 41.96 43.02 1jhz s TYR 274 CO 0.00 -0.55 0.00 -0.25 0.64 0.00 0.00 175.55 175.39 1jhz n ASP 275 N 4.62 0.00 -2.26 4.32 8.00 0.13 -1.33 116.55 130.03 1jhz n ASP 275 Ca -0.18 0.00 -0.07 0.00 0.71 0.00 0.00 54.79 55.25 1jhz n ASP 275 Cb 0.56 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 41.69 1jhz n ASP 275 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1jhz n ASN 276 N 0.00 -3.85 -4.73 -2.24 5.15 -1.22 -1.93 115.26 106.44 1jhz n ASN 276 Ca 0.00 -0.31 -0.31 0.00 -0.60 0.00 0.00 54.58 53.36 1jhz n ASN 276 Cb 0.00 -2.61 0.12 0.00 -0.53 0.00 0.00 39.78 36.76 1jhz n ASN 276 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1jhz s VAL 277 N -3.17 2.91 0.18 3.44 -7.23 -1.26 -4.88 120.40 110.39 1jhz s VAL 277 Ca 0.18 0.30 -0.22 0.00 -1.81 0.00 0.00 61.98 60.42 1jhz s VAL 277 Cb -0.02 -2.68 0.08 0.00 0.56 0.00 0.00 36.38 34.32 1jhz s VAL 277 CO 0.33 -0.39 1.43 -1.14 -0.31 0.00 0.00 175.10 175.03 1jhz n ARG 278 N -3.78 -0.31 0.00 4.82 0.63 -1.26 -1.36 116.66 115.40 1jhz n ARG 278 Ca 0.09 1.42 0.11 0.00 -0.92 0.00 0.00 57.85 58.55 1jhz n ARG 278 Cb 0.53 -2.09 0.60 0.00 0.45 0.00 0.00 32.46 31.95 1jhz n ARG 278 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1jhz n ASN 279 N -5.27 0.00 -0.28 6.15 3.02 -1.26 -4.41 115.26 113.22 1jhz n ASN 279 Ca 0.06 -0.12 0.07 0.00 -0.03 0.00 0.00 54.58 54.56 1jhz n ASN 279 Cb 0.31 -0.26 0.18 0.00 -0.61 0.00 0.00 39.78 39.40 1jhz n ASN 279 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1jhz h ALA 280 N 3.13 0.84 0.00 5.41 0.00 -1.56 0.81 119.26 127.89 1jhz h ALA 280 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1jhz h ALA 280 Cb 0.20 0.47 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1jhz h ALA 280 CO 0.00 -0.44 0.00 -0.09 0.00 0.00 0.00 179.25 178.72 1jhz h ARG 281 N 0.08 0.00 -0.55 0.00 1.12 -1.82 -2.31 114.38 110.91 1jhz h ARG 281 Ca 0.45 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 59.32 1jhz h ARG 281 Cb 0.80 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.76 1jhz h ARG 281 CO -0.73 0.00 0.00 0.66 -3.11 0.00 0.00 179.97 176.79 1jhz n TYR 282 N -2.39 1.11 -1.84 2.20 4.01 0.27 -4.55 117.16 115.97 1jhz n TYR 282 Ca -0.01 -0.60 -0.29 0.00 -0.16 0.00 0.00 57.90 56.84 1jhz n TYR 282 Cb 0.11 -0.16 0.09 0.00 -0.31 0.00 0.00 39.34 39.06 1jhz n TYR 282 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1jhz s PHE 283 N -1.63 2.95 -0.27 -0.72 0.40 -0.88 -4.95 117.98 112.88 1jhz s PHE 283 Ca 0.44 0.82 0.02 0.00 -0.60 0.00 0.00 56.93 57.61 1jhz s PHE 283 Cb 0.27 -3.41 0.07 0.00 0.51 0.00 0.00 43.02 40.46 1jhz s PHE 283 CO 0.22 -1.77 -0.05 0.99 0.70 0.00 0.00 175.22 175.32 1jhz s THR 284 N -3.50 1.88 0.89 0.64 2.01 -1.26 -2.27 115.64 114.03 1jhz s THR 284 Ca 0.62 -1.60 -0.12 0.00 0.31 0.00 0.00 61.69 60.89 1jhz s THR 284 Cb -0.12 -2.14 0.17 0.00 0.01 0.00 0.00 72.50 70.42 1jhz s THR 284 CO 0.50 -0.20 1.24 -2.16 -0.69 0.00 0.00 174.62 173.31 1jhz s PRO 285 N 1.20 1.04 -0.08 4.92 0.04 -1.26 -4.95 135.00 135.91 1jhz s PRO 285 Ca -0.03 -0.47 -0.34 0.00 0.04 0.00 0.00 61.00 60.20 1jhz s PRO 285 Cb -0.19 -1.96 -0.11 0.00 0.04 0.00 0.00 34.50 32.28 1jhz s PRO 285 CO -0.07 -2.10 1.89 0.00 0.04 0.00 0.00 177.00 176.76 1jhz n ALA 286 N -3.52 0.93 -2.13 8.56 0.00 -0.96 -4.76 120.51 118.64 1jhz n ALA 286 Ca 0.14 0.28 -0.42 0.00 0.00 0.00 0.00 53.44 53.43 1jhz n ALA 286 Cb 0.60 -2.52 -0.03 0.00 0.00 0.00 0.00 19.45 17.51 1jhz n ALA 286 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1jhz s LEU 287 N 4.12 4.31 -0.06 0.00 2.96 -1.15 -0.37 118.68 128.50 1jhz s LEU 287 Ca 0.93 2.18 -0.26 0.00 -0.22 0.00 0.00 54.13 56.75 1jhz s LEU 287 Cb -0.67 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 42.44 1jhz s LEU 287 CO 0.51 -0.81 0.82 -0.89 -1.32 0.00 0.00 176.35 174.66 1jhz s THR 288 N 3.02 4.95 0.37 3.68 2.01 -1.26 -4.51 115.64 123.90 1jhz s THR 288 Ca 0.68 1.70 -0.10 0.00 0.31 0.00 0.00 61.69 64.28 1jhz s THR 288 Cb -0.33 -4.16 0.03 0.00 0.01 0.00 0.00 72.50 68.06 1jhz s THR 288 CO 0.27 0.18 0.66 0.28 -0.69 0.00 0.00 174.62 175.32 1jhz s THR 289 N 1.13 0.00 -0.28 -0.82 -1.32 -0.73 -1.88 115.64 111.74 1jhz s THR 289 Ca 0.43 -1.25 -0.07 0.00 -1.21 0.00 0.00 61.69 59.58 1jhz s THR 289 Cb -0.19 -2.81 -0.01 0.00 -1.51 0.00 0.00 72.50 67.98 1jhz s THR 289 CO 0.20 0.00 0.08 -0.63 -2.21 0.00 0.00 174.62 172.07 1jhz s ILE 290 N -2.55 4.20 -0.28 5.08 -1.09 -1.23 -0.64 121.20 124.68 1jhz s ILE 290 Ca 0.22 -0.42 -0.29 0.00 -2.23 0.00 0.00 60.65 57.93 1jhz s ILE 290 Cb -0.03 -3.07 -0.01 0.00 -1.58 0.00 0.00 42.46 37.77 1jhz s ILE 290 CO 0.16 0.20 1.48 -2.28 -1.23 0.00 0.00 174.94 173.26 1jhz s HIS 291 N 1.57 2.35 -0.41 3.97 5.65 0.15 0.19 115.29 128.76 1jhz s HIS 291 Ca 0.05 0.69 -0.07 0.00 0.25 0.00 0.00 55.06 55.98 1jhz s HIS 291 Cb -0.16 -4.01 0.09 0.00 -1.18 0.00 0.00 32.58 27.32 1jhz s HIS 291 CO 0.03 -2.33 0.23 -1.14 -0.65 0.00 0.00 174.74 170.88 1jhz s GLN 292 N 4.58 2.40 -0.47 2.88 2.00 -0.81 -2.26 119.66 127.97 1jhz s GLN 292 Ca 0.65 -1.58 -0.27 0.00 -2.00 0.00 0.00 55.36 52.16 1jhz s GLN 292 Cb -0.20 -3.68 -0.04 0.00 0.80 0.00 0.00 33.01 29.89 1jhz s GLN 292 CO 0.28 -0.98 2.09 -1.25 -0.50 0.00 0.00 175.29 174.92 1jhz s PRO 293 N 1.32 2.62 -0.21 1.67 0.05 -1.26 -4.78 135.00 134.41 1jhz s PRO 293 Ca 0.04 1.21 -0.07 0.00 0.05 0.00 0.00 61.00 62.23 1jhz s PRO 293 Cb -0.23 -4.42 -0.19 0.00 0.05 0.00 0.00 34.50 29.70 1jhz s PRO 293 CO -0.00 -2.70 0.00 1.63 0.05 0.00 0.00 177.00 175.98 1jhz n LYS 294 N 8.94 0.66 -0.31 4.56 4.76 -1.26 -3.97 118.16 131.55 1jhz n LYS 294 Ca 0.28 0.27 0.05 0.00 -2.87 0.00 0.00 58.31 56.03 1jhz n LYS 294 Cb 0.51 -1.61 0.25 0.00 -1.84 0.00 0.00 35.03 32.34 1jhz n LYS 294 CO 0.00 0.00 0.00 -0.44 -1.37 0.00 0.00 177.40 175.59 1jhz h ASP 295 N -0.30 0.89 -0.34 4.39 3.32 -1.86 -1.82 116.42 120.70 1jhz h ASP 295 Ca -0.52 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 56.51 1jhz h ASP 295 Cb 1.81 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 41.17 1jhz h ASP 295 CO -0.11 0.56 0.10 -1.28 -1.72 0.00 0.00 179.24 176.78 1jhz h SER 296 N 1.00 0.50 0.21 6.45 0.87 -1.96 -1.76 113.55 118.86 1jhz h SER 296 Ca 0.40 -0.21 0.01 0.00 -1.23 0.00 0.00 61.79 60.76 1jhz h SER 296 Cb 0.26 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 62.06 1jhz h SER 296 CO -0.16 0.58 -0.33 -0.07 -0.53 0.00 0.00 176.83 176.32 1jhz h LEU 297 N 0.39 -0.94 -0.36 2.23 3.38 -1.48 -0.45 115.31 118.08 1jhz h LEU 297 Ca 0.11 0.10 0.08 0.00 0.09 0.00 0.00 57.88 58.25 1jhz h LEU 297 Cb 0.27 0.34 -0.08 0.00 0.09 0.00 0.00 40.66 41.28 1jhz h LEU 297 CO -0.00 -0.44 -0.17 1.23 0.09 0.00 0.00 178.44 179.15 1jhz h GLY 298 N -0.62 0.11 0.58 0.83 0.00 -1.34 0.77 103.07 103.41 1jhz h GLY 298 Ca 0.01 0.21 0.03 0.00 0.00 0.00 0.00 47.33 47.58 1jhz h GLY 298 CO -0.14 -0.18 -0.17 -2.09 0.00 0.00 0.00 176.54 173.96 1jhz h GLU 299 N -0.11 -0.27 -0.19 4.80 4.81 -1.05 -0.85 114.58 121.71 1jhz h GLU 299 Ca 0.18 0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.46 1jhz h GLU 299 Cb 0.38 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.79 1jhz h GLU 299 CO -0.43 -0.18 -0.00 1.15 -0.73 0.00 0.00 179.01 178.82 1jhz h THR 300 N -0.28 0.86 -0.28 0.32 2.02 -0.47 -1.34 112.91 113.74 1jhz h THR 300 Ca 0.05 -0.02 0.03 0.00 0.77 0.00 0.00 66.41 67.25 1jhz h THR 300 Cb 0.35 0.80 -0.03 0.00 -1.74 0.00 0.00 68.15 67.53 1jhz h THR 300 CO -0.16 0.01 0.07 0.00 0.37 0.00 0.00 175.52 175.81 1jhz h ALA 301 N 1.17 0.30 -0.82 6.16 0.00 -0.59 -1.23 119.26 124.24 1jhz h ALA 301 Ca 0.09 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1jhz h ALA 301 Cb 0.11 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 1jhz h ALA 301 CO -0.16 -0.34 0.47 0.35 0.00 0.00 0.00 179.25 179.58 1jhz h PHE 302 N 0.18 1.09 -0.25 0.00 3.57 -0.91 -1.67 116.94 118.95 1jhz h PHE 302 Ca 0.12 -0.01 -0.16 0.00 3.53 0.00 0.00 57.97 61.46 1jhz h PHE 302 Cb 0.11 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 38.49 1jhz h PHE 302 CO -0.15 0.73 -0.48 -0.91 -2.23 0.00 0.00 178.31 175.27 1jhz h ASN 303 N 1.13 0.72 -0.83 0.41 2.35 -0.96 -2.71 115.58 115.69 1jhz h ASN 303 Ca 0.29 -0.36 -0.00 0.00 -0.55 0.00 0.00 56.30 55.68 1jhz h ASN 303 Cb -0.02 -0.20 -0.04 0.00 0.05 0.00 0.00 38.32 38.11 1jhz h ASN 303 CO -0.05 1.08 0.52 0.24 -1.65 0.00 0.00 177.43 177.57 1jhz h MET 304 N 0.52 1.12 -0.80 0.81 2.86 -0.66 -2.01 114.93 116.78 1jhz h MET 304 Ca 0.03 -0.09 -0.02 0.00 -2.06 0.00 0.00 59.70 57.55 1jhz h MET 304 Cb 1.03 -0.24 -0.04 0.00 0.06 0.00 0.00 31.60 32.41 1jhz h MET 304 CO 0.10 0.77 0.41 1.25 1.06 0.00 0.00 176.91 180.50 1jhz h LEU 305 N 1.14 1.01 -1.14 1.22 5.85 -1.12 -2.22 115.31 120.05 1jhz h LEU 305 Ca 0.30 -0.10 -0.08 0.00 0.84 0.00 0.00 57.88 58.84 1jhz h LEU 305 Cb -0.07 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.69 1jhz h LEU 305 CO -0.06 0.83 -0.27 -0.07 -0.34 0.00 0.00 178.44 178.54 1jhz h LEU 306 N 1.12 0.27 -0.35 2.25 4.07 -1.10 -1.74 115.31 119.83 1jhz h LEU 306 Ca 0.28 -0.08 -0.09 0.00 0.08 0.00 0.00 57.88 58.07 1jhz h LEU 306 Cb 0.07 -0.07 -0.01 0.00 1.08 0.00 0.00 40.66 41.73 1jhz h LEU 306 CO -0.04 0.54 -0.13 0.44 -1.08 0.00 0.00 178.44 178.17 1jhz h ASP 307 N 0.24 0.71 0.66 -0.43 3.32 -0.91 -3.07 116.42 116.94 1jhz h ASP 307 Ca 0.04 -0.39 -0.07 0.00 0.02 0.00 0.00 57.03 56.63 1jhz h ASP 307 Cb 0.61 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 1jhz h ASP 307 CO 0.04 0.94 -0.32 0.03 -1.72 0.00 0.00 179.24 178.22 1jhz h ARG 308 N 0.48 0.00 -0.57 3.56 3.08 -1.06 0.40 114.38 120.27 1jhz h ARG 308 Ca 0.08 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.06 1jhz h ARG 308 Cb 0.65 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.68 1jhz h ARG 308 CO 0.04 0.32 0.07 0.82 -1.07 0.00 0.00 179.97 180.15 1jhz h ILE 309 N 0.00 1.25 -0.90 2.04 2.04 -1.23 -1.16 117.51 119.56 1jhz h ILE 309 Ca -0.00 -0.99 -0.53 0.00 1.00 0.00 0.00 64.86 64.34 1jhz h ILE 309 Cb 0.73 0.73 -0.27 0.00 -0.74 0.00 0.00 36.82 37.27 1jhz h ILE 309 CO 0.04 0.36 0.68 1.33 0.00 0.00 0.00 178.15 180.56 1jhz n VAL 310 N -4.22 3.19 -4.11 1.67 0.24 -1.12 -4.90 118.33 109.07 1jhz n VAL 310 Ca 0.04 -2.13 -0.29 0.00 -2.04 0.00 0.00 64.34 59.92 1jhz n VAL 310 Cb 0.28 -0.81 -0.05 0.00 -1.47 0.00 0.00 33.84 31.80 1jhz n VAL 310 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1jhz n ASN 311 N -0.86 -0.29 -4.55 -1.34 5.03 -0.44 -4.99 115.26 107.83 1jhz n ASN 311 Ca 0.55 -1.10 -0.31 0.00 0.87 0.00 0.00 54.58 54.59 1jhz n ASN 311 Cb 1.18 -2.52 -0.11 0.00 -1.02 0.00 0.00 39.78 37.30 1jhz n ASN 311 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1jhz s LYS 312 N -6.87 2.34 -0.90 3.52 1.02 0.14 -4.80 119.74 114.19 1jhz s LYS 312 Ca 0.11 -0.85 -0.22 0.00 0.02 0.00 0.00 55.97 55.02 1jhz s LYS 312 Cb -0.06 -2.38 0.03 0.00 -0.52 0.00 0.00 37.83 34.91 1jhz s LYS 312 CO 0.93 0.57 0.52 2.89 -0.92 0.00 0.00 175.35 179.34 1jhz n ARG 313 N 1.39 -0.55 0.26 1.68 1.85 -1.26 -3.10 116.66 116.92 1jhz n ARG 313 Ca -0.15 0.07 0.16 0.00 -1.00 0.00 0.00 57.85 56.93 1jhz n ARG 313 Cb 0.52 -1.73 0.56 0.00 -1.05 0.00 0.00 32.46 30.77 1jhz n ARG 313 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 1jhz h GLU 314 N -1.17 0.00 -7.07 2.89 5.08 -1.93 -3.45 114.58 108.93 1jhz h GLU 314 Ca -0.56 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.29 1jhz h GLU 314 Cb 1.12 0.00 0.08 0.00 0.50 0.00 0.00 28.75 30.44 1jhz h GLU 314 CO 0.39 0.00 0.45 -1.83 -1.00 0.00 0.00 179.01 177.02 1jhz s GLU 315 N -3.55 3.38 0.30 2.33 1.03 -1.26 -4.95 118.70 115.98 1jhz s GLU 315 Ca 0.03 1.69 -0.27 0.00 0.03 0.00 0.00 54.97 56.45 1jhz s GLU 315 Cb 0.08 -2.08 -0.14 0.00 -0.80 0.00 0.00 34.13 31.19 1jhz s GLU 315 CO 0.57 -0.85 0.96 -2.30 -1.33 0.00 0.00 175.26 172.30 1jhz n PRO 316 N -1.17 1.23 -4.51 -4.83 -0.02 -1.26 -5.00 135.00 119.45 1jhz n PRO 316 Ca 0.11 0.43 -0.24 0.00 -2.02 0.00 0.00 63.50 61.78 1jhz n PRO 316 Cb 0.50 -1.80 -0.10 0.00 -0.02 0.00 0.00 33.50 32.08 1jhz n PRO 316 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1jhz s GLN 317 N -1.57 1.73 -0.18 -0.52 2.00 -1.26 -5.03 119.66 114.83 1jhz s GLN 317 Ca 0.59 -1.90 0.00 0.00 -2.00 0.00 0.00 55.36 52.06 1jhz s GLN 317 Cb -0.69 -1.48 0.04 0.00 0.80 0.00 0.00 33.01 31.67 1jhz s GLN 317 CO 0.59 0.08 -0.10 0.45 -0.50 0.00 0.00 175.29 175.81 1jhz s SER 318 N -3.55 3.07 -0.31 6.67 0.15 -1.26 -1.20 113.70 117.27 1jhz s SER 318 Ca 0.32 -0.72 -0.10 0.00 0.70 0.00 0.00 55.95 56.14 1jhz s SER 318 Cb 0.04 -1.15 -0.02 0.00 -1.71 0.00 0.00 66.02 63.17 1jhz s SER 318 CO 0.15 -0.13 0.17 -0.63 1.20 0.00 0.00 173.24 174.01 1jhz s ILE 319 N 1.47 4.88 -0.03 6.45 1.01 0.14 -4.97 121.20 130.15 1jhz s ILE 319 Ca 0.01 -0.23 0.06 0.00 0.00 0.00 0.00 60.65 60.49 1jhz s ILE 319 Cb -0.15 -3.44 -0.01 0.00 0.01 0.00 0.00 42.46 38.87 1jhz s ILE 319 CO -0.09 0.11 -0.21 -0.70 0.00 0.00 0.00 174.94 174.05 1jhz s GLU 320 N 1.67 1.93 0.08 2.79 2.12 -1.26 -0.16 118.70 125.87 1jhz s GLU 320 Ca 0.06 -0.75 0.06 0.00 0.36 0.00 0.00 54.97 54.69 1jhz s GLU 320 Cb -0.17 -1.75 -0.03 0.00 0.26 0.00 0.00 34.13 32.44 1jhz s GLU 320 CO 0.08 0.38 -0.15 0.14 -0.54 0.00 0.00 175.26 175.17 1jhz s VAL 321 N -0.26 1.20 -0.11 3.70 -7.23 -0.13 -4.98 120.40 112.59 1jhz s VAL 321 Ca 0.02 -1.39 0.03 0.00 -1.81 0.00 0.00 61.98 58.84 1jhz s VAL 321 Cb -0.10 -1.19 0.00 0.00 0.56 0.00 0.00 36.38 35.65 1jhz s VAL 321 CO 0.01 -0.23 -0.23 -1.00 -0.31 0.00 0.00 175.10 173.34 1jhz s HIS 322 N -1.38 2.55 0.63 2.82 3.76 -1.26 -3.97 115.29 118.44 1jhz s HIS 322 Ca 0.00 -1.13 -0.14 0.00 -0.15 0.00 0.00 55.06 53.64 1jhz s HIS 322 Cb -0.09 -1.72 -0.02 0.00 1.11 0.00 0.00 32.58 31.86 1jhz s HIS 322 CO 0.03 -0.48 1.06 -1.25 -0.85 0.00 0.00 174.74 173.24 1jhz s PRO 323 N 0.51 3.17 0.03 8.40 0.04 -1.26 -4.83 135.00 141.07 1jhz s PRO 323 Ca -0.15 1.13 0.02 0.00 0.04 0.00 0.00 61.00 62.04 1jhz s PRO 323 Cb -0.17 -2.02 -0.02 0.00 0.04 0.00 0.00 34.50 32.34 1jhz s PRO 323 CO 0.05 -0.92 -0.07 -0.98 0.04 0.00 0.00 177.00 175.12 1jhz s ARG 324 N -4.39 0.51 -0.02 4.56 1.70 -0.96 -4.92 118.95 115.44 1jhz s ARG 324 Ca 0.62 -0.58 -0.27 0.00 -0.47 0.00 0.00 55.73 55.03 1jhz s ARG 324 Cb -0.15 -0.36 -0.04 0.00 -0.57 0.00 0.00 34.95 33.83 1jhz s ARG 324 CO 0.43 0.08 0.86 -1.17 -1.08 0.00 0.00 175.30 174.41 1jhz s LEU 325 N -1.11 4.36 -0.34 -1.89 1.98 -1.26 0.31 118.68 120.73 1jhz s LEU 325 Ca -0.06 1.47 0.04 0.00 -2.89 0.00 0.00 54.13 52.69 1jhz s LEU 325 Cb -0.07 -3.36 0.10 0.00 0.66 0.00 0.00 46.19 43.51 1jhz s LEU 325 CO 0.00 -0.17 0.05 -0.63 -1.89 0.00 0.00 176.35 173.71 1jhz s ILE 326 N 0.80 2.34 -0.07 6.68 1.01 0.18 -4.93 121.20 127.21 1jhz s ILE 326 Ca 0.45 -2.31 -0.30 0.00 0.00 0.00 0.00 60.65 58.50 1jhz s ILE 326 Cb -0.20 -2.71 -0.03 0.00 0.01 0.00 0.00 42.46 39.53 1jhz s ILE 326 CO 0.24 -0.58 1.25 -1.61 0.00 0.00 0.00 174.94 174.23 1jhz s GLU 327 N 0.92 4.32 0.00 2.79 2.02 -1.26 -1.78 118.70 125.71 1jhz s GLU 327 Ca 0.10 1.72 0.00 0.00 0.02 0.00 0.00 54.97 56.81 1jhz s GLU 327 Cb -0.19 -3.60 0.00 0.00 0.10 0.00 0.00 34.13 30.44 1jhz s GLU 327 CO -0.08 -0.51 0.00 0.54 0.02 0.00 0.00 175.26 175.23 1jhz n ARG 328 N 5.48 0.00 0.00 1.61 1.74 -1.26 -4.96 116.66 119.27 1jhz n ARG 328 Ca 0.12 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.20 1jhz n ARG 328 Cb 0.46 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.90 1jhz n ARG 328 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1jhz n ARG 329 N 0.00 1.74 -0.12 5.56 1.74 0.50 -4.76 116.66 121.33 1jhz n ARG 329 Ca 0.00 -1.10 0.10 0.00 -0.77 0.00 0.00 57.85 56.09 1jhz n ARG 329 Cb 0.00 -0.87 0.32 0.00 -1.02 0.00 0.00 32.46 30.89 1jhz n ARG 329 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1jhz n SER 330 N -0.31 2.11 -4.12 0.55 3.41 -0.82 -4.49 113.62 109.95 1jhz n SER 330 Ca 0.00 -1.80 -0.27 0.00 -0.26 0.00 0.00 58.87 56.54 1jhz n SER 330 Cb 0.28 -0.15 -0.16 0.00 -0.26 0.00 0.00 64.21 63.91 1jhz n SER 330 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1jhz s VAL 331 N -1.69 1.47 0.40 -3.33 1.01 -1.26 -0.36 120.40 116.63 1jhz s VAL 331 Ca 0.33 -0.70 0.07 0.00 0.00 0.00 0.00 61.98 61.68 1jhz s VAL 331 Cb 0.18 -1.28 -0.08 0.00 0.00 0.00 0.00 36.38 35.20 1jhz s VAL 331 CO 0.27 0.43 0.01 0.00 0.00 0.00 0.00 175.10 175.80 1jhz s ALA 332 N 0.31 3.09 0.19 5.51 0.00 -1.26 -4.96 121.76 124.64 1jhz s ALA 332 Ca -0.11 -2.27 -0.31 0.00 0.00 0.00 0.00 51.96 49.27 1jhz s ALA 332 Cb -0.14 0.19 -0.10 0.00 0.00 0.00 0.00 23.12 23.07 1jhz s ALA 332 CO 0.04 -0.12 1.51 -0.51 0.00 0.00 0.00 175.76 176.68 1jhz s ASP 333 N -3.68 6.63 0.64 0.00 1.11 -1.26 -4.90 116.67 115.21 1jhz s ASP 333 Ca 0.35 2.61 -0.09 0.00 0.18 0.00 0.00 52.55 55.60 1jhz s ASP 333 Cb 0.09 -2.60 0.01 0.00 1.07 0.00 0.00 42.92 41.48 1jhz s ASP 333 CO 0.18 -0.77 1.00 -0.83 1.18 0.00 0.00 175.17 175.93 1jhz s GLY 334 N 0.85 1.61 0.15 0.21 0.00 0.16 -4.93 107.32 105.37 1jhz s GLY 334 Ca 0.66 -0.47 0.12 0.00 0.00 0.00 0.00 44.72 45.02 1jhz s GLY 334 CO 0.36 -0.16 1.36 -1.55 0.00 0.00 0.00 173.10 173.11 1jhz n PRO 335 N -2.79 0.07 -0.60 2.90 -0.04 -1.11 -2.36 135.00 131.08 1jhz n PRO 335 Ca 0.06 0.54 0.08 0.00 -0.04 0.00 0.00 63.50 64.13 1jhz n PRO 335 Cb 0.57 -1.72 0.32 0.00 -0.04 0.00 0.00 33.50 32.63 1jhz n PRO 335 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1jhz n PHE 336 N -1.87 1.38 -2.70 0.54 3.72 0.58 -5.00 117.46 114.11 1jhz n PHE 336 Ca -0.00 -0.74 -0.32 0.00 -0.05 0.00 0.00 57.45 56.34 1jhz n PHE 336 Cb 0.04 -0.34 -0.05 0.00 -0.94 0.00 0.00 39.48 38.19 1jhz n PHE 336 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 1jhz s ARG 337 N -2.43 4.03 0.00 -1.08 6.06 -0.99 -4.67 118.95 119.86 1jhz s ARG 337 Ca 0.46 0.90 0.00 0.00 -2.50 0.00 0.00 55.73 54.60 1jhz s ARG 337 Cb 0.34 -2.23 0.00 0.00 0.06 0.00 0.00 34.95 33.13 1jhz s ARG 337 CO 0.15 -0.10 0.00 -3.47 -2.50 0.00 0.00 175.30 169.38 1jhz n ASP 338 N -1.07 0.00 -0.07 -2.12 2.03 -1.26 -5.03 116.55 109.03 1jhz n ASP 338 Ca 0.06 0.00 -0.07 0.00 0.52 0.00 0.00 54.79 55.29 1jhz n ASP 338 Cb 0.54 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.90 1jhz n ASP 338 CO 0.00 0.00 0.00 1.88 -1.92 0.00 0.00 177.20 177.16 1jhz h TYR 339 N 0.00 0.00 0.00 -0.67 -1.99 -1.92 -3.51 116.97 108.88 1jhz h TYR 339 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1jhz h TYR 339 Cb 0.00 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.73 1jhz h TYR 339 CO 0.00 0.34 0.00 -2.13 -0.00 0.00 0.00 178.16 176.37 1jhz n ARG 340 N -4.62 0.00 0.00 4.88 0.00 -1.26 -5.31 116.66 110.36 1jhz n ARG 340 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.75 1jhz n ARG 340 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.76 1jhz n ARG 340 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50