#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jtz h ASP 2 N 0.00 0.37 -3.45 3.17 2.03 -2.04 -3.47 116.42 113.03 2jtz h ASP 2 Ca 0.00 -0.85 -0.24 0.00 -0.73 0.00 0.00 57.03 55.21 2jtz h ASP 2 Cb 0.00 -0.12 -0.31 0.00 -0.83 0.00 0.00 39.33 38.07 2jtz h ASP 2 CO 0.00 1.64 -0.59 -1.81 -1.03 0.00 0.00 179.24 177.45 2jtz s ASP 3 N -7.03 -0.11 0.35 4.15 1.01 -1.26 -5.03 116.67 108.75 2jtz s ASP 3 Ca -0.20 0.30 0.13 0.00 0.71 0.00 0.00 52.55 53.48 2jtz s ASP 3 Cb 0.05 0.19 0.95 0.00 1.01 0.00 0.00 42.92 45.12 2jtz s ASP 3 CO 0.76 -0.14 1.76 -0.29 0.21 0.00 0.00 175.17 177.47 2jtz h ILE 4 N 5.99 0.58 0.00 0.77 2.10 -2.02 0.19 117.51 125.13 2jtz h ILE 4 Ca -0.42 -0.19 -0.22 0.00 1.08 0.00 0.00 64.86 65.11 2jtz h ILE 4 Cb 1.14 -0.01 0.00 0.00 -1.09 0.00 0.00 36.82 36.86 2jtz h ILE 4 CO 0.42 0.10 -0.94 1.88 -1.08 0.00 0.00 178.15 178.53 2jtz h TYR 5 N 0.54 0.56 -0.55 2.19 -1.99 -2.01 -3.18 116.97 112.53 2jtz h TYR 5 Ca 0.60 -0.31 0.16 0.00 2.00 0.00 0.00 58.73 61.18 2jtz h TYR 5 Cb 1.26 -0.06 -0.02 0.00 2.00 0.00 0.00 36.73 39.90 2jtz h TYR 5 CO -0.00 1.13 0.39 -0.22 -0.00 0.00 0.00 178.16 179.46 2jtz h LYS 6 N 0.21 0.02 0.00 4.88 1.63 -1.02 0.27 116.57 122.55 2jtz h LYS 6 Ca -0.08 -0.00 -0.11 0.00 -0.85 0.00 0.00 60.65 59.62 2jtz h LYS 6 Cb 1.58 -0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 33.19 2jtz h LYS 6 CO 0.16 0.02 -0.51 0.00 -3.45 0.00 0.00 179.45 175.66 2jtz h ALA 7 N 1.73 0.87 0.08 5.00 0.00 -1.45 -1.19 119.26 124.29 2jtz h ALA 7 Ca 0.26 -0.46 -0.29 0.00 0.00 0.00 0.00 54.91 54.42 2jtz h ALA 7 Cb 1.02 -0.08 0.03 0.00 0.00 0.00 0.00 17.79 18.75 2jtz h ALA 7 CO -0.01 0.64 -1.17 0.00 0.00 0.00 0.00 179.25 178.70 2jtz h ALA 8 N 1.49 0.05 0.03 0.00 0.00 -0.59 -2.74 119.26 117.49 2jtz h ALA 8 Ca -0.01 -0.75 -0.23 0.00 0.00 0.00 0.00 54.91 53.92 2jtz h ALA 8 Cb 1.11 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2jtz h ALA 8 CO 0.07 0.70 -0.99 -0.24 0.00 0.00 0.00 179.25 178.78 2jtz h VAL 9 N 0.32 1.42 0.00 0.00 3.04 -1.37 0.24 116.25 119.91 2jtz h VAL 9 Ca -0.17 -2.56 -0.03 0.00 -1.01 0.00 0.00 66.70 62.93 2jtz h VAL 9 Cb 1.84 2.52 -0.00 0.00 -2.01 0.00 0.00 31.29 33.63 2jtz h VAL 9 CO 0.23 0.76 -0.15 1.05 -1.01 0.00 0.00 177.57 178.44 2jtz h GLU 10 N 0.19 0.00 0.00 4.17 4.11 -1.30 -3.31 114.58 118.45 2jtz h GLU 10 Ca -0.09 0.00 -0.35 0.00 0.07 0.00 0.00 59.36 58.99 2jtz h GLU 10 Cb 1.65 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.84 2jtz h GLU 10 CO 0.17 0.15 -2.08 0.94 0.07 0.00 0.00 179.01 178.27 2jtz n GLN 11 N -3.31 0.57 -1.21 1.06 -0.06 -1.03 -5.07 117.38 108.32 2jtz n GLN 11 Ca 0.00 0.31 0.11 0.00 -2.00 0.00 0.00 57.00 55.42 2jtz n GLN 11 Cb 0.39 -1.53 -0.06 0.00 -4.06 0.00 0.00 30.24 24.98 2jtz n GLN 11 CO 0.00 0.00 0.00 -0.11 -0.20 0.00 0.00 177.06 176.75 2jtz n LEU 12 N -4.32 -0.98 -3.59 1.69 0.00 0.85 -5.05 117.00 105.60 2jtz n LEU 12 Ca -0.44 2.08 -0.15 0.00 0.00 0.00 0.00 56.01 57.50 2jtz n LEU 12 Cb 0.79 -2.47 -0.06 0.00 0.00 0.00 0.00 43.42 41.67 2jtz n LEU 12 CO 0.08 -1.49 0.28 0.28 0.00 0.00 0.00 177.39 176.54 2jtz s THR 13 N -4.35 0.03 0.23 1.96 -1.32 -1.26 -4.87 115.64 106.06 2jtz s THR 13 Ca 0.00 -0.21 0.21 0.00 -1.21 0.00 0.00 61.69 60.48 2jtz s THR 13 Cb 0.00 -0.93 0.19 0.00 -1.51 0.00 0.00 72.50 70.25 2jtz s THR 13 CO 0.00 -0.12 1.84 -0.33 -2.21 0.00 0.00 174.62 173.80 2jtz h GLU 14 N 3.00 0.00 -0.02 7.08 3.07 -1.99 -2.79 114.58 122.92 2jtz h GLU 14 Ca -0.30 0.00 0.01 0.00 -0.50 0.00 0.00 59.36 58.57 2jtz h GLU 14 Cb 1.19 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.10 2jtz h GLU 14 CO 0.40 0.28 0.02 0.93 -1.40 0.00 0.00 179.01 179.25 2jtz h GLU 15 N 0.00 0.00 0.18 2.33 4.39 -1.96 -2.07 114.58 117.46 2jtz h GLU 15 Ca -0.00 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.71 2jtz h GLU 15 Cb 0.72 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.33 2jtz h GLU 15 CO 0.04 0.00 -0.36 0.37 -1.16 0.00 0.00 179.01 177.89 2jtz h GLN 16 N 0.00 -0.61 0.00 2.33 -0.00 -1.86 0.21 115.11 115.18 2jtz h GLN 16 Ca 0.01 0.04 -0.09 0.00 -0.00 0.00 0.00 58.65 58.62 2jtz h GLN 16 Cb 0.05 0.14 -0.01 0.00 0.00 0.00 0.00 27.48 27.66 2jtz h GLN 16 CO -0.00 -0.41 -0.41 1.57 0.00 0.00 0.00 178.83 179.59 2jtz h LYS 17 N -0.63 0.00 -0.48 1.69 2.10 -1.69 -2.42 116.57 115.13 2jtz h LYS 17 Ca 0.01 0.00 -0.12 0.00 -2.00 0.00 0.00 60.65 58.55 2jtz h LYS 17 Cb 0.64 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.95 2jtz h LYS 17 CO -0.17 0.41 -0.17 -0.97 -2.00 0.00 0.00 179.45 176.55 2jtz h ASN 18 N 0.00 0.95 0.04 7.07 -1.24 -0.72 -1.70 115.58 119.98 2jtz h ASN 18 Ca -0.00 -0.33 -0.00 0.00 0.71 0.00 0.00 56.30 56.67 2jtz h ASN 18 Cb 0.99 -0.26 0.00 0.00 0.73 0.00 0.00 38.32 39.78 2jtz h ASN 18 CO 0.05 1.10 -0.02 -0.33 -1.29 0.00 0.00 177.43 176.94 2jtz h GLU 19 N 0.83 -0.05 -0.21 6.67 5.08 -0.54 -3.26 114.58 123.10 2jtz h GLU 19 Ca 0.12 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.54 2jtz h GLU 19 Cb 0.72 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 2jtz h GLU 19 CO 0.06 0.60 0.23 0.74 -1.00 0.00 0.00 179.01 179.64 2jtz h PHE 20 N -0.89 0.00 0.42 4.33 0.04 -1.50 -2.48 116.94 116.86 2jtz h PHE 20 Ca -0.01 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 2jtz h PHE 20 Cb 0.68 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.80 2jtz h PHE 20 CO 0.17 0.00 -0.44 -0.22 -0.60 0.00 0.00 178.31 177.22 2jtz h LYS 21 N 0.00 -0.84 0.00 1.51 3.11 -1.34 -1.35 116.57 117.66 2jtz h LYS 21 Ca 0.10 0.06 -0.00 0.00 -2.81 0.00 0.00 60.65 57.99 2jtz h LYS 21 Cb 0.56 0.19 -0.00 0.00 -1.00 0.00 0.00 32.23 31.98 2jtz h LYS 21 CO -0.00 -0.56 -0.02 0.00 -2.81 0.00 0.00 179.45 176.06 2jtz h ALA 22 N -0.57 1.40 -0.24 5.00 0.00 -1.57 -2.40 119.26 120.88 2jtz h ALA 22 Ca -0.04 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2jtz h ALA 22 Cb 0.78 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2jtz h ALA 22 CO -0.07 0.03 0.07 0.00 0.00 0.00 0.00 179.25 179.27 2jtz h ALA 23 N 1.98 0.31 -0.01 0.00 0.00 -1.17 -2.70 119.26 117.67 2jtz h ALA 23 Ca -0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 2jtz h ALA 23 Cb 0.07 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2jtz h ALA 23 CO 0.00 -0.06 -0.08 0.74 0.00 0.00 0.00 179.25 179.85 2jtz h PHE 24 N 0.22 0.02 -0.49 0.00 0.04 -0.89 -1.86 116.94 113.96 2jtz h PHE 24 Ca 0.08 -0.00 0.14 0.00 2.80 0.00 0.00 57.97 60.99 2jtz h PHE 24 Cb 0.24 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.37 2jtz h PHE 24 CO 0.00 0.10 0.42 0.22 -0.60 0.00 0.00 178.31 178.45 2jtz h ASP 25 N 0.02 0.00 0.38 2.17 1.82 -1.43 0.30 116.42 119.68 2jtz h ASP 25 Ca 0.00 0.00 -0.14 0.00 -0.39 0.00 0.00 57.03 56.50 2jtz h ASP 25 Cb 0.16 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.16 2jtz h ASP 25 CO 0.01 0.00 -0.60 0.40 -1.61 0.00 0.00 179.24 177.44 2jtz h ILE 26 N 0.00 1.39 0.16 2.25 2.04 -1.42 -0.22 117.51 121.71 2jtz h ILE 26 Ca 0.23 -1.98 -0.34 0.00 1.00 0.00 0.00 64.86 63.78 2jtz h ILE 26 Cb 1.06 2.00 0.00 0.00 -0.74 0.00 0.00 36.82 39.15 2jtz h ILE 26 CO -0.00 0.58 -1.72 0.15 0.00 0.00 0.00 178.15 177.16 2jtz h PHE 27 N 0.17 0.63 -0.56 1.37 3.57 -0.69 -3.34 116.94 118.09 2jtz h PHE 27 Ca -0.01 -0.46 -0.15 0.00 3.53 0.00 0.00 57.97 60.89 2jtz h PHE 27 Cb 1.10 -0.03 -0.09 0.00 2.79 0.00 0.00 35.95 39.72 2jtz h PHE 27 CO 0.02 1.67 0.19 1.55 -2.23 0.00 0.00 178.31 179.51 2jtz n VAL 28 N -3.65 2.33 0.28 1.41 3.14 0.58 -4.41 118.33 118.02 2jtz n VAL 28 Ca -0.26 -1.22 0.14 0.00 -2.96 0.00 0.00 64.34 60.04 2jtz n VAL 28 Cb 1.03 -0.43 0.85 0.00 -1.06 0.00 0.00 33.84 34.23 2jtz n VAL 28 CO 0.00 0.00 0.00 0.25 -6.46 0.00 0.00 176.83 170.62 2jtz h LEU 29 N 2.29 0.00 0.00 6.55 6.46 -1.15 -2.99 115.31 126.47 2jtz h LEU 29 Ca 0.18 0.00 -0.06 0.00 -0.12 0.00 0.00 57.88 57.88 2jtz h LEU 29 Cb 1.94 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.86 2jtz h LEU 29 CO 0.55 0.00 -0.40 1.23 -0.62 0.00 0.00 178.44 179.21 2jtz h GLY 30 N 0.00 0.00 -5.83 3.75 0.00 -1.85 -3.45 103.07 95.69 2jtz h GLY 30 Ca 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.72 2jtz h GLY 30 CO -0.00 0.00 1.14 0.00 0.00 0.00 0.00 176.54 177.68 2jtz n ALA 31 N -2.98 0.95 0.02 3.60 0.00 -1.13 -4.85 120.51 116.11 2jtz n ALA 31 Ca -0.14 0.25 -0.06 0.00 0.00 0.00 0.00 53.44 53.49 2jtz n ALA 31 Cb 0.42 -2.53 -0.12 0.00 0.00 0.00 0.00 19.45 17.23 2jtz n ALA 31 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2jtz h GLU 32 N 9.63 0.00 0.00 0.00 5.08 -1.88 -3.29 114.58 124.12 2jtz h GLU 32 Ca -0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 2jtz h GLU 32 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 2jtz h GLU 32 CO 0.95 0.58 0.00 -0.25 -1.00 0.00 0.00 179.01 179.29 2jtz n ASP 33 N -3.10 0.72 -1.69 1.42 8.00 -1.26 -4.88 116.55 115.75 2jtz n ASP 33 Ca -0.10 0.62 -0.21 0.00 0.71 0.00 0.00 54.79 55.81 2jtz n ASP 33 Cb 0.97 -0.79 -0.08 0.00 -0.02 0.00 0.00 41.12 41.20 2jtz n ASP 33 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jtz n GLY 34 N 0.65 1.72 3.23 0.44 0.00 -1.24 -4.96 105.19 105.02 2jtz n GLY 34 Ca 0.04 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.80 2jtz n GLY 34 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jtz n SER 35 N -1.44 -0.84 -3.87 1.61 3.41 -1.26 -4.39 113.62 106.85 2jtz n SER 35 Ca -0.21 -1.27 -0.19 0.00 -0.26 0.00 0.00 58.87 56.94 2jtz n SER 35 Cb 0.68 -0.88 -0.16 0.00 -0.26 0.00 0.00 64.21 63.59 2jtz n SER 35 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2jtz s ILE 36 N -3.17 0.39 0.04 -1.33 1.01 -1.25 -4.92 121.20 111.96 2jtz s ILE 36 Ca 0.64 -0.04 0.00 0.00 0.00 0.00 0.00 60.65 61.25 2jtz s ILE 36 Cb -0.04 -0.44 0.00 0.00 0.01 0.00 0.00 42.46 41.99 2jtz s ILE 36 CO 0.47 0.19 0.03 -1.54 0.00 0.00 0.00 174.94 174.09 2jtz n SER 37 N 4.05 1.04 0.27 3.58 3.41 -1.26 -4.97 113.62 119.73 2jtz n SER 37 Ca -0.26 -1.13 0.16 0.00 -0.26 0.00 0.00 58.87 57.37 2jtz n SER 37 Cb 0.51 -0.01 0.63 0.00 -0.26 0.00 0.00 64.21 65.08 2jtz n SER 37 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 2jtz h THR 38 N 0.47 0.11 0.00 6.66 1.35 -2.03 -2.74 112.91 116.73 2jtz h THR 38 Ca -0.02 -0.64 -0.10 0.00 -0.55 0.00 0.00 66.41 65.10 2jtz h THR 38 Cb 0.09 1.57 -0.02 0.00 -1.73 0.00 0.00 68.15 68.07 2jtz h THR 38 CO 0.04 0.04 -1.21 0.11 -0.25 0.00 0.00 175.52 174.25 2jtz h LYS 39 N 0.00 0.00 0.00 4.72 1.79 -2.04 -3.31 116.57 117.73 2jtz h LYS 39 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2jtz h LYS 39 Cb 0.57 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.22 2jtz h LYS 39 CO 0.01 0.17 0.00 0.39 -1.08 0.00 0.00 179.45 178.94 2jtz n GLU 40 N -2.81 0.05 0.29 3.15 -0.58 -1.03 -2.92 120.64 116.78 2jtz n GLU 40 Ca -0.05 0.18 0.19 0.00 -0.42 0.00 0.00 57.16 57.06 2jtz n GLU 40 Cb 0.72 -1.50 1.03 0.00 -0.57 0.00 0.00 31.44 31.11 2jtz n GLU 40 CO 0.00 0.00 0.00 1.37 -0.48 0.00 0.00 177.13 178.02 2jtz h LEU 41 N 0.00 0.00 -0.44 -4.62 -0.00 -1.65 -0.18 115.31 108.43 2jtz h LEU 41 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.88 2jtz h LEU 41 Cb 0.29 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.94 2jtz h LEU 41 CO 0.00 0.00 -0.01 1.23 -0.00 0.00 0.00 178.44 179.66 2jtz h GLY 42 N 0.06 0.00 1.50 0.17 0.00 -1.82 -3.18 103.07 99.80 2jtz h GLY 42 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.37 2jtz h GLY 42 CO 0.00 0.00 0.21 0.07 0.00 0.00 0.00 176.54 176.82 2jtz h LYS 43 N 0.00 0.00 0.55 4.80 5.09 -1.27 0.20 116.57 125.93 2jtz h LYS 43 Ca -0.00 0.00 -0.03 0.00 0.09 0.00 0.00 60.65 60.71 2jtz h LYS 43 Cb 0.86 0.00 0.01 0.00 0.10 0.00 0.00 32.23 33.20 2jtz h LYS 43 CO 0.00 0.00 -0.26 0.28 -2.09 0.00 0.00 179.45 177.38 2jtz h VAL 44 N 0.00 0.13 0.00 0.07 2.07 -1.74 -3.18 116.25 113.60 2jtz h VAL 44 Ca 0.07 -0.46 0.00 0.00 0.82 0.00 0.00 66.70 67.13 2jtz h VAL 44 Cb 0.49 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 2jtz h VAL 44 CO -0.00 0.02 0.00 1.15 0.02 0.00 0.00 177.57 178.76 2jtz n MET 45 N -5.27 0.17 0.25 1.57 0.00 -0.96 -2.34 117.12 110.54 2jtz n MET 45 Ca -0.10 0.28 0.10 0.00 0.00 0.00 0.00 57.70 57.98 2jtz n MET 45 Cb 0.31 -1.76 0.65 0.00 0.00 0.00 0.00 33.22 32.42 2jtz n MET 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2jtz h ARG 46 N 0.00 0.00 0.00 3.17 2.47 -0.60 0.26 114.38 119.69 2jtz h ARG 46 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2jtz h ARG 46 Cb 0.50 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.82 2jtz h ARG 46 CO 0.00 0.14 0.00 -1.33 0.56 0.00 0.00 179.97 179.34 2jtz n MET 47 N -3.86 1.33 -0.01 0.04 2.81 -1.15 -4.68 117.12 111.60 2jtz n MET 47 Ca -0.02 -1.01 -0.00 0.00 -1.81 0.00 0.00 57.70 54.86 2jtz n MET 47 Cb 0.24 -0.92 -0.03 0.00 -0.71 0.00 0.00 33.22 31.81 2jtz n MET 47 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 2jtz n LEU 48 N -0.27 0.00 -2.86 4.03 7.94 -0.99 -5.05 117.00 119.80 2jtz n LEU 48 Ca 0.00 0.00 -0.13 0.00 -1.11 0.00 0.00 56.01 54.77 2jtz n LEU 48 Cb 0.20 0.04 0.07 0.00 0.53 0.00 0.00 43.42 44.27 2jtz n LEU 48 CO 0.00 0.04 0.08 0.61 -1.11 0.00 0.00 177.39 177.01 2jtz n GLY 49 N 2.57 -0.20 3.32 -3.96 0.00 0.91 -5.00 105.19 102.82 2jtz n GLY 49 Ca -0.03 -0.01 -0.18 0.00 0.00 0.00 0.00 46.02 45.80 2jtz n GLY 49 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2jtz s GLN 50 N -4.99 1.56 -0.46 1.61 -2.07 -1.25 -5.10 119.66 108.96 2jtz s GLN 50 Ca 0.02 -1.89 0.03 0.00 -1.82 0.00 0.00 55.36 51.70 2jtz s GLN 50 Cb -0.00 -0.04 0.16 0.00 -1.09 0.00 0.00 33.01 32.03 2jtz s GLN 50 CO 0.56 -0.45 0.32 -0.80 -1.32 0.00 0.00 175.29 173.60 2jtz s ASN 51 N -3.35 2.85 1.05 12.60 -0.87 -1.26 -4.70 114.94 121.25 2jtz s ASN 51 Ca 0.36 -2.94 -0.14 0.00 -1.57 0.00 0.00 52.86 48.57 2jtz s ASN 51 Cb 0.05 -0.79 0.21 0.00 -0.02 0.00 0.00 41.25 40.71 2jtz s ASN 51 CO 0.18 -0.20 1.10 -2.16 -2.57 0.00 0.00 177.10 173.44 2jtz s PRO 52 N 0.04 0.01 -0.03 -0.60 0.04 -1.26 -5.05 135.00 128.16 2jtz s PRO 52 Ca 0.25 0.37 -0.05 0.00 0.04 0.00 0.00 61.00 61.60 2jtz s PRO 52 Cb -0.09 -1.70 -0.04 0.00 0.04 0.00 0.00 34.50 32.70 2jtz s PRO 52 CO -0.11 -2.98 0.20 -0.08 0.04 0.00 0.00 177.00 174.08 2jtz s THR 53 N -2.98 5.40 -0.66 1.26 -1.32 -1.26 -4.99 115.64 111.09 2jtz s THR 53 Ca 0.67 0.06 0.20 0.00 -1.21 0.00 0.00 61.69 61.40 2jtz s THR 53 Cb -0.17 -3.52 0.20 0.00 -1.51 0.00 0.00 72.50 67.51 2jtz s THR 53 CO 0.57 0.42 1.62 -0.81 -2.21 0.00 0.00 174.62 174.21 2jtz n PRO 54 N 1.28 0.12 0.10 7.08 -0.04 -1.26 -2.66 135.00 139.62 2jtz n PRO 54 Ca -0.13 0.37 -0.02 0.00 -0.04 0.00 0.00 63.50 63.67 2jtz n PRO 54 Cb 0.53 -1.74 0.23 0.00 -0.04 0.00 0.00 33.50 32.48 2jtz n PRO 54 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2jtz h GLU 55 N 0.00 0.22 -0.42 0.54 4.39 -2.03 -2.80 114.58 114.48 2jtz h GLU 55 Ca 0.00 -0.11 0.12 0.00 0.34 0.00 0.00 59.36 59.72 2jtz h GLU 55 Cb 0.32 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.95 2jtz h GLU 55 CO 0.00 0.61 0.38 0.93 -1.16 0.00 0.00 179.01 179.76 2jtz h GLU 56 N 0.18 0.00 0.00 2.33 4.39 -1.94 0.24 114.58 119.79 2jtz h GLU 56 Ca 0.02 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.66 2jtz h GLU 56 Cb 0.82 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.47 2jtz h GLU 56 CO 0.06 0.00 -0.25 -0.07 -1.16 0.00 0.00 179.01 177.59 2jtz h LEU 57 N 0.00 0.00 0.02 1.33 -0.00 -1.71 -2.05 115.31 112.90 2jtz h LEU 57 Ca 0.20 0.00 0.03 0.00 -0.00 0.00 0.00 57.88 58.11 2jtz h LEU 57 Cb 0.95 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 41.56 2jtz h LEU 57 CO -0.00 0.25 -0.36 1.56 -0.00 0.00 0.00 178.44 179.89 2jtz h GLN 58 N 0.00 -0.51 0.00 1.13 1.08 -0.67 0.13 115.11 116.27 2jtz h GLN 58 Ca -0.00 0.03 -0.13 0.00 -1.45 0.00 0.00 58.65 57.10 2jtz h GLN 58 Cb 0.48 0.12 -0.02 0.00 -0.05 0.00 0.00 27.48 28.01 2jtz h GLN 58 CO 0.03 -0.34 -0.63 1.49 -0.95 0.00 0.00 178.83 178.43 2jtz h GLU 59 N -0.53 0.00 0.35 1.46 4.81 -1.68 -3.04 114.58 115.96 2jtz h GLU 59 Ca 0.05 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.26 2jtz h GLU 59 Cb 0.60 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.99 2jtz h GLU 59 CO -0.28 0.63 -0.17 1.98 -0.73 0.00 0.00 179.01 180.45 2jtz h MET 60 N 0.00 -0.45 0.00 1.92 4.05 -0.70 -2.66 114.93 117.08 2jtz h MET 60 Ca -0.01 0.03 -0.03 0.00 -0.28 0.00 0.00 59.70 59.41 2jtz h MET 60 Cb 1.26 0.10 -0.00 0.00 -0.80 0.00 0.00 31.60 32.16 2jtz h MET 60 CO 0.08 -0.25 -0.15 0.97 0.23 0.00 0.00 176.91 177.79 2jtz h ILE 61 N -0.55 0.84 -0.03 1.77 6.09 -0.83 -2.90 117.51 121.90 2jtz h ILE 61 Ca -0.05 -0.57 0.03 0.00 -1.37 0.00 0.00 64.86 62.91 2jtz h ILE 61 Cb 0.41 1.33 -0.06 0.00 0.47 0.00 0.00 36.82 38.98 2jtz h ILE 61 CO 0.08 0.15 -0.36 -0.78 -3.07 0.00 0.00 178.15 174.16 2jtz h ASP 62 N 0.00 -1.11 -0.12 2.19 1.82 -1.35 -3.43 116.42 114.42 2jtz h ASP 62 Ca -0.00 0.14 0.13 0.00 -0.39 0.00 0.00 57.03 56.91 2jtz h ASP 62 Cb 0.32 0.44 -0.17 0.00 0.68 0.00 0.00 39.33 40.61 2jtz h ASP 62 CO 0.02 -0.41 -0.07 -0.70 -1.61 0.00 0.00 179.24 176.46 2jtz s GLU 63 N -5.96 0.10 -0.02 0.28 2.56 -1.15 -5.03 118.70 109.49 2jtz s GLU 63 Ca -0.16 -0.05 0.04 0.00 0.00 0.00 0.00 54.97 54.81 2jtz s GLU 63 Cb 0.09 0.01 -0.07 0.00 2.00 0.00 0.00 34.13 36.16 2jtz s GLU 63 CO 0.65 -0.14 0.08 1.55 -0.56 0.00 0.00 175.26 176.83 2jtz n VAL 64 N 3.43 0.08 -1.14 3.70 3.14 -1.11 -4.77 118.33 121.66 2jtz n VAL 64 Ca 0.06 -0.13 -0.34 0.00 -2.96 0.00 0.00 64.34 60.97 2jtz n VAL 64 Cb 0.64 0.06 -0.03 0.00 -1.06 0.00 0.00 33.84 33.46 2jtz n VAL 64 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 2jtz n ASP 65 N -1.79 7.58 0.32 6.55 2.03 -1.26 -4.59 116.55 125.39 2jtz n ASP 65 Ca -0.02 -2.50 0.20 0.00 0.52 0.00 0.00 54.79 52.98 2jtz n ASP 65 Cb 0.25 -1.42 1.08 0.00 -0.72 0.00 0.00 41.12 40.31 2jtz n ASP 65 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 2jtz h GLU 66 N 5.41 0.00 0.00 -0.67 5.08 -2.00 -0.20 114.58 122.20 2jtz h GLU 66 Ca 0.76 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.12 2jtz h GLU 66 Cb 0.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.50 2jtz h GLU 66 CO 1.69 0.01 0.00 -0.40 -1.00 0.00 0.00 179.01 179.31 2jtz n ASP 67 N -3.33 0.53 -3.66 1.42 5.75 -1.26 -4.88 116.55 111.12 2jtz n ASP 67 Ca -0.03 0.64 -0.24 0.00 -0.01 0.00 0.00 54.79 55.16 2jtz n ASP 67 Cb 0.10 -0.75 0.06 0.00 -1.03 0.00 0.00 41.12 39.50 2jtz n ASP 67 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jtz n GLY 68 N -0.17 -0.46 0.01 6.12 0.00 -0.09 -4.89 105.19 105.71 2jtz n GLY 68 Ca 0.02 0.19 0.09 0.00 0.00 0.00 0.00 46.02 46.33 2jtz n GLY 68 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jtz n SER 69 N -3.00 0.73 -0.08 1.61 3.41 -1.26 -4.98 113.62 110.06 2jtz n SER 69 Ca -0.08 -0.35 -0.01 0.00 -0.26 0.00 0.00 58.87 58.16 2jtz n SER 69 Cb 0.59 1.54 -0.00 0.00 -0.26 0.00 0.00 64.21 66.08 2jtz n SER 69 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jtz n GLY 70 N 1.43 0.37 3.23 5.00 0.00 -1.26 -4.97 105.19 108.98 2jtz n GLY 70 Ca -0.01 -0.07 -0.09 0.00 0.00 0.00 0.00 46.02 45.85 2jtz n GLY 70 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jtz s THR 71 N -1.65 0.12 -0.18 2.61 -4.23 -1.26 -5.15 115.64 105.90 2jtz s THR 71 Ca 0.00 -1.01 -0.02 0.00 -1.18 0.00 0.00 61.69 59.47 2jtz s THR 71 Cb 0.00 -1.25 0.06 0.00 1.34 0.00 0.00 72.50 72.65 2jtz s THR 71 CO 0.00 -0.56 0.03 0.54 -0.54 0.00 0.00 174.62 174.09 2jtz s VAL 72 N -3.66 0.58 0.37 2.29 0.11 -1.26 -5.01 120.40 113.82 2jtz s VAL 72 Ca 0.03 -0.53 0.02 0.00 -2.93 0.00 0.00 61.98 58.57 2jtz s VAL 72 Cb 0.03 -1.03 0.07 0.00 -1.53 0.00 0.00 36.38 33.92 2jtz s VAL 72 CO -0.10 -0.15 0.51 -0.90 -3.33 0.00 0.00 175.10 171.12 2jtz n ASP 73 N 5.03 0.94 -0.28 3.54 5.68 -1.26 -3.91 116.55 126.30 2jtz n ASP 73 Ca -0.09 -1.73 0.15 0.00 -0.50 0.00 0.00 54.79 52.62 2jtz n ASP 73 Cb 0.47 -0.31 0.43 0.00 -1.14 0.00 0.00 41.12 40.57 2jtz n ASP 73 CO 0.00 0.00 0.00 2.19 -1.33 0.00 0.00 177.20 178.06 2jtz h PHE 74 N -0.26 0.74 0.16 2.11 -0.00 -1.92 0.55 116.94 118.33 2jtz h PHE 74 Ca -0.17 0.02 -0.01 0.00 -0.00 0.00 0.00 57.97 57.82 2jtz h PHE 74 Cb 0.69 -0.23 0.00 0.00 -0.00 0.00 0.00 35.95 36.41 2jtz h PHE 74 CO 0.00 0.22 -0.08 0.22 -0.00 0.00 0.00 178.31 178.67 2jtz h ASP 75 N 0.58 -0.19 -0.39 -0.68 3.58 -1.97 -2.82 116.42 114.53 2jtz h ASP 75 Ca 0.49 -0.35 0.11 0.00 0.42 0.00 0.00 57.03 57.69 2jtz h ASP 75 Cb 0.97 0.05 -0.02 0.00 1.72 0.00 0.00 39.33 42.05 2jtz h ASP 75 CO -0.23 0.35 0.30 -0.33 -2.88 0.00 0.00 179.24 176.45 2jtz h GLU 76 N -0.82 0.00 0.00 0.28 5.08 -1.75 0.28 114.58 117.66 2jtz h GLU 76 Ca -0.02 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.27 2jtz h GLU 76 Cb 0.53 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 2jtz h GLU 76 CO 0.04 0.00 -0.32 0.35 -1.00 0.00 0.00 179.01 178.08 2jtz h PHE 77 N 0.00 0.00 0.00 4.33 3.57 -0.89 -2.99 116.94 120.96 2jtz h PHE 77 Ca 0.18 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.68 2jtz h PHE 77 Cb 0.79 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.53 2jtz h PHE 77 CO 0.00 0.32 -0.20 1.28 -2.23 0.00 0.00 178.31 177.47 2jtz n LEU 78 N -3.28 0.61 0.07 0.59 4.77 0.95 -3.54 117.00 117.17 2jtz n LEU 78 Ca 0.01 0.42 -0.15 0.00 -0.03 0.00 0.00 56.01 56.27 2jtz n LEU 78 Cb 0.58 -0.31 -0.14 0.00 -2.33 0.00 0.00 43.42 41.22 2jtz n LEU 78 CO 0.37 -0.09 -0.22 -0.37 -1.33 0.00 0.00 177.39 175.74 2jtz h VAL 79 N 0.00 1.28 0.00 4.08 -1.51 -1.31 -3.27 116.25 115.52 2jtz h VAL 79 Ca 0.00 -2.93 0.00 0.00 -1.23 0.00 0.00 66.70 62.54 2jtz h VAL 79 Cb 0.68 2.79 0.00 0.00 -2.13 0.00 0.00 31.29 32.62 2jtz h VAL 79 CO 0.00 0.83 0.00 0.23 -1.23 0.00 0.00 177.57 177.40 2jtz n MET 80 N -3.43 0.11 -0.20 5.19 2.81 -1.22 -3.61 117.12 116.78 2jtz n MET 80 Ca -0.12 0.15 -0.01 0.00 -1.81 0.00 0.00 57.70 55.90 2jtz n MET 80 Cb 1.03 -1.65 0.09 0.00 -0.71 0.00 0.00 33.22 31.98 2jtz n MET 80 CO 0.00 0.00 0.00 0.52 1.51 0.00 0.00 175.97 178.00 2jtz h MET 81 N 0.00 0.47 -0.86 0.03 2.07 -1.61 -0.48 114.93 114.54 2jtz h MET 81 Ca 0.00 -0.03 0.23 0.00 -2.07 0.00 0.00 59.70 57.83 2jtz h MET 81 Cb 0.54 -0.10 -0.04 0.00 -1.87 0.00 0.00 31.60 30.12 2jtz h MET 81 CO 0.00 0.31 0.60 -0.39 1.07 0.00 0.00 176.91 178.50 2jtz h VAL 82 N 0.48 0.61 -0.38 -2.22 -1.51 -1.73 0.24 116.25 111.74 2jtz h VAL 82 Ca 0.29 -0.04 0.11 0.00 -1.23 0.00 0.00 66.70 65.82 2jtz h VAL 82 Cb 0.29 0.47 -0.02 0.00 -2.13 0.00 0.00 31.29 29.90 2jtz h VAL 82 CO -0.25 0.02 0.34 -0.09 -1.23 0.00 0.00 177.57 176.37 2jtz h ARG 83 N 0.13 0.00 -5.79 5.19 1.12 -1.31 -3.26 114.38 110.46 2jtz h ARG 83 Ca 0.42 0.00 -0.62 0.00 -1.11 0.00 0.00 59.98 58.68 2jtz h ARG 83 Cb 1.47 0.00 -0.07 0.00 -0.01 0.00 0.00 29.97 31.36 2jtz h ARG 83 CO -0.06 0.00 2.00 -1.12 -3.11 0.00 0.00 179.97 177.67 2jtz s SER 84 N -5.80 6.50 0.00 -3.80 0.01 0.83 -4.72 113.70 106.73 2jtz s SER 84 Ca -0.05 -2.30 0.00 0.00 1.31 0.00 0.00 55.95 54.91 2jtz s SER 84 Cb 0.17 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.82 2jtz s SER 84 CO 0.62 -1.52 0.00 0.23 0.41 0.00 0.00 173.24 172.97 2jtz n MET 85 N 8.38 0.00 -1.56 12.44 2.81 -1.25 -4.67 117.12 133.27 2jtz n MET 85 Ca 0.48 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.37 2jtz n MET 85 Cb 0.46 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.97 2jtz n MET 85 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 2jtz n LYS 86 N 0.00 0.04 -4.06 0.03 4.01 -1.23 -5.07 118.16 111.89 2jtz n LYS 86 Ca 0.00 0.00 -0.23 0.00 -0.51 0.00 0.00 58.31 57.57 2jtz n LYS 86 Cb 0.00 0.00 -0.06 0.00 -0.51 0.00 0.00 35.03 34.46 2jtz n LYS 86 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 2jtz s ASP 87 N -0.56 4.82 0.05 4.39 2.15 -1.26 -4.23 116.67 122.03 2jtz s ASP 87 Ca 0.00 -0.69 0.01 0.00 0.43 0.00 0.00 52.55 52.29 2jtz s ASP 87 Cb 0.00 -0.81 0.01 0.00 -0.30 0.00 0.00 42.92 41.82 2jtz s ASP 87 CO 0.00 -0.28 0.04 -0.67 -0.17 0.00 0.00 175.17 174.09 2jtz n ASP 88 N -1.18 0.99 -3.63 -0.34 2.03 -1.26 -5.02 116.55 108.15 2jtz n ASP 88 Ca -0.03 -1.16 -0.06 0.00 0.52 0.00 0.00 54.79 54.05 2jtz n ASP 88 Cb 0.61 -0.01 -0.02 0.00 -0.72 0.00 0.00 41.12 40.98 2jtz n ASP 88 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2jtz s SER 89 N -1.29 -0.28 -0.04 1.67 1.04 -1.26 -4.88 113.70 108.66 2jtz s SER 89 Ca 0.03 -0.20 0.04 0.00 0.48 0.00 0.00 55.95 56.30 2jtz s SER 89 Cb -0.00 0.45 -0.06 0.00 0.10 0.00 0.00 66.02 66.50 2jtz s SER 89 CO 0.02 -0.78 0.03 0.29 0.98 0.00 0.00 173.24 173.78 2jtz n LYS 90 N -0.36 2.88 0.00 4.02 4.76 -1.26 -4.92 118.16 123.28 2jtz n LYS 90 Ca -0.08 -0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.36 2jtz n LYS 90 Cb 0.61 -1.13 0.00 0.00 -1.84 0.00 0.00 35.03 32.68 2jtz n LYS 90 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2jtz n GLY 91 N 2.65 0.98 3.62 0.72 0.00 -1.26 -5.04 105.19 106.84 2jtz n GLY 91 Ca -0.07 -1.37 -0.27 0.00 0.00 0.00 0.00 46.02 44.31 2jtz n GLY 91 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jtz s LYS 92 N -4.92 1.96 0.27 1.61 -2.85 -1.26 -4.95 119.74 109.60 2jtz s LYS 92 Ca 0.00 -2.04 -0.12 0.00 -1.00 0.00 0.00 55.97 52.81 2jtz s LYS 92 Cb 0.00 -1.69 0.00 0.00 -2.06 0.00 0.00 37.83 34.08 2jtz s LYS 92 CO 0.00 -0.02 0.51 -1.54 0.10 0.00 0.00 175.35 174.40 2jtz s SER 93 N -3.71 0.06 0.34 0.03 1.04 -1.26 -5.02 113.70 105.18 2jtz s SER 93 Ca 0.35 -1.02 0.25 0.00 0.48 0.00 0.00 55.95 56.02 2jtz s SER 93 Cb 0.08 0.62 1.22 0.00 0.10 0.00 0.00 66.02 68.04 2jtz s SER 93 CO 0.18 -1.21 1.77 1.05 0.98 0.00 0.00 173.24 176.01 2jtz h GLU 94 N 2.21 0.00 -0.32 4.02 4.11 -2.04 -2.63 114.58 119.92 2jtz h GLU 94 Ca -0.27 0.00 0.09 0.00 0.07 0.00 0.00 59.36 59.26 2jtz h GLU 94 Cb 1.25 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.49 2jtz h GLU 94 CO 0.36 0.00 0.33 0.93 0.07 0.00 0.00 179.01 180.70 2jtz h GLU 95 N 0.00 0.00 -0.91 1.06 4.39 -2.03 -0.72 114.58 116.37 2jtz h GLU 95 Ca 0.00 0.00 0.19 0.00 0.34 0.00 0.00 59.36 59.89 2jtz h GLU 95 Cb 0.19 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 28.77 2jtz h GLU 95 CO 0.00 0.00 0.59 1.05 -1.16 0.00 0.00 179.01 179.49 2jtz h GLU 96 N 0.00 0.47 -0.61 2.33 -0.00 -1.90 -0.82 114.58 114.05 2jtz h GLU 96 Ca 0.15 -0.03 0.11 0.00 -0.00 0.00 0.00 59.36 59.60 2jtz h GLU 96 Cb 0.82 -0.11 -0.08 0.00 -0.00 0.00 0.00 28.75 29.38 2jtz h GLU 96 CO -0.00 0.31 0.15 1.25 -0.00 0.00 0.00 179.01 180.71 2jtz h LEU 97 N 0.48 0.04 -0.76 3.06 7.12 -1.39 0.23 115.31 124.10 2jtz h LEU 97 Ca 0.47 0.11 0.14 0.00 0.13 0.00 0.00 57.88 58.74 2jtz h LEU 97 Cb 1.07 0.14 -0.10 0.00 -0.53 0.00 0.00 40.66 41.24 2jtz h LEU 97 CO -0.20 0.02 0.31 0.77 -0.13 0.00 0.00 178.44 179.21 2jtz h SER 98 N 0.28 0.29 1.29 1.25 4.64 -1.33 0.34 113.55 120.31 2jtz h SER 98 Ca 0.32 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 2jtz h SER 98 Cb 0.47 0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 2jtz h SER 98 CO -0.39 0.11 -0.11 -0.67 -0.87 0.00 0.00 176.83 174.89 2jtz n ASP 99 N -5.00 0.69 -0.03 4.97 2.03 -0.34 -2.56 116.55 116.31 2jtz n ASP 99 Ca 0.14 0.47 -0.13 0.00 0.52 0.00 0.00 54.79 55.80 2jtz n ASP 99 Cb 0.42 -0.58 -0.11 0.00 -0.72 0.00 0.00 41.12 40.13 2jtz n ASP 99 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 2jtz h LEU 100 N 0.00 -0.03 -0.45 -2.67 7.12 0.29 -1.71 115.31 117.85 2jtz h LEU 100 Ca 0.00 -0.67 -0.17 0.00 0.13 0.00 0.00 57.88 57.17 2jtz h LEU 100 Cb 0.70 0.01 -0.01 0.00 -0.53 0.00 0.00 40.66 40.83 2jtz h LEU 100 CO 0.00 0.69 -0.75 2.19 -0.13 0.00 0.00 178.44 180.44 2jtz h PHE 101 N -0.78 0.33 -0.21 1.25 -0.00 -1.31 -3.18 116.94 113.03 2jtz h PHE 101 Ca -0.00 -0.15 -0.15 0.00 -0.00 0.00 0.00 57.97 57.66 2jtz h PHE 101 Cb 0.70 -0.05 -0.01 0.00 -0.00 0.00 0.00 35.95 36.59 2jtz h PHE 101 CO 0.17 0.89 -0.50 -0.09 -0.00 0.00 0.00 178.31 178.78 2jtz h ARG 102 N 0.15 0.58 0.00 6.09 2.43 -1.60 -2.83 114.38 119.21 2jtz h ARG 102 Ca -0.03 -0.34 0.00 0.00 -0.81 0.00 0.00 59.98 58.80 2jtz h ARG 102 Cb 1.32 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.90 2jtz h ARG 102 CO 0.12 0.95 0.00 -1.33 -1.51 0.00 0.00 179.97 178.19 2jtz n MET 103 N -3.98 0.00 -0.92 0.20 2.81 -0.64 -4.99 117.12 109.59 2jtz n MET 103 Ca -0.03 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.86 2jtz n MET 103 Cb 0.58 -0.99 0.00 0.00 -0.71 0.00 0.00 33.22 32.10 2jtz n MET 103 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2jtz n ASP 105 N -0.32 -1.23 -0.16 7.83 -0.08 -1.07 -5.10 116.55 116.41 2jtz n ASP 105 Ca 0.00 0.00 -0.02 0.00 -1.51 0.00 0.00 54.79 53.26 2jtz n ASP 105 Cb 0.00 -0.61 0.06 0.00 2.34 0.00 0.00 41.12 42.90 2jtz n ASP 105 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 2jtz h LYS 106 N 0.00 0.10 0.00 -0.67 1.79 -1.90 0.46 116.57 116.35 2jtz h LYS 106 Ca 0.00 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 2jtz h LYS 106 Cb 0.00 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 30.63 2jtz h LYS 106 CO 0.00 0.07 -0.27 0.09 -1.08 0.00 0.00 179.45 178.25 2jtz n ASN 107 N -5.25 0.61 -2.55 0.86 3.02 -1.26 -4.93 115.26 105.76 2jtz n ASN 107 Ca 0.06 0.31 -0.19 0.00 -0.03 0.00 0.00 54.58 54.73 2jtz n ASN 107 Cb 0.28 -0.30 -0.00 0.00 -0.61 0.00 0.00 39.78 39.14 2jtz n ASN 107 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jtz n ALA 108 N -1.72 -0.74 -1.57 5.41 0.00 0.15 -4.86 120.51 117.18 2jtz n ALA 108 Ca 0.05 0.16 -0.10 0.00 0.00 0.00 0.00 53.44 53.55 2jtz n ALA 108 Cb 0.41 -2.26 0.16 0.00 0.00 0.00 0.00 19.45 17.76 2jtz n ALA 108 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2jtz n ASP 109 N -2.04 3.25 -3.84 0.00 5.75 -1.26 -4.94 116.55 113.46 2jtz n ASP 109 Ca -0.19 -3.80 -0.27 0.00 -0.01 0.00 0.00 54.79 50.53 2jtz n ASP 109 Cb 0.65 -0.60 0.02 0.00 -1.03 0.00 0.00 41.12 40.16 2jtz n ASP 109 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jtz n GLY 110 N -1.04 -0.40 3.47 6.12 0.00 -1.26 -4.97 105.19 107.11 2jtz n GLY 110 Ca 0.37 0.16 -0.13 0.00 0.00 0.00 0.00 46.02 46.42 2jtz n GLY 110 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2jtz s TYR 111 N -3.48 -0.67 -0.23 1.61 5.04 -1.26 -4.86 117.35 113.51 2jtz s TYR 111 Ca 0.38 1.57 0.01 0.00 -2.44 0.00 0.00 57.07 56.59 2jtz s TYR 111 Cb -0.19 0.26 0.05 0.00 0.35 0.00 0.00 41.96 42.43 2jtz s TYR 111 CO 0.83 -0.33 -0.09 0.42 -1.34 0.00 0.00 175.55 175.05 2jtz s ILE 112 N 0.51 1.72 0.58 3.14 -1.09 -1.13 -4.73 121.20 120.20 2jtz s ILE 112 Ca -0.02 -1.22 0.09 0.00 -2.23 0.00 0.00 60.65 57.27 2jtz s ILE 112 Cb -0.04 -1.87 0.09 0.00 -1.58 0.00 0.00 42.46 39.05 2jtz s ILE 112 CO -0.02 0.03 0.75 -1.81 -1.23 0.00 0.00 174.94 172.66 2jtz s ASP 113 N 1.33 5.00 0.51 3.58 1.11 -1.26 -4.00 116.67 122.95 2jtz s ASP 113 Ca -0.05 -0.93 0.32 0.00 0.18 0.00 0.00 52.55 52.07 2jtz s ASP 113 Cb -0.18 0.38 1.44 0.00 1.07 0.00 0.00 42.92 45.64 2jtz s ASP 113 CO -0.07 -1.35 1.82 -0.07 1.18 0.00 0.00 175.17 176.69 2jtz h LEU 114 N 0.23 0.09 0.01 1.23 4.07 -1.97 0.88 115.31 119.85 2jtz h LEU 114 Ca -0.30 0.02 -0.26 0.00 0.08 0.00 0.00 57.88 57.41 2jtz h LEU 114 Cb 1.29 0.00 0.01 0.00 1.08 0.00 0.00 40.66 43.05 2jtz h LEU 114 CO 0.43 0.02 -1.14 0.44 -1.08 0.00 0.00 178.44 177.11 2jtz h ASP 115 N 0.08 0.61 1.83 -0.43 5.19 -1.97 -2.15 116.42 119.57 2jtz h ASP 115 Ca 0.53 -0.56 -0.01 0.00 -0.62 0.00 0.00 57.03 56.37 2jtz h ASP 115 Cb 1.96 -0.19 -0.00 0.00 0.18 0.00 0.00 39.33 41.28 2jtz h ASP 115 CO -0.06 1.39 -0.18 -0.33 -3.12 0.00 0.00 179.24 176.94 2jtz h GLU 116 N 0.19 0.00 0.00 3.56 5.08 -0.52 -3.20 114.58 119.69 2jtz h GLU 116 Ca -0.13 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.03 2jtz h GLU 116 Cb 1.81 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 31.03 2jtz h GLU 116 CO 0.20 0.05 -1.28 -0.07 -1.00 0.00 0.00 179.01 176.91 2jtz h LEU 117 N 0.00 0.00 -0.65 1.33 4.07 0.49 -3.23 115.31 117.33 2jtz h LEU 117 Ca -0.00 0.00 -0.15 0.00 0.08 0.00 0.00 57.88 57.81 2jtz h LEU 117 Cb 1.04 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.77 2jtz h LEU 117 CO 0.01 0.76 -0.66 0.07 -1.08 0.00 0.00 178.44 177.54 2jtz h LYS 118 N 0.00 0.10 0.08 1.13 5.09 -1.42 -2.49 116.57 119.06 2jtz h LYS 118 Ca -0.15 -0.07 -0.00 0.00 0.09 0.00 0.00 60.65 60.51 2jtz h LYS 118 Cb 1.71 0.01 0.00 0.00 0.10 0.00 0.00 32.23 34.05 2jtz h LYS 118 CO 0.07 0.72 -0.04 0.82 -2.09 0.00 0.00 179.45 178.93 2jtz h ILE 119 N 0.07 1.19 0.00 0.07 2.04 -1.66 -3.14 117.51 116.08 2jtz h ILE 119 Ca -0.01 -1.36 -0.01 0.00 1.00 0.00 0.00 64.86 64.48 2jtz h ILE 119 Cb 1.17 2.02 -0.00 0.00 -0.74 0.00 0.00 36.82 39.27 2jtz h ILE 119 CO 0.09 0.32 -0.03 -0.03 0.00 0.00 0.00 178.15 178.50 2jtz h MET 120 N -0.76 0.00 -0.19 2.37 4.05 -1.62 -2.48 114.93 116.30 2jtz h MET 120 Ca -0.01 0.00 -0.04 0.00 -0.28 0.00 0.00 59.70 59.37 2jtz h MET 120 Cb 0.59 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.39 2jtz h MET 120 CO 0.02 0.03 -0.04 1.25 0.23 0.00 0.00 176.91 178.40 2jtz h LEU 121 N 0.00 0.36 -2.12 3.39 6.46 -1.43 -2.71 115.31 119.26 2jtz h LEU 121 Ca -0.00 -0.36 0.04 0.00 -0.12 0.00 0.00 57.88 57.44 2jtz h LEU 121 Cb 0.14 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 39.96 2jtz h LEU 121 CO 0.00 0.64 0.31 0.06 -0.62 0.00 0.00 178.44 178.83 2jtz h GLN 122 N 0.08 0.00 -1.55 1.25 -0.00 -1.40 0.32 115.11 113.81 2jtz h GLN 122 Ca 0.05 0.00 -0.43 0.00 -0.00 0.00 0.00 58.65 58.27 2jtz h GLN 122 Cb 0.48 0.00 -0.17 0.00 -0.00 0.00 0.00 27.48 27.79 2jtz h GLN 122 CO 0.02 0.00 0.51 0.00 -0.00 0.00 0.00 178.83 179.35 2jtz n ALA 123 N -2.09 5.64 0.00 0.06 0.00 -1.02 -4.14 120.51 118.96 2jtz n ALA 123 Ca 0.01 -2.32 0.00 0.00 0.00 0.00 0.00 53.44 51.13 2jtz n ALA 123 Cb 0.40 -1.62 0.00 0.00 0.00 0.00 0.00 19.45 18.23 2jtz n ALA 123 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2jtz n THR 124 N 0.23 0.00 0.00 0.00 5.66 -0.49 -5.07 114.28 114.61 2jtz n THR 124 Ca 0.40 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.40 2jtz n THR 124 Cb 0.58 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.36 2jtz n THR 124 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2jtz n GLY 125 N 0.00 0.51 1.90 1.09 0.00 0.10 -5.03 105.19 103.76 2jtz n GLY 125 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2jtz n GLY 125 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2jtz n GLU 126 N 0.00 0.27 -2.96 1.61 0.28 -1.26 -4.93 120.64 113.65 2jtz n GLU 126 Ca 0.00 -1.90 -0.43 0.00 -0.16 0.00 0.00 57.16 54.67 2jtz n GLU 126 Cb 0.00 1.60 -0.05 0.00 1.43 0.00 0.00 31.44 34.42 2jtz n GLU 126 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 2jtz s THR 127 N -2.77 4.57 0.30 3.84 -4.23 -1.26 -4.71 115.64 111.39 2jtz s THR 127 Ca 0.22 -0.05 0.05 0.00 -1.18 0.00 0.00 61.69 60.72 2jtz s THR 127 Cb 0.01 -4.45 -0.06 0.00 1.34 0.00 0.00 72.50 69.33 2jtz s THR 127 CO 0.16 -1.01 0.01 0.27 -0.54 0.00 0.00 174.62 173.51 2jtz s ILE 128 N 3.44 1.34 0.99 2.99 -5.25 -1.26 -5.14 121.20 118.31 2jtz s ILE 128 Ca 0.24 -2.04 -0.11 0.00 -0.99 0.00 0.00 60.65 57.75 2jtz s ILE 128 Cb -0.15 -2.62 0.19 0.00 2.95 0.00 0.00 42.46 42.82 2jtz s ILE 128 CO 0.16 -0.15 1.10 0.28 -1.79 0.00 0.00 174.94 174.55 2jtz s THR 129 N -3.20 2.12 0.09 8.37 -1.32 -1.26 -4.75 115.64 115.69 2jtz s THR 129 Ca 0.33 0.04 -0.22 0.00 -1.21 0.00 0.00 61.69 60.63 2jtz s THR 129 Cb 0.07 -2.10 -0.13 0.00 -1.51 0.00 0.00 72.50 68.82 2jtz s THR 129 CO 0.13 -0.05 1.71 -0.08 -2.21 0.00 0.00 174.62 174.12 2jtz h GLU 130 N -2.08 0.08 -0.91 7.08 4.81 -2.01 -1.06 114.58 120.49 2jtz h GLU 130 Ca -0.49 -0.01 0.23 0.00 -0.13 0.00 0.00 59.36 58.96 2jtz h GLU 130 Cb 1.29 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 30.59 2jtz h GLU 130 CO 0.45 0.09 0.62 -0.44 -0.73 0.00 0.00 179.01 179.00 2jtz h ASP 131 N 0.04 0.27 0.94 1.04 5.19 -1.99 0.40 116.42 122.30 2jtz h ASP 131 Ca 0.02 0.03 -0.22 0.00 -0.62 0.00 0.00 57.03 56.24 2jtz h ASP 131 Cb 0.04 -0.02 -0.03 0.00 0.18 0.00 0.00 39.33 39.50 2jtz h ASP 131 CO -0.00 0.10 -1.07 0.44 -3.12 0.00 0.00 179.24 175.58 2jtz h ASP 132 N 0.26 0.02 0.32 6.45 3.32 -1.76 -3.24 116.42 121.80 2jtz h ASP 132 Ca 0.46 -0.03 -0.22 0.00 0.02 0.00 0.00 57.03 57.26 2jtz h ASP 132 Cb 1.39 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.93 2jtz h ASP 132 CO -0.13 1.02 -0.93 -0.29 -1.72 0.00 0.00 179.24 177.19 2jtz h ILE 133 N 0.00 1.40 0.00 0.35 2.10 0.87 -3.12 117.51 119.11 2jtz h ILE 133 Ca -0.04 -2.43 -0.01 0.00 1.08 0.00 0.00 64.86 63.46 2jtz h ILE 133 Cb 1.80 2.40 -0.00 0.00 -1.09 0.00 0.00 36.82 39.93 2jtz h ILE 133 CO 0.13 0.73 -0.06 1.05 -1.08 0.00 0.00 178.15 178.91 2jtz h GLU 134 N 0.24 0.00 -0.32 2.19 4.11 -0.58 -2.66 114.58 117.55 2jtz h GLU 134 Ca -0.08 0.00 0.09 0.00 0.07 0.00 0.00 59.36 59.45 2jtz h GLU 134 Cb 1.56 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.80 2jtz h GLU 134 CO 0.16 0.06 0.32 0.93 0.07 0.00 0.00 179.01 180.56 2jtz h GLU 135 N 0.00 0.00 0.14 1.06 4.39 -1.57 -2.23 114.58 116.38 2jtz h GLU 135 Ca -0.00 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.71 2jtz h GLU 135 Cb 0.40 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.01 2jtz h GLU 135 CO 0.01 0.00 -0.43 -0.07 -1.16 0.00 0.00 179.01 177.36 2jtz h LEU 136 N 0.00 -1.28 0.00 1.33 4.07 -1.67 0.44 115.31 118.20 2jtz h LEU 136 Ca 0.15 0.13 -0.00 0.00 0.08 0.00 0.00 57.88 58.24 2jtz h LEU 136 Cb 0.80 0.47 0.00 0.00 1.08 0.00 0.00 40.66 43.01 2jtz h LEU 136 CO -0.00 -0.47 -0.00 -0.03 -1.08 0.00 0.00 178.44 176.86 2jtz h MET 137 N -0.64 -0.00 -0.79 1.13 1.85 -1.71 0.76 114.93 115.52 2jtz h MET 137 Ca -0.01 0.00 0.18 0.00 -0.61 0.00 0.00 59.70 59.26 2jtz h MET 137 Cb 0.63 0.00 -0.12 0.00 0.43 0.00 0.00 31.60 32.54 2jtz h MET 137 CO -0.21 0.50 0.21 -0.22 -0.40 0.00 0.00 176.91 176.79 2jtz h LYS 138 N -0.51 0.26 0.08 0.39 1.63 -1.36 -0.41 116.57 116.65 2jtz h LYS 138 Ca -0.00 -0.02 -0.28 0.00 -0.85 0.00 0.00 60.65 59.51 2jtz h LYS 138 Cb 0.51 -0.06 0.02 0.00 -0.60 0.00 0.00 32.23 32.10 2jtz h LYS 138 CO 0.00 0.17 -1.16 0.22 -3.45 0.00 0.00 179.45 175.23 2jtz h ASP 139 N 0.26 0.74 0.00 4.20 1.82 -0.12 -3.44 116.42 119.88 2jtz h ASP 139 Ca 0.46 -0.67 0.00 0.00 -0.39 0.00 0.00 57.03 56.44 2jtz h ASP 139 Cb 0.84 -0.23 0.00 0.00 0.68 0.00 0.00 39.33 40.62 2jtz h ASP 139 CO -0.56 1.48 0.00 0.61 -1.61 0.00 0.00 179.24 179.16 2jtz n GLY 140 N 1.28 -1.98 4.09 -0.78 0.00 0.26 -4.70 105.19 103.36 2jtz n GLY 140 Ca -0.11 -0.23 -0.29 0.00 0.00 0.00 0.00 46.02 45.39 2jtz n GLY 140 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2jtz n ASP 141 N 0.00 0.30 0.32 1.61 2.03 -1.19 -4.73 116.55 114.88 2jtz n ASP 141 Ca 0.00 -1.13 0.20 0.00 0.52 0.00 0.00 54.79 54.38 2jtz n ASP 141 Cb 0.00 -1.40 1.06 0.00 -0.72 0.00 0.00 41.12 40.06 2jtz n ASP 141 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 2jtz h LYS 142 N -1.52 0.00 0.00 -0.67 1.79 -1.89 0.29 116.57 114.58 2jtz h LYS 142 Ca -0.59 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.88 2jtz h LYS 142 Cb 1.23 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.88 2jtz h LYS 142 CO 0.60 0.00 0.00 -1.71 -1.08 0.00 0.00 179.45 177.26 2jtz n ASN 143 N -3.25 0.48 -2.88 0.86 5.15 -1.26 -4.98 115.26 109.37 2jtz n ASN 143 Ca -0.02 0.55 -0.09 0.00 -0.60 0.00 0.00 54.58 54.42 2jtz n ASN 143 Cb 0.16 -0.67 0.01 0.00 -0.53 0.00 0.00 39.78 38.74 2jtz n ASN 143 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2jtz n ASN 144 N -1.95 -7.79 -0.17 1.20 5.15 0.10 -4.97 115.26 106.84 2jtz n ASN 144 Ca 0.06 0.63 -0.00 0.00 -0.60 0.00 0.00 54.58 54.67 2jtz n ASN 144 Cb 0.38 -5.07 -0.00 0.00 -0.53 0.00 0.00 39.78 34.56 2jtz n ASN 144 CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 2jtz n ASP 145 N -0.10 -0.00 -3.87 1.20 5.75 -1.26 -5.02 116.55 113.24 2jtz n ASP 145 Ca 0.08 -0.33 -0.31 0.00 -0.01 0.00 0.00 54.79 54.22 2jtz n ASP 145 Cb 0.40 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.50 2jtz n ASP 145 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jtz n GLY 146 N 0.00 -0.60 3.59 6.12 0.00 -1.26 -4.97 105.19 108.06 2jtz n GLY 146 Ca -0.00 0.30 -0.09 0.00 0.00 0.00 0.00 46.02 46.22 2jtz n GLY 146 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2jtz s ARG 147 N -6.46 0.70 -0.37 1.61 3.52 -1.26 -5.13 118.95 111.56 2jtz s ARG 147 Ca 0.25 1.10 0.03 0.00 -0.13 0.00 0.00 55.73 56.98 2jtz s ARG 147 Cb -0.10 0.19 0.11 0.00 -1.56 0.00 0.00 34.95 33.59 2jtz s ARG 147 CO 0.89 -0.13 0.11 0.42 -0.81 0.00 0.00 175.30 175.78 2jtz s ILE 148 N 1.25 1.96 0.25 4.11 -1.09 -1.26 -4.68 121.20 121.75 2jtz s ILE 148 Ca -0.07 -2.33 0.03 0.00 -2.23 0.00 0.00 60.65 56.05 2jtz s ILE 148 Cb -0.05 -2.43 0.03 0.00 -1.58 0.00 0.00 42.46 38.43 2jtz s ILE 148 CO -0.13 -0.68 0.24 -0.90 -1.23 0.00 0.00 174.94 172.25 2jtz n ASP 149 N 4.12 1.51 -0.26 3.58 5.75 -1.26 -2.82 116.55 127.18 2jtz n ASP 149 Ca 0.03 -1.80 0.06 0.00 -0.01 0.00 0.00 54.79 53.07 2jtz n ASP 149 Cb 0.40 -0.08 0.19 0.00 -1.03 0.00 0.00 41.12 40.60 2jtz n ASP 149 CO 0.00 0.00 0.00 0.22 -0.11 0.00 0.00 177.20 177.31 2jtz h TYR 150 N 0.40 0.19 -0.06 2.11 3.20 -1.98 1.76 116.97 122.59 2jtz h TYR 150 Ca -0.15 0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.76 2jtz h TYR 150 Cb 0.57 0.03 -0.00 0.00 1.54 0.00 0.00 36.73 38.87 2jtz h TYR 150 CO 0.00 -0.15 0.00 0.22 -1.64 0.00 0.00 178.16 176.60 2jtz h ASP 151 N 0.21 0.11 0.77 -2.11 3.58 -2.00 -2.46 116.42 114.52 2jtz h ASP 151 Ca 0.43 -0.30 0.00 0.00 0.42 0.00 0.00 57.03 57.58 2jtz h ASP 151 Cb 0.76 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.78 2jtz h ASP 151 CO -0.57 0.38 0.00 -0.62 -2.88 0.00 0.00 179.24 175.55 2jtz n GLU 152 N -4.87 0.08 -0.00 0.28 1.02 -0.39 -1.99 120.64 114.77 2jtz n GLU 152 Ca -0.07 0.24 -0.01 0.00 -0.02 0.00 0.00 57.16 57.30 2jtz n GLU 152 Cb 0.18 -1.62 -0.01 0.00 -0.02 0.00 0.00 31.44 29.97 2jtz n GLU 152 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 2jtz h PHE 153 N 0.00 -0.06 0.00 -0.32 3.04 0.30 -3.24 116.94 116.66 2jtz h PHE 153 Ca 0.00 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 61.91 2jtz h PHE 153 Cb 0.39 0.02 -0.01 0.00 2.56 0.00 0.00 35.95 38.91 2jtz h PHE 153 CO 0.00 -0.04 -0.18 1.37 -2.02 0.00 0.00 178.31 177.44 2jtz h LEU 154 N -0.65 0.00 -1.13 0.59 -0.00 -1.52 -2.63 115.31 109.96 2jtz h LEU 154 Ca -0.01 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.85 2jtz h LEU 154 Cb 0.05 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 40.68 2jtz h LEU 154 CO 0.01 0.18 0.35 -0.33 -0.00 0.00 0.00 178.44 178.65 2jtz h GLU 155 N 0.00 0.95 0.00 0.17 5.08 -1.54 -3.16 114.58 116.09 2jtz h GLU 155 Ca -0.00 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 2jtz h GLU 155 Cb 0.45 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.51 2jtz h GLU 155 CO 0.02 0.72 0.00 1.19 -1.00 0.00 0.00 179.01 179.94 2jtz n PHE 156 N -4.35 0.00 -1.94 4.33 3.01 -0.99 -4.70 117.46 112.81 2jtz n PHE 156 Ca 0.07 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.50 2jtz n PHE 156 Cb 0.12 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.56 2jtz n PHE 156 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2jtz n MET 157 N -0.53 0.00 0.00 -1.08 0.00 -1.25 -5.01 117.12 109.26 2jtz n MET 157 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 57.70 57.27 2jtz n MET 157 Cb 0.00 0.23 0.00 0.00 0.00 0.00 0.00 33.22 33.45 2jtz n MET 157 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 2jtz n LYS 158 N 0.00 0.00 -1.75 3.17 3.00 -1.19 -4.23 118.16 117.15 2jtz n LYS 158 Ca -0.12 0.00 -0.30 0.00 -0.00 0.00 0.00 58.31 57.89 2jtz n LYS 158 Cb 0.56 0.00 0.05 0.00 0.00 0.00 0.00 35.03 35.63 2jtz n LYS 158 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2jtz n GLY 159 N 0.00 6.07 3.53 3.14 0.00 -1.26 -4.95 105.19 111.72 2jtz n GLY 159 Ca 0.00 -2.51 -0.21 0.00 0.00 0.00 0.00 46.02 43.30 2jtz n GLY 159 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2jtz n VAL 160 N -0.77 -0.01 -0.13 1.61 3.14 -1.26 -5.06 118.33 115.86 2jtz n VAL 160 Ca 0.53 -0.48 0.00 0.00 -2.96 0.00 0.00 64.34 61.42 2jtz n VAL 160 Cb 0.75 -1.08 0.00 0.00 -1.06 0.00 0.00 33.84 32.45 2jtz n VAL 160 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75