#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jss n LYS 2 N 0.00 0.00 -1.35 5.56 3.00 -1.26 -4.94 118.16 119.17 2jss n LYS 2 Ca 0.00 0.00 0.11 0.00 -0.00 0.00 0.00 58.31 58.42 2jss n LYS 2 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 35.03 34.97 2jss n LYS 2 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 2jss n GLU 3 N -0.44 -2.97 0.00 1.64 0.28 -1.26 -5.06 120.64 112.83 2jss n GLU 3 Ca 0.00 2.39 0.00 0.00 -0.16 0.00 0.00 57.16 59.39 2jss n GLU 3 Cb 0.00 -3.38 0.00 0.00 1.43 0.00 0.00 31.44 29.49 2jss n GLU 3 CO 0.00 0.00 0.00 -2.37 -0.16 0.00 0.00 177.13 174.60 2jss n THR 4 N -3.71 0.00 1.82 3.84 5.66 -1.26 -4.92 114.28 115.72 2jss n THR 4 Ca -0.06 0.00 0.16 0.00 -3.05 0.00 0.00 64.05 61.10 2jss n THR 4 Cb 0.53 0.00 0.87 0.00 -1.55 0.00 0.00 70.33 70.18 2jss n THR 4 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 175.07 170.80 2jss n TYR 5 N -0.56 0.00 -0.05 1.09 4.02 -1.26 -4.44 117.16 115.96 2jss n TYR 5 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 2jss n TYR 5 Cb 0.00 -0.07 0.01 0.00 -0.02 0.00 0.00 39.34 39.26 2jss n TYR 5 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 2jss n SER 6 N -1.00 -0.08 0.00 7.72 3.41 -1.26 -0.21 113.62 122.20 2jss n SER 6 Ca 0.21 0.24 0.00 0.00 -0.26 0.00 0.00 58.87 59.06 2jss n SER 6 Cb 0.16 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 2jss n SER 6 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2jss n SER 7 N -4.21 0.00 -0.54 4.04 3.41 -1.26 -1.30 113.62 113.76 2jss n SER 7 Ca 0.02 0.19 0.45 0.00 -0.26 0.00 0.00 58.87 59.27 2jss n SER 7 Cb 0.06 0.00 0.78 0.00 -0.26 0.00 0.00 64.21 64.78 2jss n SER 7 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 2jss h TYR 8 N 0.00 0.07 0.01 7.33 0.05 -1.81 2.34 116.97 124.96 2jss h TYR 8 Ca 0.00 0.00 -0.23 0.00 0.05 0.00 0.00 58.73 58.55 2jss h TYR 8 Cb 0.00 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 37.73 2jss h TYR 8 CO 0.00 -0.02 -0.98 0.97 -1.05 0.00 0.00 178.16 177.08 2jss h ILE 9 N 0.02 1.40 -0.21 -2.88 2.10 -0.69 -1.97 117.51 115.27 2jss h ILE 9 Ca 0.79 -2.48 0.06 0.00 1.08 0.00 0.00 64.86 64.32 2jss h ILE 9 Cb 3.09 2.46 -0.01 0.00 -1.09 0.00 0.00 36.82 41.27 2jss h ILE 9 CO -0.06 0.74 0.42 0.22 -1.08 0.00 0.00 178.15 178.39 2jss h TYR 10 N 0.23 0.00 0.03 2.19 5.03 0.53 2.32 116.97 127.30 2jss h TYR 10 Ca -0.09 0.00 -0.28 0.00 2.58 0.00 0.00 58.73 60.94 2jss h TYR 10 Cb 1.62 0.00 -0.04 0.00 1.55 0.00 0.00 36.73 39.87 2jss h TYR 10 CO 0.06 0.00 -1.52 0.87 -1.32 0.00 0.00 178.16 176.26 2jss h LYS 11 N 0.00 0.06 -0.00 1.82 6.56 -0.74 -2.40 116.57 121.87 2jss h LYS 11 Ca 0.10 -0.10 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 2jss h LYS 11 Cb 0.94 0.04 0.00 0.00 -0.57 0.00 0.00 32.23 32.64 2jss h LYS 11 CO -0.00 0.77 -0.14 0.28 -2.06 0.00 0.00 179.45 178.30 2jss n VAL 12 N -3.22 0.00 0.06 0.50 0.31 0.64 -1.22 118.33 115.41 2jss n VAL 12 Ca -0.13 -0.00 -0.23 0.00 -0.01 0.00 0.00 64.34 63.96 2jss n VAL 12 Cb 1.02 -0.27 -0.15 0.00 -0.91 0.00 0.00 33.84 33.53 2jss n VAL 12 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 2jss h LEU 13 N 0.04 0.59 0.04 7.52 5.85 0.30 -2.34 115.31 127.31 2jss h LEU 13 Ca 0.00 -0.93 -0.26 0.00 0.84 0.00 0.00 57.88 57.53 2jss h LEU 13 Cb 0.48 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 2jss h LEU 13 CO 0.00 1.78 -1.34 0.11 -0.34 0.00 0.00 178.44 178.65 2jss h LYS 14 N 0.06 0.09 0.25 1.25 6.56 -1.41 -3.07 116.57 120.30 2jss h LYS 14 Ca -0.34 -0.16 -0.01 0.00 -1.06 0.00 0.00 60.65 59.08 2jss h LYS 14 Cb 2.06 0.06 0.00 0.00 -0.57 0.00 0.00 32.23 33.78 2jss h LYS 14 CO 0.16 0.93 -0.12 1.96 -2.06 0.00 0.00 179.45 180.32 2jss h GLN 15 N 0.03 -0.32 -0.88 3.15 7.50 -1.31 -3.03 115.11 120.24 2jss h GLN 15 Ca -0.15 0.02 0.19 0.00 0.50 0.00 0.00 58.65 59.21 2jss h GLN 15 Cb 1.91 0.07 -0.06 0.00 0.05 0.00 0.00 27.48 29.45 2jss h GLN 15 CO 0.13 -0.01 0.58 0.00 -1.50 0.00 0.00 178.83 178.03 2jss h THR 16 N -0.98 0.70 -1.84 -0.54 1.03 -1.58 -3.42 112.91 106.29 2jss h THR 16 Ca -0.03 -0.14 -0.00 0.00 -0.01 0.00 0.00 66.41 66.22 2jss h THR 16 Cb 0.46 0.25 -0.22 0.00 -1.07 0.00 0.00 68.15 67.56 2jss h THR 16 CO 0.06 0.08 0.28 -1.00 -0.01 0.00 0.00 175.52 174.92 2jss s HIS 17 N -5.44 -0.63 -0.60 0.00 3.76 -1.16 -4.91 115.29 106.30 2jss s HIS 17 Ca -0.08 1.45 0.25 0.00 -0.15 0.00 0.00 55.06 56.53 2jss s HIS 17 Cb 0.22 0.34 0.67 0.00 1.11 0.00 0.00 32.58 34.92 2jss s HIS 17 CO 0.78 -0.36 1.72 -1.00 -0.85 0.00 0.00 174.74 175.03 2jss h PRO 18 N 4.22 0.00 -2.40 8.40 0.13 -1.73 -3.23 132.00 137.39 2jss h PRO 18 Ca -0.27 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.23 2jss h PRO 18 Cb 1.16 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.89 2jss h PRO 18 CO 0.14 0.00 -0.41 -0.25 -0.23 0.00 0.00 178.00 177.25 2jss n ASP 19 N -2.57 4.04 -3.41 1.44 9.92 -1.26 -4.93 116.55 119.77 2jss n ASP 19 Ca 0.05 -3.41 -0.25 0.00 -0.53 0.00 0.00 54.79 50.65 2jss n ASP 19 Cb 0.46 -0.76 -0.10 0.00 -0.64 0.00 0.00 41.12 40.07 2jss n ASP 19 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 2jss s THR 20 N -2.40 -0.00 -2.19 -3.53 2.01 -1.25 -4.28 115.64 104.00 2jss s THR 20 Ca 0.37 -1.60 0.22 0.00 0.31 0.00 0.00 61.69 60.99 2jss s THR 20 Cb 0.11 -0.97 0.53 0.00 0.01 0.00 0.00 72.50 72.17 2jss s THR 20 CO -0.02 -0.88 1.68 0.61 -0.69 0.00 0.00 174.62 175.32 2jss n GLY 21 N 3.93 -0.26 0.85 4.40 0.00 0.71 -4.77 105.19 110.04 2jss n GLY 21 Ca 0.14 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2jss n GLY 21 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2jss n ILE 22 N -0.15 0.00 -0.74 -0.61 3.06 -1.18 -4.82 119.36 114.91 2jss n ILE 22 Ca 0.16 0.00 -0.33 0.00 -2.50 0.00 0.00 62.75 60.09 2jss n ILE 22 Cb 0.23 -0.46 0.14 0.00 0.54 0.00 0.00 39.64 40.09 2jss n ILE 22 CO 0.00 0.00 0.00 -0.24 -2.50 0.00 0.00 176.55 173.81 2jss n SER 23 N 1.32 -2.09 0.12 9.51 2.88 -1.26 -4.66 113.62 119.44 2jss n SER 23 Ca 0.00 0.18 -0.06 0.00 -1.33 0.00 0.00 58.87 57.66 2jss n SER 23 Cb 0.00 -1.14 -0.03 0.00 -0.75 0.00 0.00 64.21 62.29 2jss n SER 23 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 2jss h GLN 24 N -1.76 -0.34 -0.68 -1.46 -0.00 -1.99 0.10 115.11 108.98 2jss h GLN 24 Ca -0.47 0.02 0.11 0.00 -0.00 0.00 0.00 58.65 58.31 2jss h GLN 24 Cb 1.31 0.08 -0.04 0.00 0.00 0.00 0.00 27.48 28.82 2jss h GLN 24 CO 0.36 -0.22 0.45 0.87 0.00 0.00 0.00 178.83 180.29 2jss h LYS 25 N -0.35 0.46 -0.42 1.69 6.56 -1.97 1.20 116.57 123.74 2jss h LYS 25 Ca -0.03 -0.03 0.11 0.00 -1.06 0.00 0.00 60.65 59.64 2jss h LYS 25 Cb 0.29 -0.10 -0.02 0.00 -0.57 0.00 0.00 32.23 31.82 2jss h LYS 25 CO 0.02 0.30 0.30 0.77 -2.06 0.00 0.00 179.45 178.78 2jss h SER 26 N 0.47 0.08 1.87 0.86 0.02 -1.77 2.57 113.55 117.65 2jss h SER 26 Ca 0.32 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 2jss h SER 26 Cb 0.61 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.13 2jss h SER 26 CO -0.10 0.05 0.00 -0.03 -1.14 0.00 0.00 176.83 175.61 2jss h MET 27 N 0.09 0.00 0.11 3.45 -1.53 0.34 -2.37 114.93 115.03 2jss h MET 27 Ca 0.20 0.00 -0.35 0.00 -3.44 0.00 0.00 59.70 56.11 2jss h MET 27 Cb 0.68 0.00 -0.02 0.00 -0.55 0.00 0.00 31.60 31.71 2jss h MET 27 CO -0.02 0.00 -1.89 1.03 0.14 0.00 0.00 176.91 176.17 2jss h SER 28 N 0.00 0.38 -0.11 1.39 0.87 0.51 -2.25 113.55 114.34 2jss h SER 28 Ca 0.00 -0.79 -0.02 0.00 -1.23 0.00 0.00 61.79 59.75 2jss h SER 28 Cb 0.93 -0.12 -0.00 0.00 -0.44 0.00 0.00 62.40 62.77 2jss h SER 28 CO 0.00 1.70 -0.03 0.40 -0.53 0.00 0.00 176.83 178.37 2jss h ILE 29 N 0.07 1.29 0.65 2.23 2.04 0.21 1.86 117.51 125.86 2jss h ILE 29 Ca -0.38 -0.96 -0.03 0.00 1.00 0.00 0.00 64.86 64.48 2jss h ILE 29 Cb 2.04 1.72 0.01 0.00 -0.74 0.00 0.00 36.82 39.84 2jss h ILE 29 CO 0.10 0.27 -0.31 -0.07 0.00 0.00 0.00 178.15 178.15 2jss h LEU 30 N -0.12 -0.74 -1.13 1.44 4.07 -1.59 0.64 115.31 117.88 2jss h LEU 30 Ca 0.03 -0.01 0.18 0.00 0.08 0.00 0.00 57.88 58.16 2jss h LEU 30 Cb 0.44 0.19 -0.09 0.00 1.08 0.00 0.00 40.66 42.28 2jss h LEU 30 CO 0.01 -0.44 0.61 0.78 -1.08 0.00 0.00 178.44 178.32 2jss h ASN 31 N -1.02 0.72 -0.36 -0.43 4.21 -1.34 1.38 115.58 118.74 2jss h ASN 31 Ca -0.09 0.07 -0.10 0.00 1.21 0.00 0.00 56.30 57.39 2jss h ASN 31 Cb 0.71 -0.06 -0.02 0.00 -1.12 0.00 0.00 38.32 37.83 2jss h ASN 31 CO 0.15 0.29 -0.15 -1.28 -1.29 0.00 0.00 177.43 175.15 2jss h SER 32 N 0.72 0.82 0.24 5.81 0.87 0.34 0.89 113.55 123.24 2jss h SER 32 Ca 0.54 -0.27 -0.01 0.00 -1.23 0.00 0.00 61.79 60.82 2jss h SER 32 Cb 0.88 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 62.62 2jss h SER 32 CO -0.31 0.97 -0.11 0.15 -0.53 0.00 0.00 176.83 177.00 2jss h PHE 33 N 0.73 -0.30 -1.27 2.24 3.57 0.50 1.39 116.94 123.81 2jss h PHE 33 Ca 0.11 -0.01 0.45 0.00 3.53 0.00 0.00 57.97 62.06 2jss h PHE 33 Cb 0.66 0.10 -0.15 0.00 2.79 0.00 0.00 35.95 39.35 2jss h PHE 33 CO 0.04 -0.18 0.79 0.28 -2.23 0.00 0.00 178.31 177.00 2jss h VAL 34 N -0.54 0.03 0.15 1.41 2.07 0.16 2.79 116.25 122.33 2jss h VAL 34 Ca -0.03 -0.01 -0.30 0.00 0.82 0.00 0.00 66.70 67.18 2jss h VAL 34 Cb 0.24 0.00 0.01 0.00 -1.52 0.00 0.00 31.29 30.03 2jss h VAL 34 CO 0.05 0.00 -1.36 -1.13 0.02 0.00 0.00 177.57 175.16 2jss h ASN 35 N 0.02 0.51 0.04 0.57 -1.24 0.10 -1.93 115.58 113.65 2jss h ASN 35 Ca 0.86 -0.58 -0.22 0.00 0.71 0.00 0.00 56.30 57.08 2jss h ASN 35 Cb 2.63 -0.17 0.02 0.00 0.73 0.00 0.00 38.32 41.53 2jss h ASN 35 CO -0.54 1.46 -0.88 0.44 -1.29 0.00 0.00 177.43 176.61 2jss h ASP 36 N 0.09 0.71 0.74 1.15 3.32 1.41 -2.41 116.42 121.44 2jss h ASP 36 Ca -0.19 -0.78 -0.04 0.00 0.02 0.00 0.00 57.03 56.04 2jss h ASP 36 Cb 2.03 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 41.35 2jss h ASP 36 CO 0.21 1.41 -0.18 -0.29 -1.72 0.00 0.00 179.24 178.67 2jss h ILE 37 N 0.10 0.52 -0.61 0.35 2.10 0.38 0.53 117.51 120.88 2jss h ILE 37 Ca -0.12 -0.90 -0.09 0.00 1.08 0.00 0.00 64.86 64.82 2jss h ILE 37 Cb 1.58 1.62 -0.02 0.00 -1.09 0.00 0.00 36.82 38.91 2jss h ILE 37 CO 0.17 0.18 0.02 0.15 -1.08 0.00 0.00 178.15 177.59 2jss h PHE 38 N 0.00 1.15 0.01 2.19 3.57 -1.23 -2.48 116.94 120.15 2jss h PHE 38 Ca -0.00 -0.19 -0.00 0.00 3.53 0.00 0.00 57.97 61.31 2jss h PHE 38 Cb 0.60 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 39.04 2jss h PHE 38 CO 0.00 1.01 -0.00 0.93 -2.23 0.00 0.00 178.31 178.01 2jss h GLU 39 N 0.96 -0.01 -0.90 1.11 5.08 -0.73 -2.04 114.58 118.05 2jss h GLU 39 Ca 0.18 0.00 0.23 0.00 -1.00 0.00 0.00 59.36 58.77 2jss h GLU 39 Cb 0.53 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 29.62 2jss h GLU 39 CO 0.03 0.80 0.01 -0.09 -1.00 0.00 0.00 179.01 178.75 2jss h ARG 40 N -0.86 0.05 0.00 2.33 2.43 0.02 2.33 114.38 120.68 2jss h ARG 40 Ca -0.00 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2jss h ARG 40 Cb 0.81 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.35 2jss h ARG 40 CO 0.00 0.04 0.00 -0.89 -1.51 0.00 0.00 179.97 177.61 2jss n ILE 41 N -5.43 0.00 0.33 1.20 5.41 -0.94 -2.11 119.36 117.82 2jss n ILE 41 Ca 0.19 0.59 0.07 0.00 1.00 0.00 0.00 62.75 64.61 2jss n ILE 41 Cb 0.64 -1.26 0.40 0.00 -0.71 0.00 0.00 39.64 38.70 2jss n ILE 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2jss h ALA 42 N -2.00 1.66 0.00 -1.39 0.00 -1.13 0.46 119.26 116.86 2jss h ALA 42 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2jss h ALA 42 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2jss h ALA 42 CO 0.00 -0.66 -0.00 1.15 0.00 0.00 0.00 179.25 179.74 2jss h THR 43 N 0.00 0.86 -0.80 0.00 2.02 0.39 0.36 112.91 115.74 2jss h THR 43 Ca 0.00 -1.64 -0.00 0.00 0.77 0.00 0.00 66.41 65.53 2jss h THR 43 Cb 1.33 1.63 -0.04 0.00 -1.74 0.00 0.00 68.15 69.33 2jss h THR 43 CO 0.00 0.29 0.48 -0.33 0.37 0.00 0.00 175.52 176.33 2jss h GLU 44 N -1.00 1.07 -0.15 6.66 3.07 -0.24 2.27 114.58 126.26 2jss h GLU 44 Ca -0.00 -0.09 -0.00 0.00 -0.50 0.00 0.00 59.36 58.76 2jss h GLU 44 Cb 0.48 -0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 28.15 2jss h GLU 44 CO 0.00 0.75 0.07 0.00 -1.40 0.00 0.00 179.01 178.43 2jss h ALA 45 N 1.44 0.19 0.00 3.43 0.00 -0.31 0.62 119.26 124.63 2jss h ALA 45 Ca 0.29 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 2jss h ALA 45 Cb -0.05 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2jss h ALA 45 CO -0.05 -0.26 -0.02 1.03 0.00 0.00 0.00 179.25 179.94 2jss h SER 46 N 0.12 0.00 0.00 0.00 0.87 0.41 -1.58 113.55 113.37 2jss h SER 46 Ca 0.05 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 2jss h SER 46 Cb 0.11 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.07 2jss h SER 46 CO -0.01 0.02 -0.02 0.50 -0.53 0.00 0.00 176.83 176.80 2jss h LYS 47 N 0.00 0.00 0.00 2.24 1.63 0.63 -1.40 116.57 119.67 2jss h LYS 47 Ca -0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 2jss h LYS 47 Cb 0.31 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.94 2jss h LYS 47 CO 0.00 0.00 0.08 1.47 -3.45 0.00 0.00 179.45 177.55 2jss n LEU 48 N -4.66 0.36 -0.00 5.20 -0.00 0.19 0.48 117.00 118.58 2jss n LEU 48 Ca -0.00 0.63 -0.10 0.00 -0.00 0.00 0.00 56.01 56.54 2jss n LEU 48 Cb 0.01 -0.66 -0.14 0.00 -0.00 0.00 0.00 43.42 42.63 2jss n LEU 48 CO 0.00 -0.76 -0.44 0.00 -0.00 0.00 0.00 177.39 176.19 2jss h ALA 49 N 1.76 0.67 0.00 1.47 0.00 -1.30 1.26 119.26 123.12 2jss h ALA 49 Ca 0.00 -1.37 -0.04 0.00 0.00 0.00 0.00 54.91 53.50 2jss h ALA 49 Cb 0.16 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2jss h ALA 49 CO 0.00 1.50 -0.19 0.00 0.00 0.00 0.00 179.25 180.56 2jss h ALA 50 N 0.90 1.06 0.01 0.00 0.00 0.12 1.39 119.26 122.74 2jss h ALA 50 Ca -0.26 -0.17 -0.41 0.00 0.00 0.00 0.00 54.91 54.08 2jss h ALA 50 Cb 1.98 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 19.68 2jss h ALA 50 CO 0.09 0.23 -2.32 0.66 0.00 0.00 0.00 179.25 177.91 2jss n TYR 51 N -3.40 0.24 1.04 0.00 4.02 -0.68 -4.25 117.16 114.13 2jss n TYR 51 Ca -0.00 0.08 0.13 0.00 -0.01 0.00 0.00 57.90 58.10 2jss n TYR 51 Cb 0.38 -1.03 0.60 0.00 -0.02 0.00 0.00 39.34 39.28 2jss n TYR 51 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2jss n ASN 52 N -3.92 0.00 0.00 7.72 2.85 0.43 -4.85 115.26 117.49 2jss n ASN 52 Ca -0.47 0.26 0.00 0.00 -0.11 0.00 0.00 54.58 54.26 2jss n ASN 52 Cb 0.90 -0.41 0.00 0.00 1.24 0.00 0.00 39.78 41.51 2jss n ASN 52 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 2jss n LYS 53 N -1.41 -1.04 -0.54 1.20 5.02 0.47 -4.82 118.16 117.04 2jss n LYS 53 Ca 0.09 0.26 -0.14 0.00 -2.02 0.00 0.00 58.31 56.50 2jss n LYS 53 Cb 0.27 -4.25 -0.03 0.00 -0.02 0.00 0.00 35.03 30.99 2jss n LYS 53 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2jss n LYS 54 N -0.68 1.43 -0.32 1.97 5.02 -1.02 -4.55 118.16 120.01 2jss n LYS 54 Ca 0.00 -1.02 0.19 0.00 -2.02 0.00 0.00 58.31 55.46 2jss n LYS 54 Cb 0.26 -2.17 0.39 0.00 -0.02 0.00 0.00 35.03 33.49 2jss n LYS 54 CO 0.00 0.00 0.00 0.77 -0.52 0.00 0.00 177.40 177.65 2jss h SER 55 N 6.08 0.25 -0.31 4.39 0.02 -1.88 -3.15 113.55 118.95 2jss h SER 55 Ca 0.30 0.20 -0.19 0.00 -0.84 0.00 0.00 61.79 61.26 2jss h SER 55 Cb 0.29 0.21 -0.02 0.00 0.14 0.00 0.00 62.40 63.01 2jss h SER 55 CO 1.07 -0.16 0.61 -0.89 -1.14 0.00 0.00 176.83 176.32 2jss s THR 56 N -5.79 3.31 -0.77 -2.27 2.01 -1.26 -4.50 115.64 106.37 2jss s THR 56 Ca -0.11 -0.53 -0.26 0.00 0.31 0.00 0.00 61.69 61.11 2jss s THR 56 Cb 0.28 -4.30 -0.13 0.00 0.01 0.00 0.00 72.50 68.37 2jss s THR 56 CO 0.78 -0.57 2.38 -0.63 -0.69 0.00 0.00 174.62 175.89 2jss s ILE 57 N 13.73 3.04 0.55 1.82 -1.09 -1.19 -4.90 121.20 133.15 2jss s ILE 57 Ca 0.74 -0.03 0.06 0.00 -2.23 0.00 0.00 60.65 59.20 2jss s ILE 57 Cb -0.03 -3.08 0.06 0.00 -1.58 0.00 0.00 42.46 37.83 2jss s ILE 57 CO 0.15 -0.08 0.75 -0.44 -1.23 0.00 0.00 174.94 174.10 2jss s SER 58 N 10.82 5.18 0.52 3.58 0.01 -1.26 -4.22 113.70 128.33 2jss s SER 58 Ca 0.92 -0.52 0.31 0.00 1.31 0.00 0.00 55.95 57.97 2jss s SER 58 Cb -0.13 -0.21 1.46 0.00 0.21 0.00 0.00 66.02 67.35 2jss s SER 58 CO 0.09 -1.22 1.86 0.00 0.41 0.00 0.00 173.24 174.38 2jss h ALA 59 N 0.19 2.84 -0.07 1.44 0.00 0.40 0.23 119.26 124.28 2jss h ALA 59 Ca -0.36 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.43 2jss h ALA 59 Cb 1.28 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 2jss h ALA 59 CO 0.44 -1.12 -0.38 -0.09 0.00 0.00 0.00 179.25 178.09 2jss h ARG 60 N 0.04 0.15 0.12 0.00 1.12 -1.93 0.99 114.38 114.88 2jss h ARG 60 Ca 0.47 -0.07 -0.01 0.00 -1.11 0.00 0.00 59.98 59.27 2jss h ARG 60 Cb 1.79 -0.01 0.00 0.00 -0.01 0.00 0.00 29.97 31.75 2jss h ARG 60 CO -0.03 0.52 -0.06 0.93 -3.11 0.00 0.00 179.97 178.22 2jss h GLU 61 N 0.13 -0.16 -0.47 0.20 3.07 -0.90 -2.58 114.58 113.87 2jss h GLU 61 Ca 0.01 0.01 -0.04 0.00 -0.50 0.00 0.00 59.36 58.85 2jss h GLU 61 Cb 0.74 0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.66 2jss h GLU 61 CO 0.06 0.31 0.14 -0.84 -1.40 0.00 0.00 179.01 177.28 2jss h ILE 62 N -0.78 1.20 0.29 3.13 -2.65 -1.54 -2.45 117.51 114.71 2jss h ILE 62 Ca -0.02 -0.68 0.00 0.00 1.03 0.00 0.00 64.86 65.20 2jss h ILE 62 Cb 0.55 0.69 -0.03 0.00 -2.05 0.00 0.00 36.82 35.97 2jss h ILE 62 CO 0.03 0.25 -0.44 1.56 0.03 0.00 0.00 178.15 179.59 2jss h GLN 63 N 0.69 -0.76 -0.15 0.16 4.20 -0.79 1.24 115.11 119.70 2jss h GLN 63 Ca 0.16 0.05 0.03 0.00 0.06 0.00 0.00 58.65 58.95 2jss h GLN 63 Cb 0.22 0.17 -0.06 0.00 0.30 0.00 0.00 27.48 28.11 2jss h GLN 63 CO -0.01 -0.51 -0.50 1.79 -0.67 0.00 0.00 178.83 178.94 2jss h THR 64 N -0.79 0.00 -0.13 -0.54 1.35 -1.16 1.53 112.91 113.17 2jss h THR 64 Ca -0.02 0.00 0.03 0.00 -0.55 0.00 0.00 66.41 65.87 2jss h THR 64 Cb 0.74 0.00 -0.06 0.00 -1.73 0.00 0.00 68.15 67.10 2jss h THR 64 CO -0.15 0.00 -0.51 0.00 -0.25 0.00 0.00 175.52 174.61 2jss h ALA 65 N -0.37 -0.87 -1.17 6.62 0.00 -1.08 1.25 119.26 123.64 2jss h ALA 65 Ca 0.03 -0.06 0.34 0.00 0.00 0.00 0.00 54.91 55.22 2jss h ALA 65 Cb 0.62 0.98 -0.10 0.00 0.00 0.00 0.00 17.79 19.29 2jss h ALA 65 CO -0.42 -1.05 0.77 0.28 0.00 0.00 0.00 179.25 178.83 2jss h VAL 66 N -0.54 0.37 0.00 0.00 2.07 0.26 3.09 116.25 121.49 2jss h VAL 66 Ca 0.03 -0.08 -0.11 0.00 0.82 0.00 0.00 66.70 67.36 2jss h VAL 66 Cb 0.63 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 2jss h VAL 66 CO -0.41 0.04 -0.50 0.03 0.02 0.00 0.00 177.57 176.75 2jss h ARG 67 N 0.24 0.00 0.00 1.57 3.08 0.96 -2.01 114.38 118.21 2jss h ARG 67 Ca 0.67 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.61 2jss h ARG 67 Cb 1.99 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 32.02 2jss h ARG 67 CO -0.29 0.50 -1.76 1.28 -1.07 0.00 0.00 179.97 178.62 2jss n LEU 68 N -3.30 0.35 -0.03 3.04 4.77 0.43 -4.50 117.00 117.77 2jss n LEU 68 Ca 0.01 0.15 -0.02 0.00 -0.03 0.00 0.00 56.01 56.12 2jss n LEU 68 Cb 0.69 0.11 -0.02 0.00 -2.33 0.00 0.00 43.42 41.87 2jss n LEU 68 CO 0.40 0.10 0.06 0.40 -1.33 0.00 0.00 177.39 177.02 2jss h ILE 69 N 0.00 0.21 -3.23 -0.08 1.08 0.49 -3.45 117.51 112.53 2jss h ILE 69 Ca -0.15 -1.12 -0.53 0.00 -0.39 0.00 0.00 64.86 62.67 2jss h ILE 69 Cb 1.39 0.38 0.00 0.00 -3.07 0.00 0.00 36.82 35.53 2jss h ILE 69 CO 0.02 0.07 0.56 -0.76 -0.69 0.00 0.00 178.15 177.34 2jss s LEU 70 N -8.56 4.38 0.44 1.44 1.43 -0.76 -4.88 118.68 112.17 2jss s LEU 70 Ca -0.03 2.04 0.38 0.00 -1.03 0.00 0.00 54.13 55.50 2jss s LEU 70 Cb -0.00 -3.58 1.39 0.00 0.03 0.00 0.00 46.19 44.03 2jss s LEU 70 CO 0.10 -0.45 1.29 -2.65 0.23 0.00 0.00 176.35 174.86 2jss n PRO 71 N 3.75 -0.01 0.00 1.29 -0.02 -1.26 -4.67 135.00 134.08 2jss n PRO 71 Ca 0.08 0.93 0.00 0.00 -2.02 0.00 0.00 63.50 62.49 2jss n PRO 71 Cb 0.46 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 2jss n PRO 71 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jss n GLY 72 N -1.68 2.18 0.33 -1.23 0.00 -1.26 -4.94 105.19 98.58 2jss n GLY 72 Ca 0.36 -0.42 -0.03 0.00 0.00 0.00 0.00 46.02 45.93 2jss n GLY 72 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2jss h GLU 73 N 0.00 -0.11 -0.38 1.61 4.81 -2.00 0.73 114.58 119.24 2jss h GLU 73 Ca 0.00 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.29 2jss h GLU 73 Cb 0.00 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.36 2jss h GLU 73 CO 0.00 -0.07 0.12 -0.07 -0.73 0.00 0.00 179.01 178.26 2jss h LEU 74 N -0.11 0.10 -0.47 1.64 3.38 -1.92 -1.52 115.31 116.41 2jss h LEU 74 Ca 0.27 0.05 0.09 0.00 0.09 0.00 0.00 57.88 58.38 2jss h LEU 74 Cb 0.55 0.05 -0.10 0.00 0.09 0.00 0.00 40.66 41.25 2jss h LEU 74 CO -0.72 0.09 -0.29 0.00 0.09 0.00 0.00 178.44 177.62 2jss h ALA 75 N 1.26 -0.04 -0.90 1.53 0.00 -0.00 0.50 119.26 121.61 2jss h ALA 75 Ca 0.18 0.14 0.25 0.00 0.00 0.00 0.00 54.91 55.48 2jss h ALA 75 Cb 0.18 0.67 -0.14 0.00 0.00 0.00 0.00 17.79 18.49 2jss h ALA 75 CO -0.20 -0.66 0.29 0.87 0.00 0.00 0.00 179.25 179.56 2jss h LYS 76 N -0.18 0.23 -0.24 0.00 1.79 0.51 2.78 116.57 121.45 2jss h LYS 76 Ca 0.21 -0.01 -0.15 0.00 -2.18 0.00 0.00 60.65 58.51 2jss h LYS 76 Cb 0.52 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 31.11 2jss h LYS 76 CO -0.58 0.15 -0.46 0.45 -1.08 0.00 0.00 179.45 177.94 2jss h HIS 77 N 0.24 0.76 0.00 -1.35 3.86 0.05 -2.10 115.15 116.60 2jss h HIS 77 Ca 0.58 -0.24 -0.13 0.00 -1.16 0.00 0.00 60.37 59.42 2jss h HIS 77 Cb 1.19 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 29.49 2jss h HIS 77 CO -0.22 0.97 -0.61 0.00 0.86 0.00 0.00 177.93 178.93 2jss h ALA 78 N 0.99 0.71 0.10 2.45 0.00 0.57 -2.41 119.26 121.66 2jss h ALA 78 Ca 0.03 -0.55 -0.28 0.00 0.00 0.00 0.00 54.91 54.11 2jss h ALA 78 Cb 0.99 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 18.70 2jss h ALA 78 CO 0.09 0.76 -1.19 0.28 0.00 0.00 0.00 179.25 179.19 2jss h VAL 79 N 0.00 1.35 -0.09 0.00 2.07 0.44 -0.96 116.25 119.06 2jss h VAL 79 Ca -0.01 -2.58 -0.07 0.00 0.82 0.00 0.00 66.70 64.87 2jss h VAL 79 Cb 1.33 2.70 0.00 0.00 -1.52 0.00 0.00 31.29 33.79 2jss h VAL 79 CO 0.08 0.77 -0.21 -1.28 0.02 0.00 0.00 177.57 176.95 2jss h SER 80 N 0.23 0.34 0.12 0.57 0.87 -1.43 -2.20 113.55 112.06 2jss h SER 80 Ca -0.16 -0.58 -0.11 0.00 -1.23 0.00 0.00 61.79 59.71 2jss h SER 80 Cb 1.87 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 63.72 2jss h SER 80 CO 0.22 0.86 -0.38 -0.08 -0.53 0.00 0.00 176.83 176.91 2jss h GLU 81 N -0.15 0.35 -0.37 2.24 4.57 -1.54 -2.09 114.58 117.59 2jss h GLU 81 Ca -0.00 -0.16 -0.10 0.00 -1.18 0.00 0.00 59.36 57.92 2jss h GLU 81 Cb 0.81 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.38 2jss h GLU 81 CO 0.05 0.69 -0.14 0.78 -1.18 0.00 0.00 179.01 179.20 2jss h GLY 82 N 1.15 0.82 0.06 1.92 0.00 -1.16 -2.19 103.07 103.65 2jss h GLY 82 Ca 0.03 -0.71 -0.00 0.00 0.00 0.00 0.00 47.33 46.65 2jss h GLY 82 CO 0.06 0.65 -0.03 -0.91 0.00 0.00 0.00 176.54 176.32 2jss h THR 83 N 0.55 0.00 -1.19 4.70 1.35 -1.34 -2.36 112.91 114.61 2jss h THR 83 Ca 0.09 -0.12 0.42 0.00 -0.55 0.00 0.00 66.41 66.25 2jss h THR 83 Cb 0.68 0.00 -0.13 0.00 -1.73 0.00 0.00 68.15 66.97 2jss h THR 83 CO 0.05 0.00 0.75 -1.14 -0.25 0.00 0.00 175.52 174.93 2jss n ARG 84 N -2.54 -0.03 0.02 4.72 3.00 -0.79 0.28 116.66 121.31 2jss n ARG 84 Ca -0.01 1.13 -0.13 0.00 -0.00 0.00 0.00 57.85 58.84 2jss n ARG 84 Cb 0.03 -2.20 -0.09 0.00 0.00 0.00 0.00 32.46 30.20 2jss n ARG 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2jss h ALA 85 N 1.46 -0.04 -0.96 5.13 0.00 -1.42 -2.06 119.26 121.37 2jss h ALA 85 Ca 0.78 -0.18 0.19 0.00 0.00 0.00 0.00 54.91 55.71 2jss h ALA 85 Cb 2.47 0.02 -0.08 0.00 0.00 0.00 0.00 17.79 20.19 2jss h ALA 85 CO -0.45 -0.35 0.61 0.28 0.00 0.00 0.00 179.25 179.34 2jss h VAL 86 N -0.39 0.71 0.00 0.00 2.07 0.47 0.45 116.25 119.56 2jss h VAL 86 Ca -0.00 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 67.31 2jss h VAL 86 Cb 0.36 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.18 2jss h VAL 86 CO 0.01 0.11 0.00 0.41 0.02 0.00 0.00 177.57 178.12 2jss n THR 87 N -4.62 0.00 -0.23 2.57 -1.04 0.14 -1.01 114.28 110.08 2jss n THR 87 Ca 0.21 1.21 -0.02 0.00 -2.04 0.00 0.00 64.05 63.41 2jss n THR 87 Cb 0.62 -2.21 0.05 0.00 -1.82 0.00 0.00 70.33 66.97 2jss n THR 87 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 2jss h LYS 88 N 0.00 -0.07 -0.95 -2.82 1.63 -1.16 3.76 116.57 116.97 2jss h LYS 88 Ca 0.00 0.00 0.13 0.00 -0.85 0.00 0.00 60.65 59.94 2jss h LYS 88 Cb 0.00 0.02 -0.15 0.00 -0.60 0.00 0.00 32.23 31.50 2jss h LYS 88 CO 0.00 -0.04 -0.43 -0.92 -3.45 0.00 0.00 179.45 174.61 2jss h TYR 89 N -0.07 -1.26 0.00 1.91 3.20 -0.09 0.99 116.97 121.65 2jss h TYR 89 Ca 0.30 0.11 0.00 0.00 3.14 0.00 0.00 58.73 62.28 2jss h TYR 89 Cb 0.54 0.68 0.00 0.00 1.54 0.00 0.00 36.73 39.49 2jss h TYR 89 CO -0.61 -0.40 -1.05 -1.13 -1.64 0.00 0.00 178.16 173.33 2jss n SER 90 N -5.42 0.91 -0.05 -2.11 3.41 -0.16 -4.18 113.62 106.02 2jss n SER 90 Ca 0.08 -0.91 0.13 0.00 -0.26 0.00 0.00 58.87 57.91 2jss n SER 90 Cb 0.37 1.08 0.45 0.00 -0.26 0.00 0.00 64.21 65.85 2jss n SER 90 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2jss n SER 91 N -1.55 0.39 -1.17 4.04 7.64 1.23 -4.52 113.62 119.68 2jss n SER 91 Ca 0.03 -0.16 0.00 0.00 1.01 0.00 0.00 58.87 59.75 2jss n SER 91 Cb 0.34 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 2jss n SER 91 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2jss n SER 92 N -1.31 0.00 -0.48 6.43 3.41 0.24 -4.81 113.62 117.10 2jss n SER 92 Ca 0.09 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.72 2jss n SER 92 Cb 0.32 0.00 0.08 0.00 -0.26 0.00 0.00 64.21 64.35 2jss n SER 92 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2jss n THR 93 N 0.00 0.36 -0.47 6.66 -1.04 -1.26 -4.82 114.28 113.72 2jss n THR 93 Ca 0.00 -0.26 0.00 0.00 -2.04 0.00 0.00 64.05 61.75 2jss n THR 93 Cb 0.00 -0.08 0.00 0.00 -1.82 0.00 0.00 70.33 68.43 2jss n THR 93 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jss n GLN 94 N 0.04 -0.22 -3.49 -2.82 3.00 -1.26 -4.80 117.38 107.84 2jss n GLN 94 Ca 0.06 0.05 -0.25 0.00 -0.01 0.00 0.00 57.00 56.84 2jss n GLN 94 Cb 0.25 -4.01 -0.13 0.00 0.00 0.00 0.00 30.24 26.35 2jss n GLN 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2jss s ALA 95 N -0.84 0.31 -0.16 -1.58 0.00 -1.26 -4.95 121.76 113.27 2jss s ALA 95 Ca 0.00 -0.94 0.05 0.00 0.00 0.00 0.00 51.96 51.07 2jss s ALA 95 Cb 0.00 -1.55 0.17 0.00 0.00 0.00 0.00 23.12 21.74 2jss s ALA 95 CO 0.00 -1.73 0.96 0.94 0.00 0.00 0.00 175.76 175.93 2jss n GLN 96 N 5.12 0.56 -1.75 0.00 7.27 -1.26 -5.07 117.38 122.25 2jss n GLN 96 Ca -0.03 -0.56 0.00 0.00 0.07 0.00 0.00 57.00 56.48 2jss n GLN 96 Cb 0.43 0.16 0.00 0.00 2.41 0.00 0.00 30.24 33.24 2jss n GLN 96 CO 0.00 0.00 0.00 0.43 0.07 0.00 0.00 177.06 177.56 2jss n SER 97 N -0.64 -7.88 0.20 1.69 7.64 -1.26 -1.64 113.62 111.74 2jss n SER 97 Ca -0.09 1.24 0.04 0.00 1.01 0.00 0.00 58.87 61.07 2jss n SER 97 Cb 0.66 -4.66 0.41 0.00 -1.01 0.00 0.00 64.21 59.62 2jss n SER 97 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2jss h SER 98 N 2.37 0.00 -0.03 6.43 4.64 -2.00 2.31 113.55 127.27 2jss h SER 98 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2jss h SER 98 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2jss h SER 98 CO 0.00 0.32 0.00 -0.24 -0.87 0.00 0.00 176.83 176.04 2jss n SER 99 N -4.03 0.31 0.00 4.97 2.88 -1.26 -2.05 113.62 114.44 2jss n SER 99 Ca -0.02 -2.01 0.00 0.00 -1.33 0.00 0.00 58.87 55.52 2jss n SER 99 Cb 0.38 -0.08 0.00 0.00 -0.75 0.00 0.00 64.21 63.75 2jss n SER 99 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jss n ALA 100 N -0.35 0.76 0.08 -1.46 0.00 -0.54 -4.76 120.51 114.24 2jss n ALA 100 Ca 0.01 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.24 2jss n ALA 100 Cb 0.06 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.37 2jss n ALA 100 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2jss h ARG 101 N 0.00 0.46 -0.23 0.00 2.43 0.48 -3.06 114.38 114.46 2jss h ARG 101 Ca 0.00 -0.69 0.07 0.00 -0.81 0.00 0.00 59.98 58.55 2jss h ARG 101 Cb 0.00 0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 2jss h ARG 101 CO 0.00 1.31 0.57 0.00 -1.51 0.00 0.00 179.97 180.34 2jss h ALA 102 N 0.18 1.84 -0.09 2.80 0.00 -1.56 -3.32 119.26 119.11 2jss h ALA 102 Ca -0.17 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 2jss h ALA 102 Cb 1.80 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.59 2jss h ALA 102 CO 0.20 -0.69 -0.04 0.41 0.00 0.00 0.00 179.25 179.14 2jss n GLY 103 N -1.40 0.54 0.00 0.00 0.00 -1.16 -4.62 105.19 98.55 2jss n GLY 103 Ca 0.04 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.17 2jss n GLY 103 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2jss n LEU 104 N -0.22 0.00 -2.93 0.99 4.77 -1.26 -5.09 117.00 113.26 2jss n LEU 104 Ca -0.02 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.83 2jss n LEU 104 Cb 0.07 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.19 2jss n LEU 104 CO 0.03 0.00 0.07 0.00 -1.33 0.00 0.00 177.39 176.16 2jss n GLN 105 N 0.00 0.95 -4.16 3.23 0.00 -1.26 -4.61 117.38 111.53 2jss n GLN 105 Ca 0.00 -2.53 -0.12 0.00 0.00 0.00 0.00 57.00 54.36 2jss n GLN 105 Cb 0.00 -1.33 -0.10 0.00 0.00 0.00 0.00 30.24 28.80 2jss n GLN 105 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.06 177.18 2jss s PHE 106 N -0.75 0.89 -0.64 2.61 5.36 -1.26 -4.75 117.98 119.44 2jss s PHE 106 Ca 0.31 -0.81 -0.26 0.00 -0.96 0.00 0.00 56.93 55.21 2jss s PHE 106 Cb 0.29 -0.51 -0.11 0.00 -0.34 0.00 0.00 43.02 42.35 2jss s PHE 106 CO -0.09 -0.11 2.46 -2.30 -1.46 0.00 0.00 175.22 173.72 2jss n PRO 107 N 0.28 0.76 0.10 10.12 -0.02 -1.26 -4.78 135.00 140.20 2jss n PRO 107 Ca -0.14 -0.11 -0.16 0.00 -2.02 0.00 0.00 63.50 61.07 2jss n PRO 107 Cb 0.59 -3.05 -0.12 0.00 -0.02 0.00 0.00 33.50 30.91 2jss n PRO 107 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2jss h VAL 108 N 7.74 1.46 0.12 -1.45 2.07 -1.95 -2.54 116.25 121.70 2jss h VAL 108 Ca -0.17 -2.88 -0.33 0.00 0.82 0.00 0.00 66.70 64.15 2jss h VAL 108 Cb 1.24 2.82 -0.01 0.00 -1.52 0.00 0.00 31.29 33.82 2jss h VAL 108 CO 1.20 0.85 -1.70 1.23 0.02 0.00 0.00 177.57 179.16 2jss h GLY 109 N 1.37 0.30 1.01 2.17 0.00 -1.97 -2.11 103.07 103.84 2jss h GLY 109 Ca -0.13 -0.76 -0.11 0.00 0.00 0.00 0.00 47.33 46.33 2jss h GLY 109 CO 0.20 0.66 -0.22 -0.09 0.00 0.00 0.00 176.54 177.10 2jss h ARG 110 N 0.07 0.80 -0.02 4.80 2.43 -1.96 -0.22 114.38 120.28 2jss h ARG 110 Ca -0.31 -0.36 -0.09 0.00 -0.81 0.00 0.00 59.98 58.41 2jss h ARG 110 Cb 2.04 -0.01 0.01 0.00 -0.42 0.00 0.00 29.97 31.58 2jss h ARG 110 CO 0.14 0.99 -0.33 0.82 -1.51 0.00 0.00 179.97 180.09 2jss h ILE 111 N 0.59 1.49 -0.19 1.20 2.04 -1.60 -1.94 117.51 119.10 2jss h ILE 111 Ca 0.08 -1.91 0.06 0.00 1.00 0.00 0.00 64.86 64.09 2jss h ILE 111 Cb 0.77 2.63 -0.01 0.00 -0.74 0.00 0.00 36.82 39.47 2jss h ILE 111 CO 0.06 0.53 0.44 0.50 0.00 0.00 0.00 178.15 179.69 2jss h LYS 112 N -0.35 0.00 0.02 2.37 3.11 -1.37 2.58 116.57 122.92 2jss h LYS 112 Ca -0.04 0.00 -0.23 0.00 -2.81 0.00 0.00 60.65 57.57 2jss h LYS 112 Cb 1.04 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.28 2jss h LYS 112 CO 0.06 0.00 -0.99 0.00 -2.81 0.00 0.00 179.45 175.71 2jss h ARG 113 N 0.00 0.41 -0.00 1.90 3.08 -0.41 0.08 114.38 119.43 2jss h ARG 113 Ca 0.09 -0.46 -0.08 0.00 0.07 0.00 0.00 59.98 59.59 2jss h ARG 113 Cb 0.97 0.14 -0.01 0.00 0.08 0.00 0.00 29.97 31.15 2jss h ARG 113 CO -0.00 1.13 -0.40 1.88 -1.07 0.00 0.00 179.97 181.51 2jss h TYR 114 N 0.22 0.01 -0.00 3.04 0.05 0.50 -1.74 116.97 119.04 2jss h TYR 114 Ca -0.09 -0.00 -0.26 0.00 0.05 0.00 0.00 58.73 58.43 2jss h TYR 114 Cb 1.64 -0.00 0.02 0.00 1.01 0.00 0.00 36.73 39.39 2jss h TYR 114 CO 0.06 0.40 -1.02 -0.07 -1.05 0.00 0.00 178.16 176.49 2jss h LEU 115 N 0.00 0.81 -1.46 3.88 3.38 -0.48 1.25 115.31 122.70 2jss h LEU 115 Ca -0.00 -0.65 -0.00 0.00 0.09 0.00 0.00 57.88 57.31 2jss h LEU 115 Cb 0.71 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 2jss h LEU 115 CO 0.05 1.45 0.28 0.50 0.09 0.00 0.00 178.44 180.81 2jss h LYS 116 N 0.35 0.64 0.00 1.13 3.11 -0.48 0.75 116.57 122.08 2jss h LYS 116 Ca -0.12 -0.05 -0.08 0.00 -2.81 0.00 0.00 60.65 57.59 2jss h LYS 116 Cb 1.66 -0.14 -0.02 0.00 -1.00 0.00 0.00 32.23 32.74 2jss h LYS 116 CO 0.19 0.46 -1.98 2.89 -2.81 0.00 0.00 179.45 178.21 2jss n ARG 117 N -4.43 0.66 -0.12 1.90 -4.01 -0.70 -3.12 116.66 106.84 2jss n ARG 117 Ca 0.04 -0.12 -0.21 0.00 -1.04 0.00 0.00 57.85 56.52 2jss n ARG 117 Cb 0.08 -1.56 -0.10 0.00 -3.04 0.00 0.00 32.46 27.85 2jss n ARG 117 CO 0.00 0.00 0.00 1.58 -3.04 0.00 0.00 177.63 176.17 2jss n HIS 118 N -2.42 0.00 0.26 2.89 -0.00 0.43 -4.05 115.22 112.33 2jss n HIS 118 Ca -0.10 0.00 0.08 0.00 0.46 0.00 0.00 57.72 58.16 2jss n HIS 118 Cb 0.70 -0.88 0.29 0.00 -0.12 0.00 0.00 29.99 29.98 2jss n HIS 118 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2jss h ALA 119 N -0.46 1.94 0.00 1.57 0.00 0.46 -3.41 119.26 119.36 2jss h ALA 119 Ca -0.57 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2jss h ALA 119 Cb 1.66 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.46 2jss h ALA 119 CO -0.24 -0.89 0.00 2.41 0.00 0.00 0.00 179.25 180.53 2jss n THR 120 N -2.73 0.00 0.00 0.00 -1.04 -1.25 -4.78 114.28 104.47 2jss n THR 120 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 2jss n THR 120 Cb 0.88 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.39 2jss n THR 120 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2jss n GLY 121 N 0.00 1.04 2.15 3.41 0.00 -1.18 -4.94 105.19 105.67 2jss n GLY 121 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 2jss n GLY 121 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2jss n ARG 122 N 0.00 0.94 0.00 1.61 1.85 -1.25 -4.69 116.66 115.11 2jss n ARG 122 Ca 0.00 -1.78 0.00 0.00 -1.00 0.00 0.00 57.85 55.07 2jss n ARG 122 Cb 0.00 -0.07 0.00 0.00 -1.05 0.00 0.00 32.46 31.34 2jss n ARG 122 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 2jss n THR 123 N -0.70 0.00 -0.10 8.89 -2.24 -1.26 -5.04 114.28 113.83 2jss n THR 123 Ca -0.12 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.46 2jss n THR 123 Cb 0.85 -1.61 -0.07 0.00 -2.10 0.00 0.00 70.33 67.41 2jss n THR 123 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2jss n ARG 124 N 0.00 0.46 -2.62 -0.78 5.12 -1.26 -5.07 116.66 112.52 2jss n ARG 124 Ca 0.00 0.20 -0.06 0.00 -1.93 0.00 0.00 57.85 56.06 2jss n ARG 124 Cb 0.00 -1.29 0.03 0.00 -1.16 0.00 0.00 32.46 30.04 2jss n ARG 124 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 2jss n VAL 125 N -4.07 -6.75 -1.95 1.55 0.31 -1.26 -4.98 118.33 101.19 2jss n VAL 125 Ca -0.37 -0.60 -0.36 0.00 -0.01 0.00 0.00 64.34 63.00 2jss n VAL 125 Cb 0.72 -5.54 0.04 0.00 -0.91 0.00 0.00 33.84 28.15 2jss n VAL 125 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2jss s GLY 126 N -3.02 2.65 0.30 2.92 0.00 -1.26 -4.78 107.32 104.13 2jss s GLY 126 Ca 0.18 0.95 0.06 0.00 0.00 0.00 0.00 44.72 45.92 2jss s GLY 126 CO 0.50 1.34 1.01 -1.14 0.00 0.00 0.00 173.10 174.81 2jss n SER 127 N -1.75 0.17 -0.20 1.64 3.41 -1.26 -0.54 113.62 115.08 2jss n SER 127 Ca 0.13 0.39 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 2jss n SER 127 Cb 0.50 -0.26 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 2jss n SER 127 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2jss n LYS 128 N -1.86 0.57 0.11 4.33 5.02 -1.26 -3.95 118.16 121.13 2jss n LYS 128 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2jss n LYS 128 Cb 0.51 -1.12 0.00 0.00 -0.02 0.00 0.00 35.03 34.41 2jss n LYS 128 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jss n ALA 129 N -0.21 3.00 -0.35 7.82 0.00 0.29 0.29 120.51 131.35 2jss n ALA 129 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.53 2jss n ALA 129 Cb 0.06 0.03 0.19 0.00 0.00 0.00 0.00 19.45 19.73 2jss n ALA 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jss n ALA 130 N -3.28 0.33 -0.24 0.00 0.00 -1.26 0.10 120.51 116.16 2jss n ALA 130 Ca 0.00 1.08 -0.07 0.00 0.00 0.00 0.00 53.44 54.45 2jss n ALA 130 Cb 0.01 -0.70 0.04 0.00 0.00 0.00 0.00 19.45 18.81 2jss n ALA 130 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 2jss h ILE 131 N 0.00 1.24 0.00 0.00 2.10 -1.91 -0.67 117.51 118.28 2jss h ILE 131 Ca 0.52 -0.77 0.00 0.00 1.08 0.00 0.00 64.86 65.69 2jss h ILE 131 Cb 0.91 0.49 0.00 0.00 -1.09 0.00 0.00 36.82 37.12 2jss h ILE 131 CO -0.99 0.31 0.07 0.22 -1.08 0.00 0.00 178.15 176.68 2jss h TYR 132 N 0.96 0.00 0.03 2.19 3.20 0.36 0.62 116.97 124.33 2jss h TYR 132 Ca 0.22 0.00 -0.29 0.00 3.14 0.00 0.00 58.73 61.80 2jss h TYR 132 Cb 0.22 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.45 2jss h TYR 132 CO 0.02 0.00 -1.63 -0.07 -1.64 0.00 0.00 178.16 174.83 2jss h LEU 133 N 0.00 0.09 0.00 2.82 4.07 -0.39 -2.41 115.31 119.49 2jss h LEU 133 Ca 0.00 -0.17 -0.03 0.00 0.08 0.00 0.00 57.88 57.75 2jss h LEU 133 Cb 0.14 -0.03 -0.01 0.00 1.08 0.00 0.00 40.66 41.85 2jss h LEU 133 CO 0.00 1.15 -0.69 0.71 -1.08 0.00 0.00 178.44 178.53 2jss h THR 134 N 0.02 0.16 0.09 0.22 1.35 -0.38 -2.36 112.91 112.01 2jss h THR 134 Ca -0.26 -1.26 -0.15 0.00 -0.55 0.00 0.00 66.41 64.19 2jss h THR 134 Cb 1.99 1.82 0.01 0.00 -1.73 0.00 0.00 68.15 70.24 2jss h THR 134 CO 0.10 0.09 -0.67 0.00 -0.25 0.00 0.00 175.52 174.78 2jss h ALA 135 N 1.87 -0.01 -0.05 6.62 0.00 0.03 -2.29 119.26 125.44 2jss h ALA 135 Ca -0.02 -0.71 -0.15 0.00 0.00 0.00 0.00 54.91 54.03 2jss h ALA 135 Cb 1.12 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 2jss h ALA 135 CO 0.01 0.34 -0.64 -0.39 0.00 0.00 0.00 179.25 178.57 2jss h VAL 136 N -0.58 1.41 0.13 0.00 -1.51 -1.53 -2.11 116.25 112.07 2jss h VAL 136 Ca -0.13 -2.09 -0.01 0.00 -1.23 0.00 0.00 66.70 63.24 2jss h VAL 136 Cb 1.45 2.09 0.00 0.00 -2.13 0.00 0.00 31.29 32.70 2jss h VAL 136 CO 0.08 0.61 -0.06 -0.07 -1.23 0.00 0.00 177.57 176.90 2jss h LEU 137 N 0.13 -0.15 -2.48 4.19 3.38 -1.54 -2.14 115.31 116.70 2jss h LEU 137 Ca -0.01 -0.41 0.02 0.00 0.09 0.00 0.00 57.88 57.57 2jss h LEU 137 Cb 1.15 0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.94 2jss h LEU 137 CO 0.10 0.43 0.08 -0.08 0.09 0.00 0.00 178.44 179.06 2jss h GLU 138 N -0.83 0.00 0.22 1.13 4.22 -1.48 2.25 114.58 120.08 2jss h GLU 138 Ca -0.02 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.41 2jss h GLU 138 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2jss h GLU 138 CO 0.03 0.00 -0.10 -0.92 -2.18 0.00 0.00 179.01 175.84 2jss h TYR 139 N 0.00 -0.27 0.23 0.92 3.20 -1.30 -2.23 116.97 117.52 2jss h TYR 139 Ca 0.03 -0.01 -0.32 0.00 3.14 0.00 0.00 58.73 61.57 2jss h TYR 139 Cb 0.20 0.09 0.03 0.00 1.54 0.00 0.00 36.73 38.59 2jss h TYR 139 CO 0.00 0.06 -1.43 -0.07 -1.64 0.00 0.00 178.16 175.08 2jss h LEU 140 N -0.97 0.76 -0.12 2.82 3.38 -0.91 -2.28 115.31 117.99 2jss h LEU 140 Ca -0.03 -0.93 0.03 0.00 0.09 0.00 0.00 57.88 57.05 2jss h LEU 140 Cb 0.45 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 2jss h LEU 140 CO 0.05 1.68 -0.09 0.74 0.09 0.00 0.00 178.44 180.91 2jss h THR 141 N 0.06 0.74 -0.53 0.22 2.02 0.36 0.27 112.91 116.04 2jss h THR 141 Ca -0.26 0.00 0.02 0.00 0.77 0.00 0.00 66.41 66.95 2jss h THR 141 Cb 2.08 0.74 -0.03 0.00 -1.74 0.00 0.00 68.15 69.20 2jss h THR 141 CO 0.24 0.00 0.32 0.00 0.37 0.00 0.00 175.52 176.45 2jss h ALA 142 N 1.00 0.68 -0.82 6.16 0.00 -1.47 -1.60 119.26 123.22 2jss h ALA 142 Ca 0.08 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 55.10 2jss h ALA 142 Cb 0.21 -0.16 -0.09 0.00 0.00 0.00 0.00 17.79 17.75 2jss h ALA 142 CO -0.18 0.04 0.42 1.49 0.00 0.00 0.00 179.25 181.02 2jss h GLU 143 N 0.64 0.63 -0.90 0.00 4.81 -0.59 0.26 114.58 119.43 2jss h GLU 143 Ca 0.21 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.43 2jss h GLU 143 Cb 0.01 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.20 2jss h GLU 143 CO -0.09 0.42 0.59 0.28 -0.73 0.00 0.00 179.01 179.48 2jss h VAL 144 N 0.65 1.17 0.04 0.32 2.07 0.47 -2.13 116.25 118.84 2jss h VAL 144 Ca 0.43 -0.40 -0.24 0.00 0.82 0.00 0.00 66.70 67.31 2jss h VAL 144 Cb 0.54 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.23 2jss h VAL 144 CO -0.32 0.21 -1.04 -0.07 0.02 0.00 0.00 177.57 176.36 2jss h LEU 145 N 1.15 0.53 0.44 2.57 3.38 -0.59 -2.25 115.31 120.54 2jss h LEU 145 Ca 0.35 -0.46 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 2jss h LEU 145 Cb -0.02 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 2jss h LEU 145 CO -0.10 1.28 -0.43 -0.33 0.09 0.00 0.00 178.44 178.95 2jss h GLU 146 N 0.19 -0.85 0.41 1.13 4.39 -0.12 2.41 114.58 122.13 2jss h GLU 146 Ca -0.10 0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.64 2jss h GLU 146 Cb 1.70 0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 30.53 2jss h GLU 146 CO 0.18 -0.57 -0.37 -0.07 -1.16 0.00 0.00 179.01 177.02 2jss h LEU 147 N -0.89 -1.00 0.52 1.33 3.38 -1.49 -0.81 115.31 116.35 2jss h LEU 147 Ca -0.04 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 2jss h LEU 147 Cb 0.78 0.32 0.01 0.00 0.09 0.00 0.00 40.66 41.86 2jss h LEU 147 CO -0.06 -0.50 -0.25 0.00 0.09 0.00 0.00 178.44 177.72 2jss h ALA 148 N -1.18 -0.96 -0.84 1.53 0.00 -1.31 -1.17 119.26 115.33 2jss h ALA 148 Ca -0.05 -0.15 0.12 0.00 0.00 0.00 0.00 54.91 54.82 2jss h ALA 148 Cb 0.65 0.27 -0.13 0.00 0.00 0.00 0.00 17.79 18.58 2jss h ALA 148 CO -0.02 -0.91 -0.44 0.78 0.00 0.00 0.00 179.25 178.66 2jss h GLY 149 N -0.84 -0.27 2.00 0.00 0.00 0.40 1.35 103.07 105.71 2jss h GLY 149 Ca -0.07 0.58 0.00 0.00 0.00 0.00 0.00 47.33 47.84 2jss h GLY 149 CO 0.12 -0.14 0.00 -0.57 0.00 0.00 0.00 176.54 175.94 2jss h ASN 150 N -0.08 0.00 0.11 0.19 -1.24 -1.06 -0.39 115.58 113.12 2jss h ASN 150 Ca 0.25 0.00 -0.37 0.00 0.71 0.00 0.00 56.30 56.90 2jss h ASN 150 Cb 0.55 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 39.56 2jss h ASN 150 CO -0.87 0.00 -2.15 0.00 -1.29 0.00 0.00 177.43 173.13 2jss n ALA 151 N -1.89 1.16 0.09 1.57 0.00 0.30 -3.02 120.51 118.71 2jss n ALA 151 Ca 0.01 -0.82 -0.03 0.00 0.00 0.00 0.00 53.44 52.60 2jss n ALA 151 Cb 0.22 -0.48 -0.06 0.00 0.00 0.00 0.00 19.45 19.13 2jss n ALA 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jss h ALA 152 N 0.20 0.52 0.00 0.00 0.00 0.14 -2.34 119.26 117.78 2jss h ALA 152 Ca -0.47 -0.75 -0.20 0.00 0.00 0.00 0.00 54.91 53.49 2jss h ALA 152 Cb 2.00 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 19.69 2jss h ALA 152 CO 0.03 1.00 -1.30 1.57 0.00 0.00 0.00 179.25 180.55 2jss h LYS 153 N 0.00 0.00 0.00 0.00 2.10 -0.99 2.22 116.57 119.90 2jss h LYS 153 Ca -0.03 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.46 2jss h LYS 153 Cb 1.62 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.93 2jss h LYS 153 CO 0.10 0.49 -0.91 0.22 -2.00 0.00 0.00 179.45 177.34 2jss h ASP 154 N 0.00 0.00 -0.00 7.07 1.82 -1.62 -3.37 116.42 120.32 2jss h ASP 154 Ca -0.15 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.49 2jss h ASP 154 Cb 1.71 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.72 2jss h ASP 154 CO 0.07 0.67 -0.18 0.18 -1.61 0.00 0.00 179.24 178.37 2jss n LEU 155 N -3.16 0.25 0.00 2.28 4.77 -0.88 -4.98 117.00 115.28 2jss n LEU 155 Ca -0.02 -0.53 0.00 0.00 -0.03 0.00 0.00 56.01 55.43 2jss n LEU 155 Cb 0.83 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.92 2jss n LEU 155 CO 0.43 0.06 0.00 0.29 -1.33 0.00 0.00 177.39 176.84 2jss n LYS 156 N -1.02 0.00 -3.92 3.23 4.76 0.31 -5.00 118.16 116.52 2jss n LYS 156 Ca 0.01 0.00 0.03 0.00 -2.87 0.00 0.00 58.31 55.47 2jss n LYS 156 Cb 0.06 0.00 0.01 0.00 -1.84 0.00 0.00 35.03 33.26 2jss n LYS 156 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 2jss s VAL 157 N -0.52 0.00 -0.86 -0.18 -7.23 0.67 -4.89 120.40 107.40 2jss s VAL 157 Ca 0.00 -0.17 0.00 0.00 -1.81 0.00 0.00 61.98 60.00 2jss s VAL 157 Cb 0.00 -2.79 0.00 0.00 0.56 0.00 0.00 36.38 34.15 2jss s VAL 157 CO 0.00 0.00 0.63 0.29 -0.31 0.00 0.00 175.10 175.71 2jss n LYS 158 N -0.83 0.00 -2.30 4.82 5.02 -1.26 -3.09 118.16 120.52 2jss n LYS 158 Ca 0.02 0.20 -0.25 0.00 -2.02 0.00 0.00 58.31 56.25 2jss n LYS 158 Cb 0.59 -1.62 0.07 0.00 -0.02 0.00 0.00 35.03 34.05 2jss n LYS 158 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2jss s ARG 159 N -2.26 2.21 0.08 1.97 1.81 -1.26 0.25 118.95 121.75 2jss s ARG 159 Ca 0.00 -0.40 0.00 0.00 -1.72 0.00 0.00 55.73 53.61 2jss s ARG 159 Cb 0.00 -2.23 0.00 0.00 -0.45 0.00 0.00 34.95 32.27 2jss s ARG 159 CO 0.00 -1.17 0.00 -0.89 -0.68 0.00 0.00 175.30 172.56 2jss n ILE 160 N -2.82 0.19 -1.55 1.52 5.41 -1.26 -4.26 119.36 116.59 2jss n ILE 160 Ca 0.08 0.06 0.00 0.00 1.00 0.00 0.00 62.75 63.90 2jss n ILE 160 Cb 0.60 -0.95 0.00 0.00 -0.71 0.00 0.00 39.64 38.58 2jss n ILE 160 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2jss n THR 161 N -3.00 -4.90 0.01 1.39 -2.24 -1.26 -3.19 114.28 101.10 2jss n THR 161 Ca 0.00 2.23 0.00 0.00 -2.27 0.00 0.00 64.05 64.01 2jss n THR 161 Cb 0.14 -3.12 0.01 0.00 -2.10 0.00 0.00 70.33 65.26 2jss n THR 161 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 2jss n PRO 162 N -1.14 0.00 0.19 -0.78 -0.02 -1.26 -2.13 135.00 129.87 2jss n PRO 162 Ca 0.00 0.13 -0.08 0.00 -2.02 0.00 0.00 63.50 61.53 2jss n PRO 162 Cb 0.07 -1.91 -0.04 0.00 -0.02 0.00 0.00 33.50 31.60 2jss n PRO 162 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 2jss h ARG 163 N 0.00 -0.50 0.00 -0.52 9.65 -1.89 0.20 114.38 121.33 2jss h ARG 163 Ca 0.00 0.03 -0.00 0.00 -1.10 0.00 0.00 59.98 58.91 2jss h ARG 163 Cb 0.80 0.11 -0.00 0.00 -1.39 0.00 0.00 29.97 29.49 2jss h ARG 163 CO 0.00 -0.33 -0.00 0.45 2.80 0.00 0.00 179.97 182.88 2jss h HIS 164 N -0.79 0.00 0.00 2.20 3.86 -1.39 0.87 115.15 119.91 2jss h HIS 164 Ca -0.05 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.11 2jss h HIS 164 Cb 0.40 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.86 2jss h HIS 164 CO 0.05 0.00 -0.26 -0.07 0.86 0.00 0.00 177.93 178.51 2jss h LEU 165 N 0.00 0.00 -0.34 2.43 3.38 -1.56 -1.99 115.31 117.23 2jss h LEU 165 Ca -0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 2jss h LEU 165 Cb 0.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2jss h LEU 165 CO 0.00 0.21 0.03 -0.61 0.09 0.00 0.00 178.44 178.17 2jss h GLN 166 N 0.00 0.58 -0.07 1.13 5.75 0.40 0.59 115.11 123.49 2jss h GLN 166 Ca -0.01 -0.17 -0.16 0.00 -0.15 0.00 0.00 58.65 58.17 2jss h GLN 166 Cb 1.17 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 29.65 2jss h GLN 166 CO 0.03 0.68 -0.66 -0.07 -2.65 0.00 0.00 178.83 176.15 2jss h LEU 167 N 0.40 0.35 -0.15 -2.39 4.07 -1.43 -0.05 115.31 116.10 2jss h LEU 167 Ca 0.10 -0.21 0.00 0.00 0.08 0.00 0.00 57.88 57.85 2jss h LEU 167 Cb 0.39 -0.10 0.00 0.00 1.08 0.00 0.00 40.66 42.03 2jss h LEU 167 CO 0.01 0.91 0.00 0.00 -1.08 0.00 0.00 178.44 178.28 2jss h ALA 168 N 1.09 1.00 0.00 1.53 0.00 -1.07 -1.76 119.26 120.05 2jss h ALA 168 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2jss h ALA 168 Cb 1.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2jss h ALA 168 CO 0.11 0.00 -0.33 -0.89 0.00 0.00 0.00 179.25 178.14 2jss n ILE 169 N -2.39 0.63 0.54 0.00 5.41 0.20 -4.40 119.36 119.36 2jss n ILE 169 Ca 0.05 0.30 0.13 0.00 1.00 0.00 0.00 62.75 64.23 2jss n ILE 169 Cb 0.41 -1.72 0.44 0.00 -0.71 0.00 0.00 39.64 38.05 2jss n ILE 169 CO 0.00 0.00 0.00 -2.11 0.00 0.00 0.00 176.55 174.44 2jss n ARG 170 N -3.26 0.25 0.24 0.38 1.85 -0.05 -3.37 116.66 112.70 2jss n ARG 170 Ca -0.05 0.29 -0.14 0.00 -1.00 0.00 0.00 57.85 56.95 2jss n ARG 170 Cb 0.17 -1.84 -0.08 0.00 -1.05 0.00 0.00 32.46 29.67 2jss n ARG 170 CO 0.00 0.00 0.00 0.78 -0.01 0.00 0.00 177.63 178.40 2jss h GLY 171 N 3.74 -0.65 -5.63 2.89 0.00 -1.18 -3.40 103.07 98.84 2jss h GLY 171 Ca 0.00 0.24 -0.56 0.00 0.00 0.00 0.00 47.33 47.01 2jss h GLY 171 CO 0.00 -0.24 1.12 0.99 0.00 0.00 0.00 176.54 178.41 2jss s ASP 172 N -4.82 6.52 0.06 0.19 1.01 -1.22 -4.89 116.67 113.51 2jss s ASP 172 Ca -0.14 1.98 -0.23 0.00 0.71 0.00 0.00 52.55 54.87 2jss s ASP 172 Cb 0.02 -2.53 -0.14 0.00 1.01 0.00 0.00 42.92 41.27 2jss s ASP 172 CO 0.51 -1.09 1.59 -0.78 0.21 0.00 0.00 175.17 175.61 2jss h ASP 173 N 10.18 0.09 0.61 0.27 3.58 -1.85 -1.05 116.42 128.25 2jss h ASP 173 Ca -0.37 -0.17 -0.03 0.00 0.42 0.00 0.00 57.03 56.88 2jss h ASP 173 Cb 1.17 -0.02 -0.00 0.00 1.72 0.00 0.00 39.33 42.20 2jss h ASP 173 CO 0.97 0.24 -0.37 -0.33 -2.88 0.00 0.00 179.24 176.87 2jss h GLU 174 N -0.07 -0.88 -0.50 0.28 3.07 -1.94 0.35 114.58 114.88 2jss h GLU 174 Ca 0.02 0.06 0.09 0.00 -0.50 0.00 0.00 59.36 59.03 2jss h GLU 174 Cb 0.18 0.20 -0.10 0.00 -0.84 0.00 0.00 28.75 28.19 2jss h GLU 174 CO -0.00 -0.59 -0.31 -0.07 -1.40 0.00 0.00 179.01 176.64 2jss h LEU 175 N -0.92 -1.06 -1.67 1.33 3.38 -1.88 1.27 115.31 115.77 2jss h LEU 175 Ca -0.08 0.21 0.16 0.00 0.09 0.00 0.00 57.88 58.26 2jss h LEU 175 Cb 0.73 0.52 -0.05 0.00 0.09 0.00 0.00 40.66 41.96 2jss h LEU 175 CO 0.09 -0.30 0.50 -0.78 0.09 0.00 0.00 178.44 178.04 2jss h ASP 176 N -0.19 0.30 0.37 -0.43 3.58 -1.02 3.90 116.42 122.95 2jss h ASP 176 Ca 0.21 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.68 2jss h ASP 176 Cb 0.53 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.54 2jss h ASP 176 CO -0.61 0.15 0.00 -0.24 -2.88 0.00 0.00 179.24 175.66 2jss n SER 177 N -4.45 0.06 0.00 2.28 2.88 0.43 -3.15 113.62 111.67 2jss n SER 177 Ca 0.14 0.52 0.00 0.00 -1.33 0.00 0.00 58.87 58.20 2jss n SER 177 Cb 0.59 -0.53 0.00 0.00 -0.75 0.00 0.00 64.21 63.52 2jss n SER 177 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jss n LEU 178 N -1.57 0.00 -0.03 2.46 -0.00 0.87 -4.91 117.00 113.83 2jss n LEU 178 Ca 0.02 0.00 -0.01 0.00 -0.00 0.00 0.00 56.01 56.03 2jss n LEU 178 Cb 0.13 0.00 -0.00 0.00 -0.00 0.00 0.00 43.42 43.54 2jss n LEU 178 CO 0.10 0.00 -0.05 0.40 -0.00 0.00 0.00 177.39 177.84 2jss h ILE 179 N 0.00 0.00 -3.83 1.47 2.04 0.61 -3.45 117.51 114.35 2jss h ILE 179 Ca 0.00 -0.53 -0.14 0.00 1.00 0.00 0.00 64.86 65.19 2jss h ILE 179 Cb 0.02 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.01 2jss h ILE 179 CO 0.00 0.00 -0.20 -2.11 0.00 0.00 0.00 178.15 175.84 2jss n ARG 180 N -3.50 -0.98 0.00 2.37 -4.01 -1.19 -4.76 116.66 104.60 2jss n ARG 180 Ca -0.01 0.03 0.00 0.00 -1.04 0.00 0.00 57.85 56.83 2jss n ARG 180 Cb 0.04 -1.15 0.00 0.00 -3.04 0.00 0.00 32.46 28.31 2jss n ARG 180 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 2jss n ALA 181 N -1.30 0.00 -2.70 2.89 0.00 -1.26 -4.86 120.51 113.29 2jss n ALA 181 Ca 0.03 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.38 2jss n ALA 181 Cb 0.11 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.64 2jss n ALA 181 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2jss n THR 182 N -0.33 0.44 -0.47 0.00 -2.24 -1.26 -4.98 114.28 105.44 2jss n THR 182 Ca 0.00 -2.29 -0.09 0.00 -2.27 0.00 0.00 64.05 59.40 2jss n THR 182 Cb 0.00 0.83 -0.06 0.00 -2.10 0.00 0.00 70.33 69.00 2jss n THR 182 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 2jss n ILE 183 N -0.30 1.47 -2.92 2.28 -5.35 -1.26 -4.59 119.36 108.69 2jss n ILE 183 Ca 0.04 -0.79 -0.43 0.00 -0.27 0.00 0.00 62.75 61.30 2jss n ILE 183 Cb 0.83 -1.80 0.01 0.00 -1.74 0.00 0.00 39.64 36.94 2jss n ILE 183 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2jss n ALA 184 N 3.27 5.37 0.02 -1.28 0.00 -1.26 -3.78 120.51 122.85 2jss n ALA 184 Ca 0.23 -4.76 0.00 0.00 0.00 0.00 0.00 53.44 48.91 2jss n ALA 184 Cb 0.31 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.43 2jss n ALA 184 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2jss n SER 185 N 1.07 -0.38 0.02 0.00 3.41 -1.26 -4.91 113.62 111.58 2jss n SER 185 Ca 0.30 0.23 0.13 0.00 -0.26 0.00 0.00 58.87 59.27 2jss n SER 185 Cb 0.32 0.57 0.53 0.00 -0.26 0.00 0.00 64.21 65.37 2jss n SER 185 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jss n GLY 186 N -1.35 -1.44 2.39 5.00 0.00 -1.26 -4.30 105.19 104.23 2jss n GLY 186 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2jss n GLY 186 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jss n GLY 187 N 1.16 0.78 0.57 -0.02 0.00 -1.25 -3.67 105.19 102.76 2jss n GLY 187 Ca 0.06 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.19 2jss n GLY 187 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2jss n VAL 188 N 2.61 0.00 0.08 1.61 3.14 -1.26 -4.40 118.33 120.11 2jss n VAL 188 Ca 0.00 -0.32 -0.14 0.00 -2.96 0.00 0.00 64.34 60.92 2jss n VAL 188 Cb 0.00 1.29 -0.14 0.00 -1.06 0.00 0.00 33.84 33.94 2jss n VAL 188 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 2jss h LEU 189 N 2.78 0.32 -0.14 6.55 3.38 -1.96 -3.31 115.31 122.91 2jss h LEU 189 Ca 0.00 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.59 2jss h LEU 189 Cb 0.77 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.42 2jss h LEU 189 CO 0.00 1.31 -0.14 -0.81 0.09 0.00 0.00 178.44 178.89 2jss n PRO 190 N -3.45 0.44 0.16 1.13 -0.04 -1.26 -3.66 135.00 128.32 2jss n PRO 190 Ca -0.10 -0.14 0.01 0.00 -0.04 0.00 0.00 63.50 63.23 2jss n PRO 190 Cb 1.02 -1.50 0.31 0.00 -0.04 0.00 0.00 33.50 33.30 2jss n PRO 190 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2jss h HIS 191 N 0.34 0.06 -0.03 0.54 2.76 -1.78 -3.54 115.15 113.50 2jss h HIS 191 Ca 0.00 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.16 2jss h HIS 191 Cb 0.40 -0.01 0.00 0.00 1.55 0.00 0.00 27.41 29.35 2jss h HIS 191 CO 0.00 0.44 0.00 -0.89 -1.30 0.00 0.00 177.93 176.18