#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jss h LYS 2 N 0.00 0.00 0.00 -0.14 1.63 -2.02 -3.50 116.57 112.53 2jss h LYS 2 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 2jss h LYS 2 Cb 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.63 2jss h LYS 2 CO 0.00 0.00 0.00 -1.91 -3.45 0.00 0.00 179.45 174.09 2jss n GLU 3 N -3.45 0.00 0.00 1.90 2.13 -1.26 -5.08 120.64 114.88 2jss n GLU 3 Ca -0.01 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.81 2jss n GLU 3 Cb 0.02 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.73 2jss n GLU 3 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 2jss n THR 4 N -0.18 0.00 1.84 6.31 -2.24 -1.26 -0.57 114.28 118.18 2jss n THR 4 Ca 0.00 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.79 2jss n THR 4 Cb 0.00 0.00 0.08 0.00 -2.10 0.00 0.00 70.33 68.31 2jss n THR 4 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2jss n TYR 5 N 6.58 0.00 0.00 4.78 4.02 -1.26 -4.53 117.16 126.75 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 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 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 -0.54 0.00 -0.39 7.72 3.41 0.27 0.54 113.62 124.63 2jss n SER 6 Ca 0.02 0.34 -0.10 0.00 -0.26 0.00 0.00 58.87 58.86 2jss n SER 6 Cb 0.01 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 63.87 2jss n SER 6 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2jss n SER 7 N -0.81 -0.97 0.24 4.04 7.64 -1.26 0.14 113.62 122.62 2jss n SER 7 Ca 0.00 1.64 -0.18 0.00 1.01 0.00 0.00 58.87 61.34 2jss n SER 7 Cb 0.00 -0.21 -0.10 0.00 -1.01 0.00 0.00 64.21 62.89 2jss n SER 7 CO 0.00 0.00 0.00 1.88 -3.01 0.00 0.00 175.04 173.91 2jss h TYR 8 N 0.00 -1.44 -0.66 1.43 0.05 -1.68 -1.07 116.97 113.61 2jss h TYR 8 Ca 0.15 0.02 0.14 0.00 0.05 0.00 0.00 58.73 59.09 2jss h TYR 8 Cb 0.38 0.58 -0.11 0.00 1.01 0.00 0.00 36.73 38.59 2jss h TYR 8 CO -0.95 -0.65 0.06 0.82 -1.05 0.00 0.00 178.16 176.39 2jss h ILE 9 N -0.93 0.49 -1.46 -2.88 1.08 0.14 0.73 117.51 114.68 2jss h ILE 9 Ca -0.04 -0.06 0.43 0.00 -0.39 0.00 0.00 64.86 64.80 2jss h ILE 9 Cb 0.84 0.31 -0.08 0.00 -3.07 0.00 0.00 36.82 34.82 2jss h ILE 9 CO -0.14 0.03 1.02 1.88 -0.69 0.00 0.00 178.15 180.26 2jss h TYR 10 N 0.17 0.19 0.00 1.37 0.05 0.24 3.10 116.97 122.10 2jss h TYR 10 Ca 0.36 0.01 -0.17 0.00 0.05 0.00 0.00 58.73 58.97 2jss h TYR 10 Cb 0.59 -0.05 -0.03 0.00 1.01 0.00 0.00 36.73 38.25 2jss h TYR 10 CO -0.33 -0.05 -0.94 1.57 -1.05 0.00 0.00 178.16 177.36 2jss h LYS 11 N 0.06 0.00 -0.00 4.88 2.10 0.12 -1.80 116.57 121.93 2jss h LYS 11 Ca 0.75 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.40 2jss h LYS 11 Cb 2.76 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 34.09 2jss h LYS 11 CO -0.14 0.64 -0.35 0.28 -2.00 0.00 0.00 179.45 177.88 2jss n VAL 12 N -3.19 0.00 -0.00 0.07 0.31 0.79 -2.34 118.33 113.97 2jss n VAL 12 Ca -0.02 -0.03 -0.21 0.00 -0.01 0.00 0.00 64.34 64.07 2jss n VAL 12 Cb 0.85 0.14 -0.14 0.00 -0.91 0.00 0.00 33.84 33.79 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 0.29 0.32 -0.18 7.52 5.85 0.46 -2.37 115.31 127.20 2jss h LEU 13 Ca 0.00 -0.85 -0.13 0.00 0.84 0.00 0.00 57.88 57.74 2jss h LEU 13 Cb 0.49 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.41 2jss h LEU 13 CO 0.00 1.52 -0.41 0.11 -0.34 0.00 0.00 178.44 179.31 2jss h LYS 14 N -0.44 0.60 0.11 1.25 6.56 -1.36 -0.76 116.57 122.52 2jss h LYS 14 Ca -0.26 -0.40 -0.00 0.00 -1.06 0.00 0.00 60.65 58.93 2jss h LYS 14 Cb 1.63 0.06 -0.00 0.00 -0.57 0.00 0.00 32.23 33.34 2jss h LYS 14 CO 0.04 1.02 -0.07 1.96 -2.06 0.00 0.00 179.45 180.34 2jss h GLN 15 N 0.26 -0.18 -0.96 3.15 7.50 -1.61 -1.71 115.11 121.56 2jss h GLN 15 Ca -0.00 0.01 0.03 0.00 0.50 0.00 0.00 58.65 59.19 2jss h GLN 15 Cb 1.02 0.04 -0.05 0.00 0.05 0.00 0.00 27.48 28.54 2jss h GLN 15 CO 0.09 -0.12 0.64 1.15 -1.50 0.00 0.00 178.83 179.09 2jss h THR 16 N -0.18 1.19 -1.73 -0.54 2.02 -1.44 -3.43 112.91 108.79 2jss h THR 16 Ca -0.01 -0.43 0.07 0.00 0.77 0.00 0.00 66.41 66.82 2jss h THR 16 Cb 0.16 -0.16 -0.24 0.00 -1.74 0.00 0.00 68.15 66.17 2jss h THR 16 CO 0.00 0.23 0.20 -1.00 0.37 0.00 0.00 175.52 175.32 2jss s HIS 17 N -6.04 -0.82 -0.85 3.16 3.76 -0.29 -5.00 115.29 109.20 2jss s HIS 17 Ca -0.12 1.62 0.26 0.00 -0.15 0.00 0.00 55.06 56.66 2jss s HIS 17 Cb 0.19 0.49 0.99 0.00 1.11 0.00 0.00 32.58 35.35 2jss s HIS 17 CO 0.81 -0.41 1.80 -0.35 -0.85 0.00 0.00 174.74 175.74 2jss n PRO 18 N 4.08 0.11 0.00 8.40 -0.04 -0.83 -3.21 135.00 143.51 2jss n PRO 18 Ca -0.19 0.15 0.10 0.00 -0.04 0.00 0.00 63.50 63.52 2jss n PRO 18 Cb 0.58 -1.64 -0.01 0.00 -0.04 0.00 0.00 33.50 32.38 2jss n PRO 18 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2jss n ASP 19 N -1.84 1.79 -4.56 3.54 8.00 -1.26 -4.85 116.55 117.37 2jss n ASP 19 Ca 0.06 -1.40 -0.34 0.00 0.71 0.00 0.00 54.79 53.82 2jss n ASP 19 Cb 0.34 0.51 -0.04 0.00 -0.02 0.00 0.00 41.12 41.91 2jss n ASP 19 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2jss s THR 20 N -2.27 3.52 -2.00 -3.53 2.01 -1.20 -4.56 115.64 107.62 2jss s THR 20 Ca 0.16 -0.18 0.31 0.00 0.31 0.00 0.00 61.69 62.29 2jss s THR 20 Cb 0.16 -4.25 0.74 0.00 0.01 0.00 0.00 72.50 69.16 2jss s THR 20 CO 0.52 -1.19 2.07 0.61 -0.69 0.00 0.00 174.62 175.94 2jss n GLY 21 N 6.35 -0.82 0.78 4.40 0.00 -1.21 -4.82 105.19 109.86 2jss n GLY 21 Ca 0.29 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.79 0.00 -1.49 -0.61 3.06 -1.26 -4.80 119.36 113.47 2jss n ILE 22 Ca 0.21 0.00 -0.37 0.00 -2.50 0.00 0.00 62.75 60.09 2jss n ILE 22 Cb 0.19 -0.21 0.07 0.00 0.54 0.00 0.00 39.64 40.23 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 0.89 0.40 -0.14 9.51 2.88 -0.43 -4.79 113.62 121.93 2jss n SER 23 Ca 0.00 0.73 -0.08 0.00 -1.33 0.00 0.00 58.87 58.19 2jss n SER 23 Cb 0.00 -1.37 0.01 0.00 -0.75 0.00 0.00 64.21 62.10 2jss n SER 23 CO 0.00 0.00 0.00 0.06 -1.23 0.00 0.00 175.04 173.87 2jss h GLN 24 N 0.11 0.57 -0.21 -1.46 -0.00 -1.88 -1.09 115.11 111.15 2jss h GLN 24 Ca -0.48 -0.04 -0.13 0.00 -0.00 0.00 0.00 58.65 58.01 2jss h GLN 24 Cb 1.35 -0.13 -0.01 0.00 -0.00 0.00 0.00 27.48 28.70 2jss h GLN 24 CO 0.48 0.39 -0.42 0.87 -0.00 0.00 0.00 178.83 180.15 2jss h LYS 25 N 0.59 0.50 -0.16 0.06 1.79 -1.95 -0.37 116.57 117.02 2jss h LYS 25 Ca 0.16 -0.26 0.05 0.00 -2.18 0.00 0.00 60.65 58.42 2jss h LYS 25 Cb -0.06 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.59 2jss h LYS 25 CO -0.03 0.83 0.16 0.77 -1.08 0.00 0.00 179.45 180.10 2jss h SER 26 N 0.41 0.00 1.53 0.86 0.02 -1.73 2.50 113.55 117.14 2jss h SER 26 Ca 0.03 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.89 2jss h SER 26 Cb 0.91 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.44 2jss h SER 26 CO 0.08 0.00 -0.48 -0.03 -1.14 0.00 0.00 176.83 175.26 2jss h MET 27 N 0.00 0.00 0.07 3.45 1.85 0.14 -2.14 114.93 118.31 2jss h MET 27 Ca 0.08 0.00 -0.27 0.00 -0.61 0.00 0.00 59.70 58.90 2jss h MET 27 Cb 0.39 0.00 -0.02 0.00 0.43 0.00 0.00 31.60 32.41 2jss h MET 27 CO -0.00 0.41 -1.34 1.03 -0.40 0.00 0.00 176.91 176.60 2jss h SER 28 N 0.00 0.23 -0.04 1.39 0.87 0.50 -0.23 113.55 116.27 2jss h SER 28 Ca -0.01 -0.30 -0.03 0.00 -1.23 0.00 0.00 61.79 60.22 2jss h SER 28 Cb 1.33 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 63.22 2jss h SER 28 CO 0.05 1.24 -0.08 0.40 -0.53 0.00 0.00 176.83 177.91 2jss h ILE 29 N 0.04 1.43 0.30 2.23 2.04 0.20 0.59 117.51 124.35 2jss h ILE 29 Ca -0.16 -1.40 -0.01 0.00 1.00 0.00 0.00 64.86 64.29 2jss h ILE 29 Cb 1.94 2.25 0.00 0.00 -0.74 0.00 0.00 36.82 40.27 2jss h ILE 29 CO 0.15 0.38 -0.15 -0.07 0.00 0.00 0.00 178.15 178.46 2jss h LEU 30 N -0.38 -0.35 -1.15 1.44 4.07 -1.50 0.26 115.31 117.71 2jss h LEU 30 Ca 0.00 -0.16 0.11 0.00 0.08 0.00 0.00 57.88 57.92 2jss h LEU 30 Cb 0.66 0.09 -0.07 0.00 1.08 0.00 0.00 40.66 42.42 2jss h LEU 30 CO 0.02 -0.02 0.60 0.78 -1.08 0.00 0.00 178.44 178.74 2jss h ASN 31 N -0.69 0.82 -0.32 -0.43 -0.26 -1.07 1.17 115.58 114.80 2jss h ASN 31 Ca -0.04 0.03 -0.13 0.00 -0.56 0.00 0.00 56.30 55.60 2jss h ASN 31 Cb 0.48 -0.13 -0.01 0.00 -1.06 0.00 0.00 38.32 37.59 2jss h ASN 31 CO 0.07 0.46 -0.30 0.77 -1.06 0.00 0.00 177.43 177.37 2jss h SER 32 N 0.90 0.87 0.66 5.81 4.64 0.39 0.25 113.55 127.07 2jss h SER 32 Ca 0.45 -0.35 -0.03 0.00 -0.47 0.00 0.00 61.79 61.38 2jss h SER 32 Cb 0.48 -0.24 0.01 0.00 -0.31 0.00 0.00 62.40 62.34 2jss h SER 32 CO -0.21 1.10 -0.32 0.15 -0.87 0.00 0.00 176.83 176.68 2jss h PHE 33 N 0.71 -0.83 -1.33 4.77 3.57 0.21 2.58 116.94 126.62 2jss h PHE 33 Ca 0.08 -0.02 0.43 0.00 3.53 0.00 0.00 57.97 62.00 2jss h PHE 33 Cb 0.84 0.27 -0.12 0.00 2.79 0.00 0.00 35.95 39.73 2jss h PHE 33 CO 0.05 -0.51 0.87 0.28 -2.23 0.00 0.00 178.31 176.76 2jss h VAL 34 N -1.18 0.13 0.11 1.41 2.07 0.13 3.16 116.25 122.07 2jss h VAL 34 Ca -0.09 -0.03 -0.29 0.00 0.82 0.00 0.00 66.70 67.11 2jss h VAL 34 Cb 0.68 0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 2jss h VAL 34 CO 0.15 0.02 -1.43 -1.13 0.02 0.00 0.00 177.57 175.19 2jss h ASN 35 N 0.09 0.35 -0.02 0.57 -1.24 0.21 -1.98 115.58 113.56 2jss h ASN 35 Ca 0.82 -0.46 -0.04 0.00 0.71 0.00 0.00 56.30 57.33 2jss h ASN 35 Cb 2.59 -0.11 0.00 0.00 0.73 0.00 0.00 38.32 41.52 2jss h ASN 35 CO -0.40 1.38 -0.16 -0.78 -1.29 0.00 0.00 177.43 176.18 2jss h ASP 36 N 0.06 0.18 0.52 1.15 1.82 2.12 -2.30 116.42 119.98 2jss h ASP 36 Ca -0.20 -0.69 -0.04 0.00 -0.39 0.00 0.00 57.03 55.70 2jss h ASP 36 Cb 1.99 -0.05 -0.01 0.00 0.68 0.00 0.00 39.33 41.94 2jss h ASP 36 CO 0.17 0.84 -0.21 -0.29 -1.61 0.00 0.00 179.24 178.14 2jss h ILE 37 N -0.48 0.72 -0.41 2.25 2.10 0.44 0.19 117.51 122.32 2jss h ILE 37 Ca -0.01 -0.88 -0.08 0.00 1.08 0.00 0.00 64.86 64.97 2jss h ILE 37 Cb 0.84 1.54 -0.02 0.00 -1.09 0.00 0.00 36.82 38.10 2jss h ILE 37 CO 0.03 0.21 -0.05 0.15 -1.08 0.00 0.00 178.15 177.40 2jss h PHE 38 N 0.00 0.75 0.06 2.19 3.57 -1.26 -2.61 116.94 119.63 2jss h PHE 38 Ca -0.00 -0.11 -0.00 0.00 3.53 0.00 0.00 57.97 61.38 2jss h PHE 38 Cb 0.53 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 39.07 2jss h PHE 38 CO 0.00 0.74 -0.03 0.93 -2.23 0.00 0.00 178.31 177.72 2jss h GLU 39 N 0.65 -0.08 -0.94 1.11 5.08 -0.53 -1.97 114.58 117.91 2jss h GLU 39 Ca 0.12 0.01 0.23 0.00 -1.00 0.00 0.00 59.36 58.72 2jss h GLU 39 Cb 0.48 0.02 -0.17 0.00 0.50 0.00 0.00 28.75 29.58 2jss h GLU 39 CO 0.02 0.49 -0.05 0.00 -1.00 0.00 0.00 179.01 178.47 2jss h ARG 40 N -0.92 0.02 0.00 2.33 3.08 -0.68 2.61 114.38 120.82 2jss h ARG 40 Ca -0.01 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2jss h ARG 40 Cb 0.60 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.64 2jss h ARG 40 CO 0.01 0.02 0.00 -0.89 -1.07 0.00 0.00 179.97 178.04 2jss n ILE 41 N -5.50 0.00 0.30 2.04 5.41 -0.99 -2.20 119.36 118.42 2jss n ILE 41 Ca 0.19 0.64 0.09 0.00 1.00 0.00 0.00 62.75 64.68 2jss n ILE 41 Cb 0.63 -1.45 0.48 0.00 -0.71 0.00 0.00 39.64 38.59 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 1.49 0.00 -1.39 0.00 -1.09 0.56 119.26 116.83 2jss h ALA 42 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 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 -0.49 -0.13 1.15 0.00 0.00 0.00 179.25 179.78 2jss h THR 43 N 0.00 0.42 -0.90 0.00 2.02 0.45 -1.06 112.91 113.85 2jss h THR 43 Ca 0.00 -1.34 0.04 0.00 0.77 0.00 0.00 66.41 65.88 2jss h THR 43 Cb 1.05 0.82 -0.05 0.00 -1.74 0.00 0.00 68.15 68.23 2jss h THR 43 CO 0.00 0.14 0.58 -0.33 0.37 0.00 0.00 175.52 176.28 2jss h GLU 44 N -1.00 1.08 -0.01 6.66 3.07 -0.62 0.93 114.58 124.69 2jss h GLU 44 Ca -0.02 -0.07 0.01 0.00 -0.50 0.00 0.00 59.36 58.79 2jss h GLU 44 Cb 0.34 -0.24 -0.01 0.00 -0.84 0.00 0.00 28.75 27.99 2jss h GLU 44 CO -0.01 0.72 -0.05 0.00 -1.40 0.00 0.00 179.01 178.27 2jss h ALA 45 N 1.37 -0.04 0.00 3.43 0.00 -0.07 0.62 119.26 124.56 2jss h ALA 45 Ca 0.36 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.28 2jss h ALA 45 Cb 0.02 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2jss h ALA 45 CO -0.12 -0.54 0.00 -1.13 0.00 0.00 0.00 179.25 177.45 2jss n SER 46 N -5.17 0.00 -0.08 0.00 3.41 -0.40 -1.19 113.62 110.20 2jss n SER 46 Ca -0.06 0.50 -0.09 0.00 -0.26 0.00 0.00 58.87 58.96 2jss n SER 46 Cb 0.10 -0.50 -0.04 0.00 -0.26 0.00 0.00 64.21 63.51 2jss n SER 46 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 2jss h LYS 47 N 0.00 0.00 0.00 4.33 1.63 0.57 -1.87 116.57 121.23 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 0.18 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.81 2jss h LYS 47 CO 0.00 0.27 0.00 1.47 -3.45 0.00 0.00 179.45 177.74 2jss n LEU 48 N -4.58 0.00 -0.08 5.20 -0.00 0.16 -1.90 117.00 115.80 2jss n LEU 48 Ca -0.13 0.12 -0.09 0.00 -0.00 0.00 0.00 56.01 55.91 2jss n LEU 48 Cb 0.36 -0.12 -0.11 0.00 -0.00 0.00 0.00 43.42 43.54 2jss n LEU 48 CO 0.12 -0.05 -1.03 0.00 -0.00 0.00 0.00 177.39 176.43 2jss n ALA 49 N -1.12 1.61 0.09 1.47 0.00 -0.33 -3.17 120.51 119.06 2jss n ALA 49 Ca 0.11 -0.95 -0.05 0.00 0.00 0.00 0.00 53.44 52.56 2jss n ALA 49 Cb 0.10 -0.04 -0.02 0.00 0.00 0.00 0.00 19.45 19.49 2jss n ALA 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jss h ALA 50 N 0.53 0.56 0.00 0.00 0.00 -1.00 0.40 119.26 119.74 2jss h ALA 50 Ca -0.42 -0.78 -0.14 0.00 0.00 0.00 0.00 54.91 53.57 2jss h ALA 50 Cb 1.86 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 19.49 2jss h ALA 50 CO -0.00 1.08 -1.16 1.88 0.00 0.00 0.00 179.25 181.05 2jss h TYR 51 N 0.00 0.00 -0.07 0.00 -1.99 -1.60 -3.27 116.97 110.05 2jss h TYR 51 Ca -0.01 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.72 2jss h TYR 51 Cb 1.54 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.27 2jss h TYR 51 CO 0.00 0.50 0.00 -1.71 -0.00 0.00 0.00 178.16 176.95 2jss n ASN 52 N -2.95 0.69 0.00 3.88 4.05 -1.19 -4.87 115.26 114.88 2jss n ASN 52 Ca -0.06 -1.52 0.00 0.00 0.45 0.00 0.00 54.58 53.45 2jss n ASN 52 Cb 0.79 -0.04 0.00 0.00 1.23 0.00 0.00 39.78 41.76 2jss n ASN 52 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 2jss n LYS 53 N -0.33 0.00 -0.83 1.20 5.02 -1.11 -4.75 118.16 117.35 2jss n LYS 53 Ca 0.15 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.28 2jss n LYS 53 Cb 0.18 -0.26 -0.09 0.00 -0.02 0.00 0.00 35.03 34.84 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 0.00 1.95 0.24 1.97 5.02 -1.15 -4.54 118.16 121.66 2jss n LYS 54 Ca 0.00 -1.11 0.04 0.00 -2.02 0.00 0.00 58.31 55.22 2jss n LYS 54 Cb 0.00 -2.13 0.22 0.00 -0.02 0.00 0.00 35.03 33.10 2jss n LYS 54 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2jss h SER 55 N 4.44 0.00 -1.81 4.39 0.87 -1.21 -3.40 113.55 116.83 2jss h SER 55 Ca 0.32 0.00 -0.63 0.00 -1.23 0.00 0.00 61.79 60.25 2jss h SER 55 Cb 0.82 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.79 2jss h SER 55 CO 0.75 0.00 1.19 0.41 -0.53 0.00 0.00 176.83 178.64 2jss n THR 56 N -2.24 0.47 -2.72 2.23 -1.04 -1.26 -4.79 114.28 104.94 2jss n THR 56 Ca -0.01 -0.17 -0.42 0.00 -2.04 0.00 0.00 64.05 61.42 2jss n THR 56 Cb 0.67 -1.85 -0.03 0.00 -1.82 0.00 0.00 70.33 67.29 2jss n THR 56 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2jss s ILE 57 N 5.09 4.24 0.31 12.58 -1.09 -1.26 -4.86 121.20 136.20 2jss s ILE 57 Ca 0.97 -0.99 0.06 0.00 -2.23 0.00 0.00 60.65 58.47 2jss s ILE 57 Cb -0.72 -4.92 -0.02 0.00 -1.58 0.00 0.00 42.46 35.22 2jss s ILE 57 CO 0.51 -1.74 0.41 -0.55 -1.23 0.00 0.00 174.94 172.33 2jss s SER 58 N 4.33 5.96 0.56 3.58 0.15 -1.26 -4.13 113.70 122.87 2jss s SER 58 Ca 0.39 -0.16 0.34 0.00 0.70 0.00 0.00 55.95 57.22 2jss s SER 58 Cb -0.03 -1.36 1.49 0.00 -1.71 0.00 0.00 66.02 64.40 2jss s SER 58 CO -0.07 -0.31 1.79 0.00 1.20 0.00 0.00 173.24 175.85 2jss h ALA 59 N 1.03 2.90 -0.27 5.45 0.00 0.47 0.59 119.26 129.42 2jss h ALA 59 Ca -0.47 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.27 2jss h ALA 59 Cb 1.25 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 2jss h ALA 59 CO 0.56 -1.31 -0.37 -0.09 0.00 0.00 0.00 179.25 178.04 2jss h ARG 60 N 0.00 0.62 0.30 0.00 1.12 -1.93 0.38 114.38 114.87 2jss h ARG 60 Ca 0.48 -0.30 -0.01 0.00 -1.11 0.00 0.00 59.98 59.03 2jss h ARG 60 Cb 2.05 -0.00 0.00 0.00 -0.01 0.00 0.00 29.97 32.01 2jss h ARG 60 CO -0.01 0.90 -0.14 0.93 -3.11 0.00 0.00 179.97 178.54 2jss h GLU 61 N 0.52 -0.39 -0.30 0.20 3.07 -0.16 -2.64 114.58 114.88 2jss h GLU 61 Ca 0.05 0.03 -0.06 0.00 -0.50 0.00 0.00 59.36 58.88 2jss h GLU 61 Cb 0.88 0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 28.86 2jss h GLU 61 CO 0.08 -0.05 -0.06 -0.84 -1.40 0.00 0.00 179.01 176.74 2jss h ILE 62 N -0.84 1.20 0.11 3.13 -2.65 -1.52 -2.52 117.51 114.43 2jss h ILE 62 Ca -0.04 -0.86 0.02 0.00 1.03 0.00 0.00 64.86 65.01 2jss h ILE 62 Cb 0.52 1.05 -0.04 0.00 -2.05 0.00 0.00 36.82 36.30 2jss h ILE 62 CO 0.07 0.29 -0.30 1.56 0.03 0.00 0.00 178.15 179.80 2jss h GLN 63 N 0.45 -0.49 0.02 0.16 4.20 -0.20 1.84 115.11 121.09 2jss h GLN 63 Ca 0.09 0.03 0.03 0.00 0.06 0.00 0.00 58.65 58.86 2jss h GLN 63 Cb 0.39 0.11 -0.05 0.00 0.30 0.00 0.00 27.48 28.23 2jss h GLN 63 CO 0.02 -0.33 -0.41 1.79 -0.67 0.00 0.00 178.83 179.23 2jss h THR 64 N -0.51 0.17 0.25 -0.54 1.35 -1.21 2.01 112.91 114.43 2jss h THR 64 Ca 0.03 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.89 2jss h THR 64 Cb 0.55 0.17 -0.03 0.00 -1.73 0.00 0.00 68.15 67.11 2jss h THR 64 CO -0.18 0.00 -0.43 0.00 -0.25 0.00 0.00 175.52 174.66 2jss h ALA 65 N -0.02 -1.00 -0.99 6.62 0.00 -0.99 1.02 119.26 123.91 2jss h ALA 65 Ca 0.05 -0.12 0.29 0.00 0.00 0.00 0.00 54.91 55.12 2jss h ALA 65 Cb 0.64 0.74 -0.14 0.00 0.00 0.00 0.00 17.79 19.04 2jss h ALA 65 CO -0.30 -1.07 0.54 0.28 0.00 0.00 0.00 179.25 178.70 2jss h VAL 66 N -0.72 0.37 -0.20 0.00 2.07 0.34 3.00 116.25 121.10 2jss h VAL 66 Ca -0.03 -0.13 -0.11 0.00 0.82 0.00 0.00 66.70 67.25 2jss h VAL 66 Cb 0.67 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 2jss h VAL 66 CO -0.15 0.07 -0.35 0.03 0.02 0.00 0.00 177.57 177.19 2jss h ARG 67 N 0.39 0.43 0.00 1.57 3.08 0.58 -2.47 114.38 117.95 2jss h ARG 67 Ca 0.69 -0.19 -0.12 0.00 0.07 0.00 0.00 59.98 60.42 2jss h ARG 67 Cb 1.48 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.50 2jss h ARG 67 CO -0.57 0.73 -0.72 -0.07 -1.07 0.00 0.00 179.97 178.26 2jss h LEU 68 N 0.36 0.00 -0.02 3.04 3.38 0.87 -3.40 115.31 119.54 2jss h LEU 68 Ca 0.04 -0.58 0.00 0.00 0.09 0.00 0.00 57.88 57.43 2jss h LEU 68 Cb 0.79 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.54 2jss h LEU 68 CO 0.06 1.21 -0.03 0.40 0.09 0.00 0.00 178.44 180.18 2jss h ILE 69 N -1.00 0.00 -3.55 1.22 1.08 0.48 -3.40 117.51 112.35 2jss h ILE 69 Ca -0.19 0.00 -0.52 0.00 -0.39 0.00 0.00 64.86 63.76 2jss h ILE 69 Cb 1.06 0.00 0.05 0.00 -3.07 0.00 0.00 36.82 34.85 2jss h ILE 69 CO -0.11 0.00 0.67 -0.76 -0.69 0.00 0.00 178.15 177.26 2jss s LEU 70 N -5.76 4.42 0.51 1.44 1.43 -0.93 -4.85 118.68 114.94 2jss s LEU 70 Ca -0.01 2.56 0.44 0.00 -1.03 0.00 0.00 54.13 56.09 2jss s LEU 70 Cb 0.00 -3.63 1.62 0.00 0.03 0.00 0.00 46.19 44.22 2jss s LEU 70 CO 0.03 -0.57 1.53 -2.65 0.23 0.00 0.00 176.35 174.92 2jss n PRO 71 N 1.94 -0.01 0.00 1.29 -0.02 -1.26 -4.69 135.00 132.24 2jss n PRO 71 Ca 0.04 1.12 0.00 0.00 -2.02 0.00 0.00 63.50 62.64 2jss n PRO 71 Cb 0.42 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 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 -1.77 2.33 0.39 -1.23 0.00 -1.26 -4.93 105.19 98.71 2jss n GLY 72 Ca 0.42 -0.46 -0.10 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.30 -0.52 1.61 4.81 -1.97 0.84 114.58 119.06 2jss h GLU 73 Ca 0.00 0.02 0.09 0.00 -0.13 0.00 0.00 59.36 59.34 2jss h GLU 73 Cb 0.00 0.07 -0.07 0.00 0.63 0.00 0.00 28.75 29.37 2jss h GLU 73 CO 0.00 -0.20 0.10 -0.07 -0.73 0.00 0.00 179.01 178.11 2jss h LEU 74 N -0.31 -0.01 -0.30 1.64 3.38 -1.91 -0.46 115.31 117.34 2jss h LEU 74 Ca 0.14 0.10 0.07 0.00 0.09 0.00 0.00 57.88 58.28 2jss h LEU 74 Cb 0.58 0.13 -0.08 0.00 0.09 0.00 0.00 40.66 41.38 2jss h LEU 74 CO -0.60 0.02 -0.29 0.00 0.09 0.00 0.00 178.44 177.66 2jss h ALA 75 N 1.41 -0.19 -1.15 1.53 0.00 -0.37 0.35 119.26 120.85 2jss h ALA 75 Ca 0.26 0.08 0.38 0.00 0.00 0.00 0.00 54.91 55.64 2jss h ALA 75 Cb 0.36 0.61 -0.14 0.00 0.00 0.00 0.00 17.79 18.63 2jss h ALA 75 CO -0.35 -0.71 0.70 0.87 0.00 0.00 0.00 179.25 179.76 2jss h LYS 76 N -0.27 0.17 -0.00 0.00 1.79 0.21 2.61 116.57 121.08 2jss h LYS 76 Ca 0.15 -0.01 -0.18 0.00 -2.18 0.00 0.00 60.65 58.43 2jss h LYS 76 Cb 0.51 -0.04 0.01 0.00 -1.58 0.00 0.00 32.23 31.14 2jss h LYS 76 CO -0.45 0.11 -0.70 0.45 -1.08 0.00 0.00 179.45 177.78 2jss h HIS 77 N 0.18 0.71 0.00 -1.35 3.86 -0.06 -1.39 115.15 117.10 2jss h HIS 77 Ca 0.78 -0.39 0.00 0.00 -1.16 0.00 0.00 60.37 59.60 2jss h HIS 77 Cb 2.15 -0.08 0.00 0.00 1.06 0.00 0.00 27.41 30.54 2jss h HIS 77 CO -0.01 1.21 0.00 0.00 0.86 0.00 0.00 177.93 179.99 2jss h ALA 78 N 0.34 1.00 0.04 2.45 0.00 0.46 -2.43 119.26 121.12 2jss h ALA 78 Ca -0.09 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.51 2jss h ALA 78 Cb 1.40 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.15 2jss h ALA 78 CO 0.14 0.00 -1.78 0.28 0.00 0.00 0.00 179.25 177.88 2jss h VAL 79 N 0.00 0.80 0.83 0.00 2.07 0.40 -2.09 116.25 118.26 2jss h VAL 79 Ca 0.00 -2.60 -0.04 0.00 0.82 0.00 0.00 66.70 64.88 2jss h VAL 79 Cb 0.45 2.46 0.01 0.00 -1.52 0.00 0.00 31.29 32.70 2jss h VAL 79 CO 0.00 0.63 -0.40 -1.28 0.02 0.00 0.00 177.57 176.54 2jss h SER 80 N 0.03 -0.94 -0.59 0.57 0.87 -0.90 -2.24 113.55 110.34 2jss h SER 80 Ca -0.32 0.02 -0.09 0.00 -1.23 0.00 0.00 61.79 60.17 2jss h SER 80 Cb 2.02 0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 64.20 2jss h SER 80 CO 0.09 -0.64 0.01 -0.33 -0.53 0.00 0.00 176.83 175.43 2jss h GLU 81 N -1.18 1.05 -0.07 2.24 4.39 -1.61 -2.02 114.58 117.38 2jss h GLU 81 Ca -0.11 -0.32 0.04 0.00 0.34 0.00 0.00 59.36 59.30 2jss h GLU 81 Cb 0.86 -0.10 -0.06 0.00 -0.10 0.00 0.00 28.75 29.35 2jss h GLU 81 CO 0.19 1.02 -0.44 0.78 -1.16 0.00 0.00 179.01 179.39 2jss h GLY 82 N 1.00 -0.81 0.14 -3.84 0.00 -1.28 0.33 103.07 98.61 2jss h GLY 82 Ca 0.17 0.55 -0.01 0.00 0.00 0.00 0.00 47.33 48.04 2jss h GLY 82 CO 0.03 -0.23 -0.07 -0.91 0.00 0.00 0.00 176.54 175.36 2jss h THR 83 N -0.55 0.00 -1.54 4.70 1.35 -1.43 -2.53 112.91 112.91 2jss h THR 83 Ca 0.06 -0.43 0.50 0.00 -0.55 0.00 0.00 66.41 65.98 2jss h THR 83 Cb 0.65 0.00 -0.12 0.00 -1.73 0.00 0.00 68.15 66.96 2jss h THR 83 CO -0.37 0.00 1.04 -1.14 -0.25 0.00 0.00 175.52 174.80 2jss n ARG 84 N -3.72 -0.02 -0.03 4.72 3.00 -0.76 0.30 116.66 120.14 2jss n ARG 84 Ca -0.02 1.17 -0.13 0.00 -0.00 0.00 0.00 57.85 58.86 2jss n ARG 84 Cb 0.08 -2.42 -0.09 0.00 0.00 0.00 0.00 32.46 30.03 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 1.36 0.09 -0.85 5.13 0.00 -0.37 -2.23 119.26 122.38 2jss h ALA 85 Ca 0.88 -0.29 0.21 0.00 0.00 0.00 0.00 54.91 55.71 2jss h ALA 85 Cb 3.08 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 20.80 2jss h ALA 85 CO -0.31 -0.10 0.58 0.28 0.00 0.00 0.00 179.25 179.70 2jss h VAL 86 N -0.31 0.67 0.00 0.00 2.07 0.49 0.42 116.25 119.60 2jss h VAL 86 Ca 0.01 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.43 2jss h VAL 86 Cb 0.59 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 2jss h VAL 86 CO 0.02 0.05 0.00 0.41 0.02 0.00 0.00 177.57 178.07 2jss n THR 87 N -4.44 0.00 -0.22 2.57 -1.04 0.43 -1.56 114.28 110.01 2jss n THR 87 Ca 0.18 1.13 -0.00 0.00 -2.04 0.00 0.00 64.05 63.31 2jss n THR 87 Cb 0.73 -2.07 0.06 0.00 -1.82 0.00 0.00 70.33 67.24 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 -0.02 -1.31 -2.82 1.63 -1.13 2.75 116.57 115.67 2jss h LYS 88 Ca 0.00 0.00 0.39 0.00 -0.85 0.00 0.00 60.65 60.19 2jss h LYS 88 Cb 0.00 0.00 -0.09 0.00 -0.60 0.00 0.00 32.23 31.54 2jss h LYS 88 CO 0.00 -0.01 0.89 -0.92 -3.45 0.00 0.00 179.45 175.96 2jss h TYR 89 N -0.02 0.36 0.00 1.91 3.20 -0.18 -2.56 116.97 119.68 2jss h TYR 89 Ca 0.31 0.01 -0.10 0.00 3.14 0.00 0.00 58.73 62.09 2jss h TYR 89 Cb 0.49 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.65 2jss h TYR 89 CO -0.55 -0.06 -1.23 -1.13 -1.64 0.00 0.00 178.16 173.56 2jss n SER 90 N -4.45 0.65 -0.19 -2.11 3.41 0.19 -2.43 113.62 108.70 2jss n SER 90 Ca 0.32 0.11 0.27 0.00 -0.26 0.00 0.00 58.87 59.31 2jss n SER 90 Cb 1.33 -0.25 0.46 0.00 -0.26 0.00 0.00 64.21 65.48 2jss n SER 90 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2jss h SER 91 N -0.26 0.00 0.00 4.04 4.64 0.45 1.66 113.55 124.08 2jss h SER 91 Ca -0.16 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.14 2jss h SER 91 Cb 1.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 2jss h SER 91 CO -0.10 0.00 -0.10 0.77 -0.87 0.00 0.00 176.83 176.53 2jss h SER 92 N 0.00 0.08 0.00 4.97 4.64 -1.60 -3.44 113.55 118.20 2jss h SER 92 Ca 0.46 -0.82 -0.14 0.00 -0.47 0.00 0.00 61.79 60.82 2jss h SER 92 Cb 2.78 -0.03 -0.11 0.00 -0.31 0.00 0.00 62.40 64.73 2jss h SER 92 CO -0.00 0.89 -0.17 0.41 -0.87 0.00 0.00 176.83 177.09 2jss n THR 93 N -4.62 0.00 -0.70 2.95 -1.04 0.24 -4.93 114.28 106.19 2jss n THR 93 Ca -0.10 -0.89 -0.03 0.00 -2.04 0.00 0.00 64.05 60.99 2jss n THR 93 Cb 0.45 0.85 -0.01 0.00 -1.82 0.00 0.00 70.33 69.79 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 -0.88 -1.69 -0.04 -2.82 1.13 0.50 -3.64 117.38 109.93 2jss n GLN 94 Ca -0.12 0.30 0.00 0.00 -1.94 0.00 0.00 57.00 55.24 2jss n GLN 94 Cb 0.77 -3.89 0.00 0.00 0.11 0.00 0.00 30.24 27.22 2jss n GLN 94 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2jss n ALA 95 N 0.21 -0.09 0.02 -1.58 0.00 -1.02 -4.82 120.51 113.23 2jss n ALA 95 Ca -0.03 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.37 2jss n ALA 95 Cb 0.22 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.57 2jss n ALA 95 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2jss h GLN 96 N 0.00 0.00 -0.35 0.00 4.15 -1.82 -3.45 115.11 113.64 2jss h GLN 96 Ca 0.00 0.00 0.10 0.00 0.77 0.00 0.00 58.65 59.52 2jss h GLN 96 Cb 0.00 0.00 -0.18 0.00 0.21 0.00 0.00 27.48 27.51 2jss h GLN 96 CO 0.00 0.43 -0.17 -1.54 -1.93 0.00 0.00 178.83 175.62 2jss s SER 97 N -6.01 -0.54 0.38 -0.69 1.04 -1.26 -5.01 113.70 101.61 2jss s SER 97 Ca -0.03 -0.27 0.19 0.00 0.48 0.00 0.00 55.95 56.33 2jss s SER 97 Cb 0.08 0.71 1.16 0.00 0.10 0.00 0.00 66.02 68.07 2jss s SER 97 CO 0.81 -0.06 1.70 0.77 0.98 0.00 0.00 173.24 177.45 2jss h SER 98 N 5.74 0.44 0.00 7.02 4.64 -1.93 2.59 113.55 132.05 2jss h SER 98 Ca -0.02 0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 2jss h SER 98 Cb 1.22 0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 2jss h SER 98 CO -0.04 -0.03 0.00 -1.54 -0.87 0.00 0.00 176.83 174.34 2jss n SER 99 N -4.78 0.39 0.00 4.97 3.41 -1.26 -1.67 113.62 114.68 2jss n SER 99 Ca 0.30 -1.17 0.00 0.00 -0.26 0.00 0.00 58.87 57.74 2jss n SER 99 Cb 1.03 -0.20 0.00 0.00 -0.26 0.00 0.00 64.21 64.78 2jss n SER 99 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jss n ALA 100 N -0.03 0.06 -0.10 7.33 0.00 0.42 -4.88 120.51 123.31 2jss n ALA 100 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.20 2jss n ALA 100 Cb 0.10 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.43 2jss n ALA 100 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2jss n ARG 101 N -0.22 0.63 0.21 0.00 3.00 0.77 -4.08 116.66 116.97 2jss n ARG 101 Ca 0.00 0.34 0.05 0.00 -0.00 0.00 0.00 57.85 58.23 2jss n ARG 101 Cb 0.00 -1.62 0.25 0.00 0.00 0.00 0.00 32.46 31.09 2jss n ARG 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2jss h ALA 102 N -0.46 1.43 0.00 5.13 0.00 -1.46 -3.38 119.26 120.52 2jss h ALA 102 Ca -0.52 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2jss h ALA 102 Cb 1.65 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.44 2jss h ALA 102 CO -0.20 -0.43 0.00 0.41 0.00 0.00 0.00 179.25 179.03 2jss n GLY 103 N -1.29 0.26 2.77 0.00 0.00 -1.26 -4.77 105.19 100.89 2jss n GLY 103 Ca -0.01 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 2jss n GLY 103 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jss s LEU 104 N 0.00 1.16 0.00 0.99 1.43 -1.26 -4.99 118.68 116.00 2jss s LEU 104 Ca 0.00 -0.67 0.00 0.00 -1.03 0.00 0.00 54.13 52.43 2jss s LEU 104 Cb 0.00 -0.62 0.00 0.00 0.03 0.00 0.00 46.19 45.60 2jss s LEU 104 CO 0.00 -0.27 0.70 0.00 0.23 0.00 0.00 176.35 177.01 2jss n GLN 105 N 5.04 0.82 -3.37 1.70 6.02 -1.26 -4.81 117.38 121.52 2jss n GLN 105 Ca -0.09 0.00 -0.37 0.00 -0.01 0.00 0.00 57.00 56.53 2jss n GLN 105 Cb 0.48 -1.19 -0.06 0.00 1.02 0.00 0.00 30.24 30.49 2jss n GLN 105 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.06 176.17 2jss s PHE 106 N -0.18 3.71 -0.65 1.08 5.36 -1.26 -4.90 117.98 121.14 2jss s PHE 106 Ca 0.00 1.11 -0.06 0.00 -0.96 0.00 0.00 56.93 57.02 2jss s PHE 106 Cb 0.00 -2.38 -0.22 0.00 -0.34 0.00 0.00 43.02 40.08 2jss s PHE 106 CO 0.00 0.54 1.52 -2.30 -1.46 0.00 0.00 175.22 173.52 2jss n PRO 107 N 1.37 0.00 0.09 10.12 -0.02 -1.26 -4.71 135.00 140.58 2jss n PRO 107 Ca -0.09 0.00 -0.19 0.00 -2.02 0.00 0.00 63.50 61.20 2jss n PRO 107 Cb 0.52 -0.77 -0.11 0.00 -0.02 0.00 0.00 33.50 33.11 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 5.41 1.35 0.16 -1.45 2.07 -1.90 -2.59 116.25 119.30 2jss h VAL 108 Ca 0.03 -2.59 -0.33 0.00 0.82 0.00 0.00 66.70 64.63 2jss h VAL 108 Cb 0.86 2.70 0.00 0.00 -1.52 0.00 0.00 31.29 33.33 2jss h VAL 108 CO 1.18 0.78 -1.61 1.23 0.02 0.00 0.00 177.57 179.17 2jss h GLY 109 N 0.75 0.39 1.05 2.17 0.00 -1.97 -1.65 103.07 103.81 2jss h GLY 109 Ca -0.16 -0.99 -0.10 0.00 0.00 0.00 0.00 47.33 46.08 2jss h GLY 109 CO 0.22 0.87 -0.07 -0.09 0.00 0.00 0.00 176.54 177.47 2jss h ARG 110 N 0.09 0.94 -0.01 4.80 2.43 -1.95 0.13 114.38 120.82 2jss h ARG 110 Ca -0.28 -0.34 -0.04 0.00 -0.81 0.00 0.00 59.98 58.51 2jss h ARG 110 Cb 2.07 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 31.55 2jss h ARG 110 CO 0.18 0.99 -0.16 0.82 -1.51 0.00 0.00 179.97 180.29 2jss h ILE 111 N 0.80 1.56 -0.35 1.20 2.04 -1.59 -1.88 117.51 119.29 2jss h ILE 111 Ca 0.13 -1.87 0.10 0.00 1.00 0.00 0.00 64.86 64.22 2jss h ILE 111 Cb 0.62 2.76 -0.01 0.00 -0.74 0.00 0.00 36.82 39.44 2jss h ILE 111 CO 0.04 0.51 0.47 0.50 0.00 0.00 0.00 178.15 179.67 2jss h LYS 112 N -0.57 0.00 -0.04 2.37 3.11 -1.27 2.39 116.57 122.56 2jss h LYS 112 Ca -0.02 0.00 -0.20 0.00 -2.81 0.00 0.00 60.65 57.62 2jss h LYS 112 Cb 0.91 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 32.14 2jss h LYS 112 CO 0.03 0.00 -0.84 0.00 -2.81 0.00 0.00 179.45 175.84 2jss h ARG 113 N 0.00 0.39 0.00 1.90 3.08 -0.28 -0.67 114.38 118.80 2jss h ARG 113 Ca 0.17 -0.37 0.00 0.00 0.07 0.00 0.00 59.98 59.84 2jss h ARG 113 Cb 1.11 0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.25 2jss h ARG 113 CO -0.00 1.03 0.00 1.88 -1.07 0.00 0.00 179.97 181.81 2jss h TYR 114 N 0.24 0.00 0.00 3.04 -1.99 0.48 0.13 116.97 118.87 2jss h TYR 114 Ca -0.05 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.66 2jss h TYR 114 Cb 1.44 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 40.17 2jss h TYR 114 CO 0.05 0.00 -1.44 1.28 -0.00 0.00 0.00 178.16 178.05 2jss n LEU 115 N -2.54 0.50 0.01 3.88 4.77 -0.29 -2.34 117.00 120.99 2jss n LEU 115 Ca 0.00 0.20 -0.03 0.00 -0.03 0.00 0.00 56.01 56.15 2jss n LEU 115 Cb 0.19 -0.02 -0.10 0.00 -2.33 0.00 0.00 43.42 41.16 2jss n LEU 115 CO 0.20 -0.08 -0.38 1.17 -1.33 0.00 0.00 177.39 176.97 2jss n LYS 116 N -2.53 0.62 -0.10 3.23 0.00 -0.06 -3.54 118.16 115.80 2jss n LYS 116 Ca -0.03 0.24 -0.13 0.00 0.00 0.00 0.00 58.31 58.39 2jss n LYS 116 Cb 0.59 -1.80 -0.10 0.00 0.00 0.00 0.00 35.03 33.72 2jss n LYS 116 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 2jss n ARG 117 N -2.93 0.62 0.04 1.64 1.85 0.24 -3.26 116.66 114.86 2jss n ARG 117 Ca -0.12 0.10 -0.21 0.00 -1.00 0.00 0.00 57.85 56.62 2jss n ARG 117 Cb 0.91 -1.41 -0.14 0.00 -1.05 0.00 0.00 32.46 30.76 2jss n ARG 117 CO 0.00 0.00 0.00 1.25 -0.01 0.00 0.00 177.63 178.87 2jss h HIS 118 N 0.00 0.55 -0.59 2.89 2.76 -1.63 -3.34 115.15 115.78 2jss h HIS 118 Ca -0.46 -0.40 0.11 0.00 -2.20 0.00 0.00 60.37 57.43 2jss h HIS 118 Cb 1.75 -0.02 -0.12 0.00 1.55 0.00 0.00 27.41 30.57 2jss h HIS 118 CO 0.02 1.47 -0.23 0.00 -1.30 0.00 0.00 177.93 177.89 2jss h ALA 119 N 0.03 0.21 0.00 5.26 0.00 -1.60 -3.45 119.26 119.70 2jss h ALA 119 Ca -0.24 0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2jss h ALA 119 Cb 1.77 0.60 0.00 0.00 0.00 0.00 0.00 17.79 20.16 2jss h ALA 119 CO 0.12 -0.54 0.00 -2.37 0.00 0.00 0.00 179.25 176.47 2jss n THR 120 N -5.43 0.00 0.00 0.00 5.66 -1.25 -5.01 114.28 108.24 2jss n THR 120 Ca 0.06 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.06 2jss n THR 120 Cb 0.34 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.12 2jss n THR 120 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2jss n GLY 121 N 0.00 3.38 0.69 1.09 0.00 -1.20 -4.90 105.19 104.26 2jss n GLY 121 Ca 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.42 2jss n GLY 121 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jss n ARG 122 N 0.00 0.67 -2.99 1.61 3.00 -1.26 -4.70 116.66 112.99 2jss n ARG 122 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 57.85 57.41 2jss n ARG 122 Cb 0.00 -1.27 -0.06 0.00 0.00 0.00 0.00 32.46 31.13 2jss n ARG 122 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 2jss s THR 123 N -0.49 4.69 0.39 0.55 2.01 -1.26 -4.86 115.64 116.66 2jss s THR 123 Ca 0.00 0.41 0.12 0.00 0.31 0.00 0.00 61.69 62.53 2jss s THR 123 Cb 0.00 -4.29 0.12 0.00 0.01 0.00 0.00 72.50 68.34 2jss s THR 123 CO 0.00 -0.67 1.87 0.03 -0.69 0.00 0.00 174.62 175.16 2jss h ARG 124 N 8.91 0.05 -5.58 4.92 2.47 -1.92 -3.46 114.38 119.77 2jss h ARG 124 Ca -0.25 -0.02 -0.11 0.00 -1.26 0.00 0.00 59.98 58.34 2jss h ARG 124 Cb 1.09 -0.00 0.03 0.00 -1.65 0.00 0.00 29.97 29.44 2jss h ARG 124 CO 0.94 0.35 -0.30 0.28 0.56 0.00 0.00 179.97 181.80 2jss n VAL 125 N -4.17 -9.06 -1.29 2.04 0.31 -1.26 -4.88 118.33 100.02 2jss n VAL 125 Ca -0.02 -0.41 -0.37 0.00 -0.01 0.00 0.00 64.34 63.53 2jss n VAL 125 Cb 0.36 -6.30 0.05 0.00 -0.91 0.00 0.00 33.84 27.04 2jss n VAL 125 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2jss n GLY 126 N -1.68 -2.07 0.00 2.92 0.00 -1.26 -4.68 105.19 98.43 2jss n GLY 126 Ca -0.05 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.65 2jss n GLY 126 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2jss n SER 127 N 0.72 0.00 -2.82 1.61 2.88 -1.26 -2.09 113.62 112.66 2jss n SER 127 Ca 0.09 0.22 -0.38 0.00 -1.33 0.00 0.00 58.87 57.47 2jss n SER 127 Cb 0.49 -0.22 0.04 0.00 -0.75 0.00 0.00 64.21 63.77 2jss n SER 127 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 2jss n LYS 128 N -1.17 2.84 0.06 -1.46 2.85 -1.26 -4.61 118.16 115.42 2jss n LYS 128 Ca 0.00 -3.65 0.00 0.00 -1.05 0.00 0.00 58.31 53.61 2jss n LYS 128 Cb 0.08 -2.27 0.00 0.00 -0.65 0.00 0.00 35.03 32.19 2jss n LYS 128 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2jss n ALA 129 N -0.55 0.21 -0.36 0.58 0.00 -0.89 0.32 120.51 119.81 2jss n ALA 129 Ca 0.52 0.00 0.31 0.00 0.00 0.00 0.00 53.44 54.27 2jss n ALA 129 Cb 0.32 0.00 0.57 0.00 0.00 0.00 0.00 19.45 20.33 2jss n ALA 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jss h ALA 130 N 0.00 2.27 -0.35 0.00 0.00 -1.84 1.83 119.26 121.18 2jss h ALA 130 Ca 0.00 0.19 -0.15 0.00 0.00 0.00 0.00 54.91 54.96 2jss h ALA 130 Cb 0.00 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2jss h ALA 130 CO 0.00 -0.95 -0.37 0.97 0.00 0.00 0.00 179.25 178.90 2jss h ILE 131 N 0.14 1.28 -0.07 0.00 2.10 -1.90 -1.95 117.51 117.11 2jss h ILE 131 Ca 0.80 -1.54 0.02 0.00 1.08 0.00 0.00 64.86 65.22 2jss h ILE 131 Cb 2.15 1.41 -0.00 0.00 -1.09 0.00 0.00 36.82 39.28 2jss h ILE 131 CO -0.60 0.51 0.20 0.22 -1.08 0.00 0.00 178.15 177.39 2jss h TYR 132 N 0.67 0.00 0.00 2.19 3.20 0.26 0.71 116.97 124.00 2jss h TYR 132 Ca 0.06 0.00 -0.19 0.00 3.14 0.00 0.00 58.73 61.74 2jss h TYR 132 Cb 0.93 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 39.16 2jss h TYR 132 CO 0.05 0.00 -1.57 1.28 -1.64 0.00 0.00 178.16 176.28 2jss n LEU 133 N -3.26 0.73 0.14 2.82 4.77 -0.80 -2.14 117.00 119.26 2jss n LEU 133 Ca -0.01 0.33 0.09 0.00 -0.03 0.00 0.00 56.01 56.39 2jss n LEU 133 Cb 0.28 0.12 0.05 0.00 -2.33 0.00 0.00 43.42 41.54 2jss n LEU 133 CO 0.20 0.20 0.31 0.71 -1.33 0.00 0.00 177.39 177.48 2jss h THR 134 N 0.00 0.16 0.09 -5.08 1.35 -0.06 -2.39 112.91 106.97 2jss h THR 134 Ca -0.21 -1.26 -0.18 0.00 -0.55 0.00 0.00 66.41 64.22 2jss h THR 134 Cb 1.67 1.84 0.01 0.00 -1.73 0.00 0.00 68.15 69.93 2jss h THR 134 CO 0.05 0.09 -0.86 0.00 -0.25 0.00 0.00 175.52 174.55 2jss h ALA 135 N 1.87 0.03 -0.05 6.62 0.00 0.19 -2.26 119.26 125.66 2jss h ALA 135 Ca -0.02 -0.81 -0.11 0.00 0.00 0.00 0.00 54.91 53.96 2jss h ALA 135 Cb 1.11 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 2jss h ALA 135 CO 0.01 0.46 -0.49 -0.39 0.00 0.00 0.00 179.25 178.84 2jss h VAL 136 N -0.54 1.35 0.26 0.00 -1.51 -1.52 -1.71 116.25 112.57 2jss h VAL 136 Ca -0.18 -1.70 -0.01 0.00 -1.23 0.00 0.00 66.70 63.58 2jss h VAL 136 Cb 1.52 1.85 0.00 0.00 -2.13 0.00 0.00 31.29 32.53 2jss h VAL 136 CO 0.06 0.50 -0.12 -0.07 -1.23 0.00 0.00 177.57 176.71 2jss h LEU 137 N 0.11 -0.29 -2.50 4.19 3.38 -1.54 -2.18 115.31 116.48 2jss h LEU 137 Ca 0.00 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.81 2jss h LEU 137 Cb 0.91 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.73 2jss h LEU 137 CO 0.07 0.21 0.09 -0.08 0.09 0.00 0.00 178.44 178.82 2jss h GLU 138 N -1.00 0.00 0.10 1.13 4.81 -1.46 2.14 114.58 120.30 2jss h GLU 138 Ca -0.04 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2jss h GLU 138 Cb 0.44 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.82 2jss h GLU 138 CO 0.06 0.00 -0.05 -0.92 -0.73 0.00 0.00 179.01 177.37 2jss h TYR 139 N 0.00 -0.12 0.00 0.92 3.20 -1.24 -1.94 116.97 117.80 2jss h TYR 139 Ca 0.00 -0.00 -0.13 0.00 3.14 0.00 0.00 58.73 61.73 2jss h TYR 139 Cb 0.19 0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.48 2jss h TYR 139 CO 0.00 0.27 -0.78 -0.07 -1.64 0.00 0.00 178.16 175.94 2jss h LEU 140 N -0.97 0.00 -0.06 2.82 3.38 -0.75 -2.06 115.31 117.67 2jss h LEU 140 Ca -0.01 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 2jss h LEU 140 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2jss h LEU 140 CO 0.02 0.59 -0.23 0.74 0.09 0.00 0.00 178.44 179.65 2jss h THR 141 N 0.00 1.44 0.00 0.22 2.02 0.34 0.05 112.91 116.98 2jss h THR 141 Ca -0.04 -1.63 -0.07 0.00 0.77 0.00 0.00 66.41 65.43 2jss h THR 141 Cb 1.48 2.33 -0.01 0.00 -1.74 0.00 0.00 68.15 70.21 2jss h THR 141 CO 0.07 0.46 -0.35 0.00 0.37 0.00 0.00 175.52 176.07 2jss h ALA 142 N 0.43 1.16 0.03 6.16 0.00 -1.43 -2.62 119.26 123.00 2jss h ALA 142 Ca -0.01 -0.32 -0.14 0.00 0.00 0.00 0.00 54.91 54.44 2jss h ALA 142 Cb 0.86 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.61 2jss h ALA 142 CO 0.05 0.44 -0.57 1.49 0.00 0.00 0.00 179.25 180.66 2jss h GLU 143 N 0.00 0.33 -0.83 0.00 4.57 -1.30 -1.24 114.58 116.11 2jss h GLU 143 Ca -0.00 -0.40 0.01 0.00 -1.18 0.00 0.00 59.36 57.79 2jss h GLU 143 Cb 0.74 0.12 -0.04 0.00 -0.16 0.00 0.00 28.75 29.41 2jss h GLU 143 CO 0.05 1.10 0.55 0.28 -1.18 0.00 0.00 179.01 179.81 2jss h VAL 144 N -0.26 1.20 -0.13 0.32 2.07 -0.93 -1.75 116.25 116.77 2jss h VAL 144 Ca -0.08 -0.38 -0.18 0.00 0.82 0.00 0.00 66.70 66.87 2jss h VAL 144 Cb 1.32 -0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 31.08 2jss h VAL 144 CO 0.11 0.20 -0.67 0.25 0.02 0.00 0.00 177.57 177.48 2jss h LEU 145 N 1.12 0.61 0.52 2.57 5.85 -1.51 -2.43 115.31 122.04 2jss h LEU 145 Ca 0.31 -0.37 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 2jss h LEU 145 Cb -0.11 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 40.73 2jss h LEU 145 CO -0.07 1.11 -0.42 -0.08 -0.34 0.00 0.00 178.44 178.64 2jss h GLU 146 N 0.38 -0.89 -0.05 1.25 4.81 -0.36 0.85 114.58 120.56 2jss h GLU 146 Ca -0.02 0.06 0.02 0.00 -0.13 0.00 0.00 59.36 59.29 2jss h GLU 146 Cb 1.25 0.20 -0.03 0.00 0.63 0.00 0.00 28.75 30.80 2jss h GLU 146 CO 0.12 -0.59 -0.08 -0.07 -0.73 0.00 0.00 179.01 177.66 2jss h LEU 147 N -0.92 -0.25 -1.05 1.64 3.38 -1.47 0.14 115.31 116.79 2jss h LEU 147 Ca -0.06 0.05 0.04 0.00 0.09 0.00 0.00 57.88 58.00 2jss h LEU 147 Cb 0.79 0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.60 2jss h LEU 147 CO -0.01 -0.12 0.64 0.00 0.09 0.00 0.00 178.44 179.05 2jss h ALA 148 N 0.92 1.37 0.09 1.53 0.00 -1.23 -0.88 119.26 121.05 2jss h ALA 148 Ca 0.05 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2jss h ALA 148 Cb 0.19 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2jss h ALA 148 CO -0.12 0.53 -0.04 0.78 0.00 0.00 0.00 179.25 180.39 2jss h GLY 149 N 1.23 -0.12 1.10 0.00 0.00 0.14 2.14 103.07 107.56 2jss h GLY 149 Ca 0.39 0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.77 2jss h GLY 149 CO -0.12 -0.04 0.29 0.70 0.00 0.00 0.00 176.54 177.36 2jss n ASN 150 N -2.60 0.20 -0.10 0.19 3.02 0.44 -1.73 115.26 114.67 2jss n ASN 150 Ca -0.01 0.44 -0.20 0.00 -0.03 0.00 0.00 54.58 54.77 2jss n ASN 150 Cb 0.05 -0.39 -0.07 0.00 -0.61 0.00 0.00 39.78 38.75 2jss n ASN 150 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jss n ALA 151 N -1.44 1.71 -0.06 5.41 0.00 -0.34 -3.82 120.51 121.98 2jss n ALA 151 Ca -0.01 -0.78 0.24 0.00 0.00 0.00 0.00 53.44 52.89 2jss n ALA 151 Cb 0.30 0.22 0.72 0.00 0.00 0.00 0.00 19.45 20.70 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 -0.61 2.56 0.09 0.00 0.00 0.44 1.41 119.26 123.15 2jss h ALA 152 Ca -0.49 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.21 2jss h ALA 152 Cb 1.46 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.31 2jss h ALA 152 CO -0.27 -0.87 -0.93 -0.22 0.00 0.00 0.00 179.25 176.96 2jss h LYS 153 N 0.00 0.19 0.00 0.00 1.63 -1.52 0.25 116.57 117.12 2jss h LYS 153 Ca 0.32 -0.33 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 2jss h LYS 153 Cb 1.37 0.12 0.00 0.00 -0.60 0.00 0.00 32.23 33.12 2jss h LYS 153 CO -0.00 1.16 0.00 -0.25 -3.45 0.00 0.00 179.45 176.90 2jss n ASP 154 N -4.17 0.23 -0.01 4.20 8.00 -0.45 -2.91 116.55 121.44 2jss n ASP 154 Ca -0.19 0.55 -0.21 0.00 0.71 0.00 0.00 54.79 55.64 2jss n ASP 154 Cb 0.77 -0.60 -0.14 0.00 -0.02 0.00 0.00 41.12 41.14 2jss n ASP 154 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2jss n LEU 155 N -1.75 2.59 0.00 0.64 4.77 0.47 -4.99 117.00 118.74 2jss n LEU 155 Ca 0.04 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.23 2jss n LEU 155 Cb 0.23 -1.10 0.00 0.00 -2.33 0.00 0.00 43.42 40.22 2jss n LEU 155 CO 0.19 0.81 0.00 2.29 -1.33 0.00 0.00 177.39 179.35 2jss n LYS 156 N -3.56 0.00 -3.64 3.23 2.85 -0.78 -5.06 118.16 111.20 2jss n LYS 156 Ca -0.33 0.00 -0.09 0.00 -1.05 0.00 0.00 58.31 56.84 2jss n LYS 156 Cb 1.01 0.00 -0.07 0.00 -0.65 0.00 0.00 35.03 35.32 2jss n LYS 156 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2jss s VAL 157 N -1.16 0.00 -0.26 0.58 0.11 0.82 -4.94 120.40 115.55 2jss s VAL 157 Ca 0.00 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.05 2jss s VAL 157 Cb 0.00 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.85 2jss s VAL 157 CO 0.00 0.00 0.59 2.29 -3.33 0.00 0.00 175.10 174.65 2jss n LYS 158 N 3.59 0.00 -3.07 1.54 2.85 -1.26 -3.89 118.16 117.93 2jss n LYS 158 Ca -0.17 0.11 -0.44 0.00 -1.05 0.00 0.00 58.31 56.76 2jss n LYS 158 Cb 0.57 -1.86 -0.06 0.00 -0.65 0.00 0.00 35.03 33.04 2jss n LYS 158 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 177.40 177.85 2jss s ARG 159 N -2.18 3.16 0.75 -1.58 3.52 -1.26 -3.36 118.95 118.01 2jss s ARG 159 Ca 0.00 -0.77 -0.15 0.00 -0.13 0.00 0.00 55.73 54.68 2jss s ARG 159 Cb 0.00 -4.11 0.05 0.00 -1.56 0.00 0.00 34.95 29.34 2jss s ARG 159 CO 0.00 -1.33 1.23 0.42 -0.81 0.00 0.00 175.30 174.81 2jss s ILE 160 N 3.00 2.07 0.02 4.11 1.01 -1.26 -4.70 121.20 125.45 2jss s ILE 160 Ca 0.19 0.03 -0.10 0.00 0.00 0.00 0.00 60.65 60.77 2jss s ILE 160 Cb -0.18 -2.62 0.01 0.00 0.01 0.00 0.00 42.46 39.67 2jss s ILE 160 CO 0.13 -0.02 0.20 0.42 0.00 0.00 0.00 174.94 175.67 2jss s THR 161 N -1.91 0.09 0.14 2.92 -4.23 -1.26 -1.32 115.64 110.07 2jss s THR 161 Ca 0.76 -0.75 0.02 0.00 -1.18 0.00 0.00 61.69 60.54 2jss s THR 161 Cb -0.31 -0.70 0.02 0.00 1.34 0.00 0.00 72.50 72.84 2jss s THR 161 CO 0.47 -0.41 0.78 -2.65 -0.54 0.00 0.00 174.62 172.26 2jss n PRO 162 N 1.04 0.02 -0.00 3.99 -0.02 -1.26 -0.00 135.00 138.76 2jss n PRO 162 Ca -0.21 0.36 -0.10 0.00 -2.02 0.00 0.00 63.50 61.53 2jss n PRO 162 Cb 0.57 -2.15 -0.08 0.00 -0.02 0.00 0.00 33.50 31.82 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 -0.10 0.00 -0.52 9.65 -1.93 -1.01 114.38 120.47 2jss h ARG 163 Ca 0.00 0.01 -0.02 0.00 -1.10 0.00 0.00 59.98 58.87 2jss h ARG 163 Cb 1.17 0.02 -0.00 0.00 -1.39 0.00 0.00 29.97 29.77 2jss h ARG 163 CO 0.00 0.44 -0.09 0.45 2.80 0.00 0.00 179.97 183.57 2jss h HIS 164 N -0.89 0.00 0.00 2.20 3.86 -0.82 0.36 115.15 119.86 2jss h HIS 164 Ca -0.01 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 2jss h HIS 164 Cb 0.59 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.06 2jss h HIS 164 CO 0.13 0.09 -0.01 -0.07 0.86 0.00 0.00 177.93 178.93 2jss h LEU 165 N 0.00 0.00 -0.14 2.43 3.38 -1.46 -1.56 115.31 117.96 2jss h LEU 165 Ca -0.00 -0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 2jss h LEU 165 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2jss h LEU 165 CO 0.01 0.00 -0.44 -0.61 0.09 0.00 0.00 178.44 177.49 2jss h GLN 166 N 0.00 0.54 0.00 1.13 5.75 0.11 0.25 115.11 122.90 2jss h GLN 166 Ca 0.00 -0.40 0.00 0.00 -0.15 0.00 0.00 58.65 58.10 2jss h GLN 166 Cb 0.89 0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.51 2jss h GLN 166 CO 0.00 1.02 -0.08 1.37 -2.65 0.00 0.00 178.83 178.49 2jss h LEU 167 N 0.16 0.00 0.07 -2.39 8.10 -1.37 0.80 115.31 120.68 2jss h LEU 167 Ca -0.02 -0.03 -0.29 0.00 0.11 0.00 0.00 57.88 57.66 2jss h LEU 167 Cb 1.07 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 41.26 2jss h LEU 167 CO 0.09 0.01 -1.52 0.00 -4.11 0.00 0.00 178.44 172.92 2jss h ALA 168 N 2.50 0.42 0.00 0.17 0.00 -1.16 -1.99 119.26 119.20 2jss h ALA 168 Ca 0.00 -1.19 -0.11 0.00 0.00 0.00 0.00 54.91 53.61 2jss h ALA 168 Cb 0.75 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 2jss h ALA 168 CO 0.00 1.28 -0.69 0.82 0.00 0.00 0.00 179.25 180.66 2jss h ILE 169 N 0.04 0.91 -0.18 0.00 2.04 -0.94 -3.31 117.51 116.07 2jss h ILE 169 Ca -0.23 -1.92 -0.00 0.00 1.00 0.00 0.00 64.86 63.71 2jss h ILE 169 Cb 1.98 1.95 -0.01 0.00 -0.74 0.00 0.00 36.82 39.99 2jss h ILE 169 CO 0.13 0.31 0.09 0.03 0.00 0.00 0.00 178.15 178.71 2jss h ARG 170 N -1.00 0.24 0.00 2.37 2.47 -1.02 -3.13 114.38 114.31 2jss h ARG 170 Ca -0.17 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.53 2jss h ARG 170 Cb 0.97 -0.05 0.00 0.00 -1.65 0.00 0.00 29.97 29.24 2jss h ARG 170 CO -0.10 0.18 0.00 0.41 0.56 0.00 0.00 179.97 181.02 2jss n GLY 171 N -1.44 -3.28 3.56 0.04 0.00 -0.75 -3.30 105.19 100.02 2jss n GLY 171 Ca -0.00 0.39 -0.13 0.00 0.00 0.00 0.00 46.02 46.27 2jss n GLY 171 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jss n ASP 172 N -0.93 1.37 -0.08 1.61 8.00 -1.19 -4.68 116.55 120.66 2jss n ASP 172 Ca 0.00 -2.11 0.23 0.00 0.71 0.00 0.00 54.79 53.63 2jss n ASP 172 Cb 0.00 -1.67 0.45 0.00 -0.02 0.00 0.00 41.12 39.88 2jss n ASP 172 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2jss h ASP 173 N 11.96 0.00 0.42 -2.24 5.19 -1.75 0.69 116.42 130.69 2jss h ASP 173 Ca 0.00 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.39 2jss h ASP 173 Cb 1.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.52 2jss h ASP 173 CO 1.01 0.00 -0.20 -0.33 -3.12 0.00 0.00 179.24 176.60 2jss h GLU 174 N 0.00 -0.54 -0.31 3.56 4.39 -1.88 -2.26 114.58 117.53 2jss h GLU 174 Ca 0.37 0.04 0.07 0.00 0.34 0.00 0.00 59.36 60.18 2jss h GLU 174 Cb 2.43 0.12 -0.08 0.00 -0.10 0.00 0.00 28.75 31.13 2jss h GLU 174 CO -0.00 -0.36 -0.27 -0.07 -1.16 0.00 0.00 179.01 177.15 2jss h LEU 175 N -1.09 -0.88 -0.54 1.33 3.38 -1.17 -0.84 115.31 115.50 2jss h LEU 175 Ca -0.06 0.16 0.09 0.00 0.09 0.00 0.00 57.88 58.16 2jss h LEU 175 Cb 0.43 0.42 -0.10 0.00 0.09 0.00 0.00 40.66 41.49 2jss h LEU 175 CO 0.09 -0.29 -0.40 -0.78 0.09 0.00 0.00 178.44 177.15 2jss h ASP 176 N -0.24 -1.37 0.00 -0.43 3.58 -1.42 4.11 116.42 120.65 2jss h ASP 176 Ca 0.16 0.23 0.00 0.00 0.42 0.00 0.00 57.03 57.84 2jss h ASP 176 Cb 0.49 0.63 0.00 0.00 1.72 0.00 0.00 39.33 42.17 2jss h ASP 176 CO -0.45 -0.33 0.00 -1.20 -2.88 0.00 0.00 179.24 174.37 2jss n SER 177 N -5.42 0.00 -0.05 2.28 7.64 -0.53 -1.54 113.62 116.01 2jss n SER 177 Ca 0.02 0.49 -0.05 0.00 1.01 0.00 0.00 58.87 60.34 2jss n SER 177 Cb 0.35 -0.49 -0.07 0.00 -1.01 0.00 0.00 64.21 62.99 2jss n SER 177 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2jss n LEU 178 N -1.49 0.56 -0.04 -3.43 7.94 0.90 -4.81 117.00 116.63 2jss n LEU 178 Ca 0.00 -0.01 -0.01 0.00 -1.11 0.00 0.00 56.01 54.88 2jss n LEU 178 Cb 0.00 0.11 -0.00 0.00 0.53 0.00 0.00 43.42 44.05 2jss n LEU 178 CO 0.00 0.31 -0.07 0.40 -1.11 0.00 0.00 177.39 176.92 2jss h ILE 179 N 0.00 0.00 -4.11 1.96 2.04 0.73 -3.46 117.51 114.67 2jss h ILE 179 Ca -0.25 -0.66 -0.18 0.00 1.00 0.00 0.00 64.86 64.77 2jss h ILE 179 Cb 1.54 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 37.50 2jss h ILE 179 CO 0.00 0.00 -0.26 -2.11 0.00 0.00 0.00 178.15 175.78 2jss n ARG 180 N -3.82 -1.18 0.00 2.37 0.00 -0.59 -4.72 116.66 108.72 2jss n ARG 180 Ca -0.01 0.04 -0.03 0.00 -0.00 0.00 0.00 57.85 57.84 2jss n ARG 180 Cb 0.06 -1.96 -0.02 0.00 -0.00 0.00 0.00 32.46 30.53 2jss n ARG 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2jss h ALA 181 N 1.54 -0.12 -0.29 2.89 0.00 -1.88 -3.48 119.26 117.91 2jss h ALA 181 Ca -0.17 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2jss h ALA 181 Cb 0.53 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2jss h ALA 181 CO 0.26 -0.12 0.00 0.25 0.00 0.00 0.00 179.25 179.64 2jss n THR 182 N -4.85 0.00 -2.53 0.00 -2.24 -1.26 -4.98 114.28 98.42 2jss n THR 182 Ca -0.03 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.66 2jss n THR 182 Cb 0.09 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.31 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 -2.35 0.00 -2.15 2.28 -5.35 -1.26 -4.72 119.36 105.80 2jss n ILE 183 Ca 0.00 0.00 -0.42 0.00 -0.27 0.00 0.00 62.75 62.06 2jss n ILE 183 Cb 0.00 -0.11 0.00 0.00 -1.74 0.00 0.00 39.64 37.80 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 -2.27 5.60 -0.03 -1.28 0.00 -1.26 -4.23 120.51 117.04 2jss n ALA 184 Ca 0.03 -4.19 0.00 0.00 0.00 0.00 0.00 53.44 49.28 2jss n ALA 184 Cb 0.37 -3.08 0.00 0.00 0.00 0.00 0.00 19.45 16.74 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 4.10 0.00 0.00 0.00 3.41 -1.26 -4.88 113.62 114.99 2jss n SER 185 Ca 0.45 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.06 2jss n SER 185 Cb 0.35 0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.64 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 -1.48 -0.14 1.60 5.00 0.00 -1.26 -4.87 105.19 104.05 2jss n GLY 186 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.08 -4.85 0.89 -0.02 0.00 -1.26 -4.37 105.19 94.50 2jss n GLY 187 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.56 2jss n GLY 187 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2jss n VAL 188 N 0.75 0.40 -3.70 1.61 0.24 -1.26 -4.71 118.33 111.66 2jss n VAL 188 Ca 0.00 0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 62.07 2jss n VAL 188 Cb 0.00 -0.64 0.05 0.00 -1.47 0.00 0.00 33.84 31.77 2jss n VAL 188 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2jss n LEU 189 N 0.63 -3.16 0.00 1.34 4.32 -1.26 -5.00 117.00 113.88 2jss n LEU 189 Ca 0.00 -0.74 0.00 0.00 -0.02 0.00 0.00 56.01 55.25 2jss n LEU 189 Cb 0.23 -2.76 0.00 0.00 -1.62 0.00 0.00 43.42 39.27 2jss n LEU 189 CO 0.00 0.45 0.00 -0.81 -1.22 0.00 0.00 177.39 175.81 2jss n PRO 190 N -4.44 2.50 -2.08 3.23 -0.04 -1.26 -5.01 135.00 127.90 2jss n PRO 190 Ca -0.18 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 62.92 2jss n PRO 190 Cb 0.62 0.00 0.02 0.00 -0.04 0.00 0.00 33.50 34.11 2jss n PRO 190 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 2jss s HIS 191 N 0.46 2.49 0.00 0.54 -3.43 -1.26 -5.23 115.29 108.87 2jss s HIS 191 Ca 0.00 1.51 0.00 0.00 -0.80 0.00 0.00 55.06 55.77 2jss s HIS 191 Cb 0.00 -3.46 0.00 0.00 -1.43 0.00 0.00 32.58 27.69 2jss s HIS 191 CO 0.00 -2.06 0.00 -0.89 -2.00 0.00 0.00 174.74 169.79