#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p1c h TRP 44 N 0.00 0.00 -0.00 -1.55 5.08 -2.05 -2.49 115.95 114.94 1p1c h TRP 44 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 1p1c h TRP 44 Cb 0.00 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.16 1p1c h TRP 44 CO 0.00 0.00 -0.27 -0.85 -1.28 0.00 0.00 178.44 176.04 1p1c n GLU 45 N -2.60 0.22 -0.32 0.12 0.00 -1.26 -4.37 120.64 112.42 1p1c n GLU 45 Ca 0.02 -0.09 0.03 0.00 0.00 0.00 0.00 57.16 57.11 1p1c n GLU 45 Cb 0.27 -1.50 0.09 0.00 0.00 0.00 0.00 31.44 30.30 1p1c n GLU 45 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.13 179.54 1p1c n THR 46 N -1.31 -0.41 -0.33 3.84 -1.04 -0.94 0.67 114.28 114.76 1p1c n THR 46 Ca 0.08 2.03 0.06 0.00 -2.04 0.00 0.00 64.05 64.19 1p1c n THR 46 Cb 0.33 -2.75 0.25 0.00 -1.82 0.00 0.00 70.33 66.34 1p1c n THR 46 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 1p1c h PRO 47 N 0.00 0.96 -0.32 -2.82 0.11 -1.84 -0.23 132.00 127.85 1p1c h PRO 47 Ca 0.37 -0.06 -0.11 0.00 0.11 0.00 0.00 66.00 66.31 1p1c h PRO 47 Cb 0.59 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 31.48 1p1c h PRO 47 CO -0.89 0.63 -0.23 -0.92 -0.21 0.00 0.00 178.00 176.38 1p1c h TYR 48 N 0.98 0.85 -0.06 0.65 -0.00 -0.06 -1.33 116.97 118.00 1p1c h TYR 48 Ca 0.46 -0.23 -0.02 0.00 -0.00 0.00 0.00 58.73 58.93 1p1c h TYR 48 Cb 0.41 -0.19 -0.01 0.00 -0.00 0.00 0.00 36.73 36.95 1p1c h TYR 48 CO -0.00 0.97 -0.07 0.52 -0.00 0.00 0.00 178.16 179.57 1p1c h MET 49 N 0.48 0.08 -0.02 1.82 2.86 -0.52 -0.64 114.93 118.99 1p1c h MET 49 Ca 0.06 -0.01 -0.17 0.00 -2.06 0.00 0.00 59.70 57.52 1p1c h MET 49 Cb 0.79 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.42 1p1c h MET 49 CO 0.06 0.16 -0.76 0.45 1.06 0.00 0.00 176.91 177.88 1p1c h HIS 50 N 0.08 0.22 -0.53 -0.22 3.86 -0.74 -1.24 115.15 116.59 1p1c h HIS 50 Ca 0.02 -0.11 -0.07 0.00 -1.16 0.00 0.00 60.37 59.05 1p1c h HIS 50 Cb 0.19 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 28.60 1p1c h HIS 50 CO 0.00 0.86 0.07 1.03 0.86 0.00 0.00 177.93 180.75 1p1c h SER 51 N 0.10 0.86 -0.31 2.45 0.87 0.02 -0.84 113.55 116.71 1p1c h SER 51 Ca -0.02 -0.27 -0.14 0.00 -1.23 0.00 0.00 61.79 60.13 1p1c h SER 51 Cb 1.34 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 63.07 1p1c h SER 51 CO 0.11 0.92 -0.34 -0.07 -0.53 0.00 0.00 176.83 176.92 1p1c h LEU 52 N 0.78 0.84 -1.02 2.23 3.38 -1.36 -1.97 115.31 118.18 1p1c h LEU 52 Ca 0.16 -0.48 -0.01 0.00 0.09 0.00 0.00 57.88 57.63 1p1c h LEU 52 Cb 0.43 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 1p1c h LEU 52 CO 0.01 1.15 0.45 0.00 0.09 0.00 0.00 178.44 180.14 1p1c h ALA 53 N 0.71 1.25 -0.05 1.53 0.00 -1.06 -0.82 119.26 120.83 1p1c h ALA 53 Ca 0.05 -0.12 -0.19 0.00 0.00 0.00 0.00 54.91 54.64 1p1c h ALA 53 Cb 0.93 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 1p1c h ALA 53 CO 0.08 0.61 -0.80 0.00 0.00 0.00 0.00 179.25 179.15 1p1c h ALA 54 N 1.35 0.53 -0.29 0.00 0.00 -1.13 -2.23 119.26 117.50 1p1c h ALA 54 Ca 0.29 -0.64 -0.08 0.00 0.00 0.00 0.00 54.91 54.47 1p1c h ALA 54 Cb 0.02 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1p1c h ALA 54 CO -0.05 0.79 -0.14 0.00 0.00 0.00 0.00 179.25 179.86 1p1c h ALA 55 N 0.89 0.41 0.00 0.00 0.00 -0.91 -0.95 119.26 118.70 1p1c h ALA 55 Ca -0.04 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.49 1p1c h ALA 55 Cb 1.39 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 1p1c h ALA 55 CO 0.13 0.29 -0.28 0.00 0.00 0.00 0.00 179.25 179.39 1p1c h ALA 56 N 0.75 1.08 -0.02 0.00 0.00 -1.20 -2.91 119.26 116.95 1p1c h ALA 56 Ca 0.06 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1p1c h ALA 56 Cb 0.65 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1p1c h ALA 56 CO 0.04 0.35 -0.14 0.00 0.00 0.00 0.00 179.25 179.51 1p1c n ALA 57 N -2.28 2.81 0.26 0.00 0.00 -0.84 -4.30 120.51 116.17 1p1c n ALA 57 Ca -0.00 -0.58 0.03 0.00 0.00 0.00 0.00 53.44 52.89 1p1c n ALA 57 Cb 0.43 -0.94 0.15 0.00 0.00 0.00 0.00 19.45 19.09 1p1c n ALA 57 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1p1c n SER 58 N 0.48 0.00 -0.32 0.00 3.41 -0.38 -0.93 113.62 115.88 1p1c n SER 58 Ca 0.14 0.42 0.07 0.00 -0.26 0.00 0.00 58.87 59.24 1p1c n SER 58 Cb 0.47 -0.45 -0.00 0.00 -0.26 0.00 0.00 64.21 63.98 1p1c n SER 58 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1p1c n ARG 59 N -1.45 1.80 0.00 4.33 5.12 -1.26 -5.08 116.66 120.13 1p1c n ARG 59 Ca 0.02 -0.74 0.00 0.00 -1.93 0.00 0.00 57.85 55.20 1p1c n ARG 59 Cb 0.07 -1.21 0.00 0.00 -1.16 0.00 0.00 32.46 30.16 1p1c n ARG 59 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1p1c n GLY 60 N 1.06 0.90 7.00 -0.13 0.00 -0.11 -4.89 105.19 109.03 1p1c n GLY 60 Ca 0.06 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.27 1p1c n GLY 60 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p1c n GLY 61 N 0.00 1.05 3.52 -0.02 0.00 -1.26 -4.63 105.19 103.85 1p1c n GLY 61 Ca 0.00 -0.73 -0.41 0.00 0.00 0.00 0.00 46.02 44.88 1p1c n GLY 61 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1p1c s ARG 62 N 0.00 3.38 -0.15 1.61 3.52 -1.26 -0.34 118.95 125.71 1p1c s ARG 62 Ca 0.00 -0.63 -0.04 0.00 -0.13 0.00 0.00 55.73 54.92 1p1c s ARG 62 Cb 0.00 -3.86 -0.03 0.00 -1.56 0.00 0.00 34.95 29.50 1p1c s ARG 62 CO 0.00 -0.58 0.00 0.08 -0.81 0.00 0.00 175.30 173.99 1p1c s VAL 63 N 1.89 4.25 -0.19 7.11 1.01 -0.51 -0.52 120.40 133.44 1p1c s VAL 63 Ca 0.09 -0.24 -0.04 0.00 0.00 0.00 0.00 61.98 61.79 1p1c s VAL 63 Cb -0.17 -2.86 -0.02 0.00 0.00 0.00 0.00 36.38 33.32 1p1c s VAL 63 CO 0.11 0.51 -0.02 -0.22 0.00 0.00 0.00 175.10 175.48 1p1c s LEU 64 N 0.09 3.17 -0.16 3.92 2.96 -0.46 -0.78 118.68 127.42 1p1c s LEU 64 Ca 0.02 -0.22 0.01 0.00 -0.22 0.00 0.00 54.13 53.72 1p1c s LEU 64 Cb -0.13 -1.79 0.01 0.00 0.50 0.00 0.00 46.19 44.78 1p1c s LEU 64 CO 0.02 0.09 -0.19 -0.70 -1.32 0.00 0.00 176.35 174.25 1p1c s GLU 65 N 0.86 3.08 -0.50 1.98 2.12 0.14 0.27 118.70 126.65 1p1c s GLU 65 Ca -0.00 -0.81 -0.16 0.00 0.36 0.00 0.00 54.97 54.36 1p1c s GLU 65 Cb -0.14 -2.55 0.09 0.00 0.26 0.00 0.00 34.13 31.78 1p1c s GLU 65 CO 0.02 -0.07 0.47 0.08 -0.54 0.00 0.00 175.26 175.22 1p1c s VAL 66 N 0.98 5.16 0.00 3.70 1.01 -0.15 -0.17 120.40 130.93 1p1c s VAL 66 Ca -0.03 -1.09 0.00 0.00 0.00 0.00 0.00 61.98 60.87 1p1c s VAL 66 Cb -0.15 -4.22 0.00 0.00 0.00 0.00 0.00 36.38 32.01 1p1c s VAL 66 CO -0.05 -0.71 0.00 0.61 0.00 0.00 0.00 175.10 174.95 1p1c n GLY 67 N 5.22 1.13 0.11 4.51 0.00 0.17 -2.79 105.19 113.53 1p1c n GLY 67 Ca -0.12 -0.98 -0.19 0.00 0.00 0.00 0.00 46.02 44.73 1p1c n GLY 67 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1p1c h PHE 68 N 0.00 0.40 0.00 1.61 3.04 -1.87 -3.45 116.94 116.67 1p1c h PHE 68 Ca 0.00 -0.29 0.00 0.00 3.98 0.00 0.00 57.97 61.66 1p1c h PHE 68 Cb 0.00 -0.02 0.00 0.00 2.56 0.00 0.00 35.95 38.49 1p1c h PHE 68 CO 0.00 1.30 0.00 0.41 -2.02 0.00 0.00 178.31 178.00 1p1c n GLY 69 N 1.66 1.62 0.42 2.40 0.00 -1.26 -1.35 105.19 108.68 1p1c n GLY 69 Ca -0.16 0.43 0.06 0.00 0.00 0.00 0.00 46.02 46.35 1p1c n GLY 69 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1p1c n MET 70 N 1.14 2.56 -2.41 1.61 0.00 -1.26 -5.00 117.12 113.77 1p1c n MET 70 Ca 0.00 -2.24 -0.16 0.00 0.00 0.00 0.00 57.70 55.30 1p1c n MET 70 Cb 0.00 -1.40 -0.01 0.00 0.00 0.00 0.00 33.22 31.81 1p1c n MET 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1p1c n ALA 71 N -0.44 -0.70 0.00 3.04 0.00 -0.46 -4.86 120.51 117.09 1p1c n ALA 71 Ca 0.12 0.13 -0.19 0.00 0.00 0.00 0.00 53.44 53.51 1p1c n ALA 71 Cb 0.55 -1.79 -0.09 0.00 0.00 0.00 0.00 19.45 18.13 1p1c n ALA 71 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1p1c h ILE 72 N 0.00 1.28 0.21 0.00 2.04 -1.95 -1.31 117.51 117.79 1p1c h ILE 72 Ca -0.38 -2.07 -0.32 0.00 1.00 0.00 0.00 64.86 63.09 1p1c h ILE 72 Cb 1.28 2.17 0.03 0.00 -0.74 0.00 0.00 36.82 39.55 1p1c h ILE 72 CO 0.45 0.65 -1.39 0.00 0.00 0.00 0.00 178.15 177.86 1p1c h ALA 73 N 0.48 -0.07 -0.69 1.87 0.00 -1.89 -3.10 119.26 115.86 1p1c h ALA 73 Ca -0.08 -0.86 -0.00 0.00 0.00 0.00 0.00 54.91 53.97 1p1c h ALA 73 Cb 1.51 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 19.39 1p1c h ALA 73 CO 0.18 0.77 0.42 0.00 0.00 0.00 0.00 179.25 180.62 1p1c h ALA 74 N 0.30 0.87 -0.38 0.00 0.00 -1.89 -0.16 119.26 118.00 1p1c h ALA 74 Ca -0.21 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.55 1p1c h ALA 74 Cb 2.09 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 19.58 1p1c h ALA 74 CO 0.25 0.34 -0.06 0.77 0.00 0.00 0.00 179.25 180.55 1p1c h SER 75 N 0.93 0.61 -0.16 0.00 0.02 -1.32 -1.50 113.55 112.13 1p1c h SER 75 Ca 0.25 -0.15 -0.16 0.00 -0.84 0.00 0.00 61.79 60.89 1p1c h SER 75 Cb -0.04 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.33 1p1c h SER 75 CO -0.05 0.72 -0.46 -0.09 -1.14 0.00 0.00 176.83 175.81 1p1c h ARG 76 N 0.59 0.72 -0.34 3.45 9.65 -1.34 -2.98 114.38 124.12 1p1c h ARG 76 Ca 0.11 -0.41 -0.00 0.00 -1.10 0.00 0.00 59.98 58.58 1p1c h ARG 76 Cb 0.46 0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 29.06 1p1c h ARG 76 CO 0.02 1.03 0.21 0.28 2.80 0.00 0.00 179.97 184.31 1p1c h VAL 77 N 0.57 1.11 0.00 0.20 2.07 -0.55 -0.74 116.25 118.91 1p1c h VAL 77 Ca 0.03 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.31 1p1c h VAL 77 Cb 1.02 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 31.46 1p1c h VAL 77 CO 0.10 0.11 0.00 0.00 0.02 0.00 0.00 177.57 177.80 1p1c n GLN 78 N -4.82 0.01 -0.16 1.57 1.13 -0.61 -1.10 117.38 113.40 1p1c n GLN 78 Ca -0.01 0.46 0.10 0.00 -1.94 0.00 0.00 57.00 55.62 1p1c n GLN 78 Cb 0.05 -1.54 0.28 0.00 0.11 0.00 0.00 30.24 29.14 1p1c n GLN 78 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 1p1c n GLN 79 N -1.57 2.06 -3.77 -1.09 6.02 -0.29 -4.74 117.38 114.00 1p1c n GLN 79 Ca 0.01 -1.61 -0.21 0.00 -0.01 0.00 0.00 57.00 55.18 1p1c n GLN 79 Cb 0.04 -1.42 -0.03 0.00 1.02 0.00 0.00 30.24 29.85 1p1c n GLN 79 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1p1c s ALA 80 N -1.59 3.91 0.00 -1.58 0.00 -0.26 -4.96 121.76 117.28 1p1c s ALA 80 Ca 0.34 -1.56 0.00 0.00 0.00 0.00 0.00 51.96 50.74 1p1c s ALA 80 Cb 0.19 -1.33 0.00 0.00 0.00 0.00 0.00 23.12 21.98 1p1c s ALA 80 CO 0.27 0.04 0.45 -0.35 0.00 0.00 0.00 175.76 176.16 1p1c n PRO 81 N -1.42 0.43 -0.75 0.00 -0.04 -1.26 -4.82 135.00 127.14 1p1c n PRO 81 Ca -0.02 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.13 1p1c n PRO 81 Cb 0.59 -1.28 0.17 0.00 -0.04 0.00 0.00 33.50 32.94 1p1c n PRO 81 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1p1c s ILE 82 N 0.59 2.22 -0.11 0.52 1.09 -1.26 -4.28 121.20 119.96 1p1c s ILE 82 Ca 0.00 0.07 0.01 0.00 -1.10 0.00 0.00 60.65 59.63 1p1c s ILE 82 Cb 0.00 -2.17 -0.08 0.00 -1.06 0.00 0.00 42.46 39.16 1p1c s ILE 82 CO 0.00 -0.09 -0.09 2.29 -0.10 0.00 0.00 174.94 176.95 1p1c n LYS 83 N -4.25 0.44 -3.94 2.79 2.85 0.53 -4.73 118.16 111.85 1p1c n LYS 83 Ca 0.10 0.06 -0.10 0.00 -1.05 0.00 0.00 58.31 57.32 1p1c n LYS 83 Cb 0.53 -1.22 -0.11 0.00 -0.65 0.00 0.00 35.03 33.58 1p1c n LYS 83 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 1p1c s GLU 84 N -2.22 0.36 -0.26 -1.58 2.02 -0.23 -3.87 118.70 112.91 1p1c s GLU 84 Ca -0.14 -0.52 -0.02 0.00 0.02 0.00 0.00 54.97 54.31 1p1c s GLU 84 Cb 0.04 0.14 0.08 0.00 0.10 0.00 0.00 34.13 34.49 1p1c s GLU 84 CO 0.26 -0.07 0.07 -1.58 0.02 0.00 0.00 175.26 173.96 1p1c s HIS 85 N -1.39 1.41 -0.20 1.61 2.46 0.23 -1.42 115.29 117.99 1p1c s HIS 85 Ca -0.15 -1.37 -0.08 0.00 0.47 0.00 0.00 55.06 53.92 1p1c s HIS 85 Cb -0.09 -1.41 -0.04 0.00 -0.13 0.00 0.00 32.58 30.91 1p1c s HIS 85 CO -0.00 -0.78 0.09 -1.58 -2.47 0.00 0.00 174.74 170.00 1p1c s TRP 86 N 1.72 3.28 -0.05 3.88 0.52 0.04 -0.59 118.94 127.74 1p1c s TRP 86 Ca 0.05 0.11 0.01 0.00 0.02 0.00 0.00 56.10 56.29 1p1c s TRP 86 Cb -0.17 -2.14 0.02 0.00 -1.15 0.00 0.00 33.47 30.03 1p1c s TRP 86 CO -0.19 0.12 -0.05 -1.50 0.02 0.00 0.00 176.95 175.35 1p1c s ILE 87 N 0.59 0.59 -0.07 2.03 1.10 -1.06 0.27 121.20 124.66 1p1c s ILE 87 Ca 0.05 -0.15 -0.15 0.00 -0.51 0.00 0.00 60.65 59.89 1p1c s ILE 87 Cb -0.13 -0.61 -0.05 0.00 0.15 0.00 0.00 42.46 41.82 1p1c s ILE 87 CO 0.01 0.24 0.38 -0.63 -2.11 0.00 0.00 174.94 172.83 1p1c s ILE 88 N 0.91 5.16 -0.09 2.00 1.01 0.75 -1.74 121.20 129.21 1p1c s ILE 88 Ca -0.11 0.75 -0.04 0.00 0.00 0.00 0.00 60.65 61.25 1p1c s ILE 88 Cb -0.14 -3.70 0.04 0.00 0.01 0.00 0.00 42.46 38.67 1p1c s ILE 88 CO 0.00 0.48 0.20 -0.70 0.00 0.00 0.00 174.94 174.92 1p1c s GLU 89 N -0.31 0.16 -0.07 2.79 2.56 -0.57 0.44 118.70 123.71 1p1c s GLU 89 Ca 0.22 0.46 -0.02 0.00 0.00 0.00 0.00 54.97 55.63 1p1c s GLU 89 Cb -0.15 -0.15 -0.26 0.00 2.00 0.00 0.00 34.13 35.57 1p1c s GLU 89 CO 0.10 -0.17 0.58 0.00 -0.56 0.00 0.00 175.26 175.21 1p1c s ASN 91 N -6.82 7.06 0.16 0.00 3.84 -1.26 -4.44 114.94 113.47 1p1c s ASN 91 Ca -0.14 2.36 -0.12 0.00 0.21 0.00 0.00 52.86 55.17 1p1c s ASN 91 Cb 0.07 -2.62 0.04 0.00 -0.55 0.00 0.00 41.25 38.18 1p1c s ASN 91 CO 0.81 -0.35 1.63 -0.78 -2.79 0.00 0.00 177.10 175.62 1p1c h ASP 92 N 4.44 0.89 -0.07 -4.21 3.58 -1.99 -1.24 116.42 117.83 1p1c h ASP 92 Ca -0.46 -0.28 -0.01 0.00 0.42 0.00 0.00 57.03 56.70 1p1c h ASP 92 Cb 1.22 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 42.03 1p1c h ASP 92 CO 0.71 0.95 0.02 1.23 -2.88 0.00 0.00 179.24 179.26 1p1c h GLY 93 N 0.80 0.11 1.34 -0.78 0.00 -2.00 -2.53 103.07 100.02 1p1c h GLY 93 Ca 0.16 -0.07 -0.11 0.00 0.00 0.00 0.00 47.33 47.30 1p1c h GLY 93 CO 0.02 0.07 -0.22 -2.08 0.00 0.00 0.00 176.54 174.32 1p1c h VAL 94 N -0.10 1.27 -0.53 4.60 2.07 -1.95 -2.58 116.25 119.02 1p1c h VAL 94 Ca 0.02 -1.33 -0.01 0.00 0.82 0.00 0.00 66.70 66.21 1p1c h VAL 94 Cb 0.24 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.20 1p1c h VAL 94 CO 0.00 0.44 0.31 0.15 0.02 0.00 0.00 177.57 178.49 1p1c h PHE 95 N 0.66 0.70 -0.63 1.57 3.04 -1.20 0.15 116.94 121.24 1p1c h PHE 95 Ca 0.09 -0.00 -0.03 0.00 3.98 0.00 0.00 57.97 62.01 1p1c h PHE 95 Cb 0.73 -0.23 -0.03 0.00 2.56 0.00 0.00 35.95 38.98 1p1c h PHE 95 CO 0.04 0.48 0.27 1.96 -2.02 0.00 0.00 178.31 179.04 1p1c h GLN 96 N 0.74 0.90 -0.03 1.11 4.20 -1.05 -0.72 115.11 120.26 1p1c h GLN 96 Ca 0.19 -0.13 -0.23 0.00 0.06 0.00 0.00 58.65 58.54 1p1c h GLN 96 Cb -0.00 -0.16 0.01 0.00 0.30 0.00 0.00 27.48 27.62 1p1c h GLN 96 CO -0.03 0.72 -0.92 0.00 -0.67 0.00 0.00 178.83 177.92 1p1c h ARG 97 N 0.89 0.54 -0.25 1.46 3.08 -1.09 -2.90 114.38 116.11 1p1c h ARG 97 Ca 0.22 -0.54 -0.01 0.00 0.07 0.00 0.00 59.98 59.72 1p1c h ARG 97 Cb 0.13 0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 1p1c h ARG 97 CO -0.02 1.17 0.11 1.25 -1.07 0.00 0.00 179.97 181.41 1p1c h LEU 98 N 0.32 0.30 -0.17 3.04 5.85 -0.14 0.11 115.31 124.62 1p1c h LEU 98 Ca -0.08 -0.02 -0.17 0.00 0.84 0.00 0.00 57.88 58.45 1p1c h LEU 98 Cb 1.55 -0.08 0.01 0.00 0.37 0.00 0.00 40.66 42.51 1p1c h LEU 98 CO 0.17 0.27 -0.57 1.56 -0.34 0.00 0.00 178.44 179.53 1p1c h GLN 99 N 0.35 0.69 -0.28 1.25 4.20 -1.06 -1.99 115.11 118.27 1p1c h GLN 99 Ca 0.09 -0.51 -0.13 0.00 0.06 0.00 0.00 58.65 58.16 1p1c h GLN 99 Cb 0.05 0.09 -0.00 0.00 0.30 0.00 0.00 27.48 27.92 1p1c h GLN 99 CO -0.01 1.13 -0.35 -0.97 -0.67 0.00 0.00 178.83 177.96 1p1c h ASN 100 N 0.38 0.79 -0.78 1.46 -1.24 -1.23 -3.21 115.58 111.75 1p1c h ASN 100 Ca -0.02 -0.49 0.00 0.00 0.71 0.00 0.00 56.30 56.50 1p1c h ASN 100 Cb 1.19 -0.22 -0.04 0.00 0.73 0.00 0.00 38.32 39.98 1p1c h ASN 100 CO 0.12 1.13 0.49 -0.25 -1.29 0.00 0.00 177.43 177.63 1p1c h TRP 101 N 0.47 1.00 -0.59 0.67 7.01 -0.83 -2.90 115.95 120.78 1p1c h TRP 101 Ca 0.04 0.01 0.08 0.00 2.11 0.00 0.00 58.89 61.13 1p1c h TRP 101 Cb 0.93 -0.33 -0.07 0.00 -2.10 0.00 0.00 29.16 27.59 1p1c h TRP 101 CO 0.08 0.65 0.24 0.00 -2.79 0.00 0.00 178.44 176.61 1p1c h ALA 102 N 1.27 0.76 -0.04 2.65 0.00 -1.36 -1.72 119.26 120.83 1p1c h ALA 102 Ca 0.28 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.27 1p1c h ALA 102 Cb -0.08 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1p1c h ALA 102 CO -0.06 -0.16 0.22 -0.07 0.00 0.00 0.00 179.25 179.17 1p1c h LEU 103 N 0.44 0.00 -2.11 0.00 -0.00 -1.51 -0.94 115.31 111.19 1p1c h LEU 103 Ca 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.17 1p1c h LEU 103 Cb 0.33 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.99 1p1c h LEU 103 CO -0.27 0.00 0.00 0.29 -0.00 0.00 0.00 178.44 178.46 1p1c n LYS 104 N -3.09 1.92 -2.66 1.13 5.02 -0.65 -5.01 118.16 114.82 1p1c n LYS 104 Ca -0.02 -1.83 -0.32 0.00 -2.02 0.00 0.00 58.31 54.12 1p1c n LYS 104 Cb 0.28 -1.36 -0.04 0.00 -0.02 0.00 0.00 35.03 33.89 1p1c n LYS 104 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1p1c s GLN 105 N -1.26 3.97 0.08 1.97 -1.52 -0.36 -5.00 119.66 117.54 1p1c s GLN 105 Ca 0.26 0.85 -0.12 0.00 -1.95 0.00 0.00 55.36 54.39 1p1c s GLN 105 Cb 0.16 -2.23 -0.21 0.00 -0.22 0.00 0.00 33.01 30.51 1p1c s GLN 105 CO 0.22 -0.13 1.21 -1.00 -0.25 0.00 0.00 175.29 175.35 1p1c h PRO 106 N 1.32 0.66 -5.84 2.91 0.13 -1.88 -3.45 132.00 125.85 1p1c h PRO 106 Ca -0.47 -0.71 -0.64 0.00 -0.87 0.00 0.00 66.00 63.30 1p1c h PRO 106 Cb 1.18 0.20 -0.06 0.00 0.13 0.00 0.00 31.00 32.45 1p1c h PRO 106 CO 0.62 1.29 -0.51 -1.01 -0.23 0.00 0.00 178.00 178.17 1p1c s HIS 107 N -3.32 3.50 0.12 1.56 3.76 -1.26 -5.05 115.29 114.60 1p1c s HIS 107 Ca -0.09 0.33 -0.34 0.00 -0.15 0.00 0.00 55.06 54.81 1p1c s HIS 107 Cb 0.07 -1.81 -0.14 0.00 1.11 0.00 0.00 32.58 31.81 1p1c s HIS 107 CO 0.91 0.63 1.59 1.17 -0.85 0.00 0.00 174.74 178.19 1p1c n LYS 108 N 1.02 2.03 -4.81 1.40 0.00 -1.25 -4.73 118.16 111.82 1p1c n LYS 108 Ca -0.12 0.74 -0.27 0.00 0.00 0.00 0.00 58.31 58.66 1p1c n LYS 108 Cb 0.53 -2.50 -0.17 0.00 0.00 0.00 0.00 35.03 32.89 1p1c n LYS 108 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 1p1c s VAL 109 N 1.26 1.45 -0.34 3.15 -7.23 -1.25 0.77 120.40 118.21 1p1c s VAL 109 Ca 0.81 -0.68 -0.03 0.00 -1.81 0.00 0.00 61.98 60.28 1p1c s VAL 109 Cb -0.71 -1.28 0.07 0.00 0.56 0.00 0.00 36.38 35.01 1p1c s VAL 109 CO 0.41 0.42 0.07 0.68 -0.31 0.00 0.00 175.10 176.37 1p1c s VAL 110 N 0.42 3.19 0.12 1.32 -7.23 0.24 -4.93 120.40 113.53 1p1c s VAL 110 Ca -0.13 -1.54 -0.30 0.00 -1.81 0.00 0.00 61.98 58.20 1p1c s VAL 110 Cb -0.15 -2.94 -0.06 0.00 0.56 0.00 0.00 36.38 33.79 1p1c s VAL 110 CO 0.05 -0.29 1.02 -2.16 -0.31 0.00 0.00 175.10 173.41 1p1c s PRO 111 N 1.24 4.63 -0.12 4.82 0.04 -1.26 -2.55 135.00 141.80 1p1c s PRO 111 Ca -0.01 1.55 0.02 0.00 0.04 0.00 0.00 61.00 62.61 1p1c s PRO 111 Cb -0.21 -3.35 0.01 0.00 0.04 0.00 0.00 34.50 30.99 1p1c s PRO 111 CO -0.01 0.11 -0.19 -0.51 0.04 0.00 0.00 177.00 176.44 1p1c s LEU 112 N 0.08 1.93 -0.18 -3.56 1.02 -0.71 -4.96 118.68 112.30 1p1c s LEU 112 Ca 0.49 -0.52 -0.10 0.00 0.02 0.00 0.00 54.13 54.01 1p1c s LEU 112 Cb -0.25 -1.28 -0.05 0.00 0.02 0.00 0.00 46.19 44.63 1p1c s LEU 112 CO 0.31 0.05 0.17 -0.75 0.02 0.00 0.00 176.35 176.15 1p1c s LYS 113 N 0.88 4.08 0.00 1.70 2.20 -1.26 -1.51 119.74 125.83 1p1c s LYS 113 Ca -0.07 -0.13 0.00 0.00 -0.36 0.00 0.00 55.97 55.41 1p1c s LYS 113 Cb -0.15 -3.38 0.00 0.00 -1.51 0.00 0.00 37.83 32.79 1p1c s LYS 113 CO -0.02 0.37 0.00 0.41 -0.36 0.00 0.00 175.35 175.76 1p1c n GLY 114 N 3.21 1.08 3.80 5.54 0.00 0.77 -4.91 105.19 114.68 1p1c n GLY 114 Ca -0.16 -2.06 -0.34 0.00 0.00 0.00 0.00 46.02 43.47 1p1c n GLY 114 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1p1c s LEU 115 N 0.00 3.75 0.43 0.99 1.43 -1.26 -2.50 118.68 121.51 1p1c s LEU 115 Ca 0.00 1.91 0.19 0.00 -1.03 0.00 0.00 54.13 55.21 1p1c s LEU 115 Cb 0.00 -4.55 0.96 0.00 0.03 0.00 0.00 46.19 42.63 1p1c s LEU 115 CO 0.00 -0.91 1.89 4.11 0.23 0.00 0.00 176.35 181.67 1p1c h TRP 116 N 1.24 0.00 0.00 0.29 5.08 -1.95 -0.12 115.95 120.49 1p1c h TRP 116 Ca -0.49 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.48 1p1c h TRP 116 Cb 1.22 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.38 1p1c h TRP 116 CO 0.57 0.28 -0.01 0.93 -1.28 0.00 0.00 178.44 178.92 1p1c h GLU 117 N 0.00 0.00 0.00 0.12 3.07 -2.00 0.46 114.58 116.23 1p1c h GLU 117 Ca -0.00 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 58.65 1p1c h GLU 117 Cb 0.60 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.47 1p1c h GLU 117 CO 0.04 0.01 -1.84 0.39 -1.40 0.00 0.00 179.01 176.21 1p1c n GLU 118 N -4.16 1.83 -0.01 2.33 1.02 -0.81 -4.61 120.64 116.23 1p1c n GLU 118 Ca -0.03 -0.02 -0.18 0.00 -0.02 0.00 0.00 57.16 56.92 1p1c n GLU 118 Cb 0.10 -1.32 -0.14 0.00 -0.02 0.00 0.00 31.44 30.06 1p1c n GLU 118 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1p1c h VAL 119 N 0.00 1.55 -0.79 2.62 2.07 -0.89 -3.38 116.25 117.44 1p1c h VAL 119 Ca -0.31 -2.44 0.16 0.00 0.82 0.00 0.00 66.70 64.93 1p1c h VAL 119 Cb 1.69 3.19 -0.11 0.00 -1.52 0.00 0.00 31.29 34.54 1p1c h VAL 119 CO 0.02 0.66 0.31 0.00 0.02 0.00 0.00 177.57 178.57 1p1c h ALA 120 N 0.01 1.14 0.00 1.67 0.00 -1.12 0.33 119.26 121.29 1p1c h ALA 120 Ca -0.11 0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1p1c h ALA 120 Cb 1.39 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.31 1p1c h ALA 120 CO 0.07 -0.26 0.16 -1.35 0.00 0.00 0.00 179.25 177.88 1p1c h PRO 121 N 0.41 0.00 0.00 0.00 0.11 -1.75 -0.10 132.00 130.67 1p1c h PRO 121 Ca 0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.56 1p1c h PRO 121 Cb 0.75 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.86 1p1c h PRO 121 CO -0.45 0.00 -0.36 1.79 -0.21 0.00 0.00 178.00 178.76 1p1c h THR 122 N 0.00 0.00 -3.49 -1.15 1.35 -1.15 -3.46 112.91 105.02 1p1c h THR 122 Ca 0.00 -0.75 -0.53 0.00 -0.55 0.00 0.00 66.41 64.58 1p1c h THR 122 Cb 0.33 1.54 -0.03 0.00 -1.73 0.00 0.00 68.15 68.26 1p1c h THR 122 CO 0.00 0.00 0.16 -0.76 -0.25 0.00 0.00 175.52 174.67 1p1c s LEU 123 N -5.14 4.57 0.58 3.87 1.02 -0.05 -5.06 118.68 118.48 1p1c s LEU 123 Ca 0.06 1.60 -0.14 0.00 0.02 0.00 0.00 54.13 55.67 1p1c s LEU 123 Cb 0.10 -3.26 -0.05 0.00 0.02 0.00 0.00 46.19 43.00 1p1c s LEU 123 CO 0.69 0.19 1.02 -2.16 0.02 0.00 0.00 176.35 176.11 1p1c s PRO 124 N -1.01 3.61 0.77 1.29 0.04 -1.26 -5.02 135.00 133.42 1p1c s PRO 124 Ca 0.36 0.94 -0.15 0.00 0.04 0.00 0.00 61.00 62.19 1p1c s PRO 124 Cb -0.23 -2.08 0.05 0.00 0.04 0.00 0.00 34.50 32.28 1p1c s PRO 124 CO 0.25 -0.56 1.19 -0.25 0.04 0.00 0.00 177.00 177.67 1p1c n ASP 125 N -2.18 1.15 -4.25 6.66 10.43 -1.26 -3.18 116.55 123.92 1p1c n ASP 125 Ca 0.07 0.65 -0.33 0.00 2.57 0.00 0.00 54.79 57.74 1p1c n ASP 125 Cb 0.54 -1.50 -0.06 0.00 1.84 0.00 0.00 41.12 41.94 1p1c n ASP 125 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1p1c n GLY 126 N 0.70 -0.29 0.02 0.44 0.00 0.50 -4.85 105.19 101.71 1p1c n GLY 126 Ca 0.14 0.14 0.11 0.00 0.00 0.00 0.00 46.02 46.41 1p1c n GLY 126 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1p1c n HIS 127 N -4.38 0.11 -4.72 1.61 -0.00 -0.86 -4.58 115.22 102.40 1p1c n HIS 127 Ca -0.13 0.03 -0.29 0.00 0.46 0.00 0.00 57.72 57.79 1p1c n HIS 127 Cb 0.59 -0.42 -0.14 0.00 -0.12 0.00 0.00 29.99 29.90 1p1c n HIS 127 CO 0.00 0.00 0.00 -0.06 0.46 0.00 0.00 176.34 176.74 1p1c s PHE 128 N -3.35 2.26 -0.01 1.57 0.08 -0.51 -4.79 117.98 113.24 1p1c s PHE 128 Ca -0.02 -0.40 0.11 0.00 0.12 0.00 0.00 56.93 56.74 1p1c s PHE 128 Cb 0.14 -1.31 -0.14 0.00 -0.57 0.00 0.00 43.02 41.14 1p1c s PHE 128 CO 0.88 0.19 1.13 -0.44 -0.10 0.00 0.00 175.22 176.87 1p1c h ASP 129 N 4.51 0.00 -5.04 1.36 5.19 -1.08 -0.77 116.42 120.59 1p1c h ASP 129 Ca -0.47 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 55.87 1p1c h ASP 129 Cb 1.15 0.00 -0.16 0.00 0.18 0.00 0.00 39.33 40.51 1p1c h ASP 129 CO 0.42 0.84 -0.06 -0.83 -3.12 0.00 0.00 179.24 176.49 1p1c s GLY 130 N -4.75 -0.32 -0.02 2.75 0.00 -1.18 -0.26 107.32 103.55 1p1c s GLY 130 Ca -0.00 0.30 0.00 0.00 0.00 0.00 0.00 44.72 45.02 1p1c s GLY 130 CO 0.80 0.03 0.02 -0.42 0.00 0.00 0.00 173.10 173.53 1p1c s ILE 131 N -2.80 -0.02 -0.22 0.90 1.01 0.30 -1.36 121.20 119.01 1p1c s ILE 131 Ca -0.03 0.14 0.02 0.00 0.00 0.00 0.00 60.65 60.78 1p1c s ILE 131 Cb -0.00 -0.08 0.04 0.00 0.01 0.00 0.00 42.46 42.43 1p1c s ILE 131 CO -0.05 0.07 -0.13 -0.22 0.00 0.00 0.00 174.94 174.61 1p1c s LEU 132 N 0.77 2.78 -0.45 2.97 2.96 0.14 -1.81 118.68 126.04 1p1c s LEU 132 Ca -0.07 -1.06 -0.07 0.00 -0.22 0.00 0.00 54.13 52.72 1p1c s LEU 132 Cb -0.09 -1.45 0.12 0.00 0.50 0.00 0.00 46.19 45.26 1p1c s LEU 132 CO -0.02 -0.13 0.29 -0.47 -1.32 0.00 0.00 176.35 174.71 1p1c s TYR 133 N 1.23 3.49 -0.43 5.38 6.14 -0.94 -0.97 117.35 131.25 1p1c s TYR 133 Ca -0.03 -2.07 0.02 0.00 0.64 0.00 0.00 57.07 55.63 1p1c s TYR 133 Cb -0.17 -3.39 0.13 0.00 0.42 0.00 0.00 41.96 38.95 1p1c s TYR 133 CO -0.08 -0.98 0.21 0.34 0.64 0.00 0.00 175.55 175.68 1p1c s ASP 134 N 2.35 3.83 0.36 4.32 2.15 -1.12 -2.20 116.67 126.36 1p1c s ASP 134 Ca 0.07 -2.52 0.06 0.00 0.43 0.00 0.00 52.55 50.59 1p1c s ASP 134 Cb -0.25 -1.11 -0.07 0.00 -0.30 0.00 0.00 42.92 41.19 1p1c s ASP 134 CO -0.02 -0.29 0.02 -0.89 -0.17 0.00 0.00 175.17 173.82 1p1c s THR 135 N 0.47 1.62 0.12 1.71 2.01 -1.26 -4.45 115.64 115.87 1p1c s THR 135 Ca 0.16 -2.02 0.04 0.00 0.31 0.00 0.00 61.69 60.18 1p1c s THR 135 Cb -0.24 -2.84 -0.04 0.00 0.01 0.00 0.00 72.50 69.39 1p1c s THR 135 CO -0.03 -0.04 0.09 -0.72 -0.69 0.00 0.00 174.62 173.23 1p1c s TYR 136 N -2.99 3.14 0.38 4.92 -0.00 -1.26 -4.88 117.35 116.66 1p1c s TYR 136 Ca 0.35 0.02 -0.21 0.00 -0.00 0.00 0.00 57.07 57.23 1p1c s TYR 136 Cb 0.09 -1.56 -0.10 0.00 -0.00 0.00 0.00 41.96 40.39 1p1c s TYR 136 CO 0.16 0.52 0.91 -1.25 -0.00 0.00 0.00 175.55 175.88 1p1c s PRO 137 N -2.72 4.26 0.05 -3.49 0.05 -1.26 -5.03 135.00 126.87 1p1c s PRO 137 Ca 0.30 1.08 -0.02 0.00 0.05 0.00 0.00 61.00 62.40 1p1c s PRO 137 Cb -0.11 -2.37 -0.01 0.00 0.05 0.00 0.00 34.50 32.06 1p1c s PRO 137 CO 0.22 0.08 -0.04 1.28 0.05 0.00 0.00 177.00 178.59 1p1c n LEU 138 N -0.31 1.08 -4.93 -3.56 7.99 -1.26 -5.08 117.00 110.93 1p1c n LEU 138 Ca 0.05 0.14 -0.26 0.00 -0.01 0.00 0.00 56.01 55.94 1p1c n LEU 138 Cb 0.53 -0.35 -0.03 0.00 -0.11 0.00 0.00 43.42 43.46 1p1c n LEU 138 CO 0.39 -0.59 -0.11 -0.94 -1.51 0.00 0.00 177.39 174.63 1p1c s SER 139 N -5.89 6.26 0.00 -1.43 1.04 -1.26 -5.00 113.70 107.42 1p1c s SER 139 Ca -0.04 0.14 0.13 0.00 0.48 0.00 0.00 55.95 56.67 1p1c s SER 139 Cb 0.01 -1.86 0.67 0.00 0.10 0.00 0.00 66.02 64.93 1p1c s SER 139 CO 0.05 0.05 1.35 -1.84 0.98 0.00 0.00 173.24 173.83 1p1c n GLU 140 N -0.54 0.18 0.09 4.02 0.00 -1.26 -1.94 120.64 121.19 1p1c n GLU 140 Ca -0.07 0.16 -0.17 0.00 0.00 0.00 0.00 57.16 57.08 1p1c n GLU 140 Cb 0.54 -1.50 -0.14 0.00 0.00 0.00 0.00 31.44 30.34 1p1c n GLU 140 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.13 178.18 1p1c h GLU 141 N 0.00 0.29 -0.01 3.44 9.09 -2.05 -3.36 114.58 121.99 1p1c h GLU 141 Ca 0.00 -0.49 -0.00 0.00 0.05 0.00 0.00 59.36 58.92 1p1c h GLU 141 Cb 0.13 0.18 -0.00 0.00 -1.65 0.00 0.00 28.75 27.41 1p1c h GLU 141 CO 0.00 1.19 -0.08 0.25 0.05 0.00 0.00 179.01 180.42 1p1c n THR 142 N -3.51 1.95 -0.07 -1.06 -2.24 -1.16 -4.85 114.28 103.34 1p1c n THR 142 Ca -0.13 -2.43 -0.10 0.00 -2.27 0.00 0.00 64.05 59.12 1p1c n THR 142 Cb 1.04 -0.24 -0.04 0.00 -2.10 0.00 0.00 70.33 68.99 1p1c n THR 142 CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 175.07 174.25 1p1c h TRP 143 N 0.19 -1.07 -0.09 4.78 2.91 -1.54 0.53 115.95 121.67 1p1c h TRP 143 Ca 0.00 0.06 0.00 0.00 1.13 0.00 0.00 58.89 60.08 1p1c h TRP 143 Cb 1.01 0.51 0.00 0.00 -0.51 0.00 0.00 29.16 30.17 1p1c h TRP 143 CO 0.14 -0.42 0.00 0.72 -1.03 0.00 0.00 178.44 177.84 1p1c n HIS 144 N -5.42 0.09 -0.17 2.65 8.25 -1.26 -4.42 115.22 114.94 1p1c n HIS 144 Ca -0.01 -0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.40 1p1c n HIS 144 Cb 0.35 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.46 1p1c n HIS 144 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1p1c n THR 145 N 0.98 0.00 -0.39 1.59 -2.24 -1.00 -4.80 114.28 108.42 1p1c n THR 145 Ca 0.16 -0.32 0.31 0.00 -2.27 0.00 0.00 64.05 61.93 1p1c n THR 145 Cb 0.52 1.17 0.59 0.00 -2.10 0.00 0.00 70.33 70.50 1p1c n THR 145 CO 0.00 0.00 0.00 1.12 -0.57 0.00 0.00 175.07 175.62 1p1c h HIS 146 N 0.00 0.59 0.00 4.78 2.07 -0.15 0.45 115.15 122.89 1p1c h HIS 146 Ca 0.00 0.02 -0.04 0.00 -2.85 0.00 0.00 60.37 57.50 1p1c h HIS 146 Cb 0.08 -0.16 -0.01 0.00 2.57 0.00 0.00 27.41 29.90 1p1c h HIS 146 CO 0.00 -0.12 -0.20 -0.56 -3.07 0.00 0.00 177.93 173.98 1p1c h GLN 147 N 0.20 0.00 0.00 5.12 -0.00 -1.87 -2.34 115.11 116.22 1p1c h GLN 147 Ca 0.74 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.39 1p1c h GLN 147 Cb 2.15 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 29.63 1p1c h GLN 147 CO -0.39 0.20 0.00 0.74 -0.00 0.00 0.00 178.83 179.38 1p1c h PHE 148 N 0.00 0.00 -0.09 0.06 0.05 -0.46 -1.13 116.94 115.37 1p1c h PHE 148 Ca -0.00 0.00 -0.19 0.00 3.82 0.00 0.00 57.97 61.60 1p1c h PHE 148 Cb 0.38 0.00 0.01 0.00 2.00 0.00 0.00 35.95 38.34 1p1c h PHE 148 CO 0.00 0.00 -0.70 -0.91 -0.18 0.00 0.00 178.31 176.52 1p1c h ASN 149 N 0.00 0.77 -0.28 2.17 2.35 -1.44 0.40 115.58 119.56 1p1c h ASN 149 Ca 0.00 -0.67 -0.15 0.00 -0.55 0.00 0.00 56.30 54.94 1p1c h ASN 149 Cb 0.65 -0.23 -0.00 0.00 0.05 0.00 0.00 38.32 38.79 1p1c h ASN 149 CO 0.00 1.32 -0.40 0.15 -1.65 0.00 0.00 177.43 176.85 1p1c h PHE 150 N 0.27 0.93 -0.22 1.19 3.57 -1.50 -1.48 116.94 119.70 1p1c h PHE 150 Ca -0.06 -0.31 -0.06 0.00 3.53 0.00 0.00 57.97 61.07 1p1c h PHE 150 Cb 1.35 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.90 1p1c h PHE 150 CO 0.11 1.09 -0.10 0.82 -2.23 0.00 0.00 178.31 178.00 1p1c h ILE 151 N 0.50 1.30 -0.25 1.41 2.04 -1.22 1.27 117.51 122.55 1p1c h ILE 151 Ca 0.03 -1.15 -0.11 0.00 1.00 0.00 0.00 64.86 64.63 1p1c h ILE 151 Cb 0.99 1.58 -0.00 0.00 -0.74 0.00 0.00 36.82 38.65 1p1c h ILE 151 CO 0.09 0.35 -0.26 0.11 0.00 0.00 0.00 178.15 178.44 1p1c h LYS 152 N 0.17 0.62 0.21 2.37 1.57 -0.98 -2.60 116.57 117.94 1p1c h LYS 152 Ca 0.05 -0.33 -0.32 0.00 -1.87 0.00 0.00 60.65 58.18 1p1c h LYS 152 Cb 0.58 0.01 0.03 0.00 0.08 0.00 0.00 32.23 32.93 1p1c h LYS 152 CO 0.03 0.93 -1.43 1.15 -0.57 0.00 0.00 179.45 179.57 1p1c h THR 153 N 0.34 1.33 0.00 -0.16 2.02 -1.28 -3.44 112.91 111.71 1p1c h THR 153 Ca 0.04 -2.81 -0.04 0.00 0.77 0.00 0.00 66.41 64.37 1p1c h THR 153 Cb 0.83 3.00 -0.01 0.00 -1.74 0.00 0.00 68.15 70.23 1p1c h THR 153 CO 0.06 0.84 -1.15 1.41 0.37 0.00 0.00 175.52 177.05 1p1c n HIS 154 N -3.65 0.00 -0.09 3.16 8.25 0.42 -4.75 115.22 118.56 1p1c n HIS 154 Ca -0.15 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.25 1p1c n HIS 154 Cb 1.08 -0.10 -0.00 0.00 1.12 0.00 0.00 29.99 32.09 1p1c n HIS 154 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1p1c h ALA 155 N -0.05 0.23 -0.07 -1.41 0.00 -0.93 0.25 119.26 117.28 1p1c h ALA 155 Ca -0.06 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1p1c h ALA 155 Cb 1.07 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1p1c h ALA 155 CO -0.03 -0.45 0.00 0.34 0.00 0.00 0.00 179.25 179.12 1p1c n PHE 156 N -5.23 0.00 -0.17 0.00 -0.00 -0.99 -2.02 117.46 109.04 1p1c n PHE 156 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 57.45 57.43 1p1c n PHE 156 Cb 0.17 -0.49 0.04 0.00 -0.00 0.00 0.00 39.48 39.21 1p1c n PHE 156 CO 0.00 0.00 0.00 0.07 -0.00 0.00 0.00 176.76 176.83 1p1c h ARG 157 N 0.00 -0.02 0.00 -4.13 0.11 -1.85 -1.50 114.38 106.99 1p1c h ARG 157 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1p1c h ARG 157 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 1p1c h ARG 157 CO 0.00 -0.01 0.00 1.28 0.10 0.00 0.00 179.97 181.34 1p1c n LEU 158 N -5.39 0.00 -4.74 0.08 4.32 0.07 -0.37 117.00 110.97 1p1c n LEU 158 Ca 0.05 0.44 -0.38 0.00 -0.02 0.00 0.00 56.01 56.10 1p1c n LEU 158 Cb 0.29 -0.44 -0.06 0.00 -1.62 0.00 0.00 43.42 41.59 1p1c n LEU 158 CO 0.08 -0.31 0.15 -0.76 -1.22 0.00 0.00 177.39 175.33 1p1c s LEU 159 N -2.87 4.32 0.54 2.23 1.43 -0.57 -1.42 118.68 122.34 1p1c s LEU 159 Ca 0.05 0.83 -0.17 0.00 -1.03 0.00 0.00 54.13 53.81 1p1c s LEU 159 Cb 0.05 -2.66 -0.06 0.00 0.03 0.00 0.00 46.19 43.56 1p1c s LEU 159 CO 0.14 0.07 1.02 -0.54 0.23 0.00 0.00 176.35 177.27 1p1c s LYS 160 N 0.26 3.69 0.24 1.70 1.02 -0.30 -4.33 119.74 122.04 1p1c s LYS 160 Ca 0.25 1.09 -0.31 0.00 0.02 0.00 0.00 55.97 57.02 1p1c s LYS 160 Cb -0.15 -2.09 -0.14 0.00 -0.52 0.00 0.00 37.83 34.93 1p1c s LYS 160 CO 0.11 -0.49 1.28 -2.30 -0.92 0.00 0.00 175.35 173.03 1p1c n PRO 161 N -1.70 1.76 0.00 -1.68 -0.02 -1.26 0.10 135.00 132.20 1p1c n PRO 161 Ca 0.08 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 1p1c n PRO 161 Cb 0.53 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 1p1c n PRO 161 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1p1c n GLY 162 N 1.82 2.82 3.60 -1.23 0.00 0.79 -4.98 105.19 108.01 1p1c n GLY 162 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 1p1c n GLY 162 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p1c n GLY 163 N -2.00 -0.43 3.48 -0.02 0.00 0.28 -4.50 105.19 102.00 1p1c n GLY 163 Ca 0.00 -0.20 -0.33 0.00 0.00 0.00 0.00 46.02 45.49 1p1c n GLY 163 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1p1c s ILE 164 N -1.60 3.50 -0.11 -0.61 1.10 0.64 0.37 121.20 124.49 1p1c s ILE 164 Ca 0.75 -0.52 0.03 0.00 -0.51 0.00 0.00 60.65 60.41 1p1c s ILE 164 Cb -0.40 -2.47 0.00 0.00 0.15 0.00 0.00 42.46 39.74 1p1c s ILE 164 CO 0.48 0.54 -0.23 -0.22 -2.11 0.00 0.00 174.94 173.40 1p1c s LEU 165 N -0.06 2.14 0.15 8.50 2.96 0.16 -0.54 118.68 131.99 1p1c s LEU 165 Ca -0.00 -0.55 0.04 0.00 -0.22 0.00 0.00 54.13 53.39 1p1c s LEU 165 Cb -0.14 -1.43 -0.04 0.00 0.50 0.00 0.00 46.19 45.08 1p1c s LEU 165 CO 0.03 0.15 -0.08 0.28 -1.32 0.00 0.00 176.35 175.40 1p1c s THR 166 N 0.43 1.08 0.07 3.68 -1.32 -0.75 -1.63 115.64 117.20 1p1c s THR 166 Ca -0.16 -2.04 -0.26 0.00 -1.21 0.00 0.00 61.69 58.02 1p1c s THR 166 Cb -0.17 -1.89 0.09 0.00 -1.51 0.00 0.00 72.50 69.01 1p1c s THR 166 CO 0.07 -0.71 1.18 -0.72 -2.21 0.00 0.00 174.62 172.23 1p1c s TYR 167 N -3.38 0.04 -0.12 9.09 1.13 -1.26 -2.21 117.35 120.63 1p1c s TYR 167 Ca 0.18 -0.29 -0.30 0.00 -1.41 0.00 0.00 57.07 55.25 1p1c s TYR 167 Cb 0.03 0.62 0.12 0.00 -1.10 0.00 0.00 41.96 41.63 1p1c s TYR 167 CO 0.01 -0.56 0.96 0.00 -2.51 0.00 0.00 175.55 173.45 1p1c s ASN 169 N -1.42 2.63 0.28 0.00 3.84 -1.26 -4.43 114.94 114.58 1p1c s ASN 169 Ca -0.01 -2.85 0.09 0.00 0.21 0.00 0.00 52.86 50.31 1p1c s ASN 169 Cb -0.01 -0.67 0.39 0.00 -0.55 0.00 0.00 41.25 40.41 1p1c s ASN 169 CO -0.00 -0.21 1.64 -0.07 -2.79 0.00 0.00 177.10 175.66 1p1c h LEU 170 N 6.17 0.07 -1.35 3.21 4.07 -1.98 0.55 115.31 126.05 1p1c h LEU 170 Ca 0.15 -0.04 -0.03 0.00 0.08 0.00 0.00 57.88 58.04 1p1c h LEU 170 Cb 0.91 -0.02 -0.02 0.00 1.08 0.00 0.00 40.66 42.61 1p1c h LEU 170 CO 0.40 0.62 0.07 0.74 -1.08 0.00 0.00 178.44 179.20 1p1c h THR 171 N 0.05 1.17 0.00 0.22 2.02 -1.94 0.11 112.91 114.53 1p1c h THR 171 Ca -0.00 -0.60 -0.03 0.00 0.77 0.00 0.00 66.41 66.54 1p1c h THR 171 Cb 1.02 0.83 -0.00 0.00 -1.74 0.00 0.00 68.15 68.26 1p1c h THR 171 CO 0.08 0.22 -0.15 -1.28 0.37 0.00 0.00 175.52 174.75 1p1c h SER 172 N 0.50 0.00 -0.75 4.18 0.87 -1.80 -3.31 113.55 113.24 1p1c h SER 172 Ca 0.12 -0.91 -0.01 0.00 -1.23 0.00 0.00 61.79 59.75 1p1c h SER 172 Cb 0.21 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.14 1p1c h SER 172 CO -0.00 1.05 0.42 -0.50 -0.53 0.00 0.00 176.83 177.27 1p1c h TRP 173 N -1.00 1.02 -0.13 2.24 6.55 -0.79 -1.51 115.95 122.32 1p1c h TRP 173 Ca -0.04 -0.02 0.04 0.00 0.95 0.00 0.00 58.89 59.82 1p1c h TRP 173 Cb 1.01 -0.33 -0.01 0.00 -0.86 0.00 0.00 29.16 28.98 1p1c h TRP 173 CO 0.25 0.70 0.09 0.78 -1.05 0.00 0.00 178.44 179.22 1p1c h GLY 174 N 1.03 0.00 1.16 1.49 0.00 -0.93 0.24 103.07 106.07 1p1c h GLY 174 Ca 0.27 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 47.25 1p1c h GLY 174 CO -0.05 0.00 -1.57 -2.09 0.00 0.00 0.00 176.54 172.84 1p1c h GLU 175 N 0.00 0.51 -0.18 4.80 4.81 -1.45 -3.12 114.58 119.94 1p1c h GLU 175 Ca 0.06 -0.87 -0.11 0.00 -0.13 0.00 0.00 59.36 58.32 1p1c h GLU 175 Cb 0.25 0.32 -0.01 0.00 0.63 0.00 0.00 28.75 29.94 1p1c h GLU 175 CO -0.00 1.41 -0.37 -0.07 -0.73 0.00 0.00 179.01 179.26 1p1c h LEU 176 N 0.14 0.41 -0.24 1.64 3.38 -0.63 -2.70 115.31 117.31 1p1c h LEU 176 Ca -0.28 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.52 1p1c h LEU 176 Cb 2.16 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.79 1p1c h LEU 176 CO 0.25 0.75 0.00 0.23 0.09 0.00 0.00 178.44 179.76 1p1c n MET 177 N -4.05 0.24 0.25 1.13 2.81 0.80 -2.19 117.12 116.10 1p1c n MET 177 Ca -0.01 0.28 -0.10 0.00 -1.81 0.00 0.00 57.70 56.06 1p1c n MET 177 Cb 0.47 -1.83 -0.05 0.00 -0.71 0.00 0.00 33.22 31.10 1p1c n MET 177 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 1p1c h LYS 178 N 0.00 -0.62 0.00 0.03 1.63 -1.41 -3.42 116.57 112.78 1p1c h LYS 178 Ca 0.00 0.04 -0.04 0.00 -0.85 0.00 0.00 60.65 59.80 1p1c h LYS 178 Cb 0.61 0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 32.37 1p1c h LYS 178 CO 0.00 -0.41 -1.16 -1.13 -3.45 0.00 0.00 179.45 173.29 1p1c n SER 179 N -3.87 3.62 0.13 4.20 3.41 -1.26 -4.89 113.62 114.97 1p1c n SER 179 Ca -0.08 -0.01 -0.13 0.00 -0.26 0.00 0.00 58.87 58.39 1p1c n SER 179 Cb 0.25 -0.05 -0.06 0.00 -0.26 0.00 0.00 64.21 64.10 1p1c n SER 179 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1p1c h LYS 180 N -0.00 -0.48 -6.36 4.33 1.57 -1.77 -3.44 116.57 110.41 1p1c h LYS 180 Ca -0.06 0.03 -0.61 0.00 -1.87 0.00 0.00 60.65 58.14 1p1c h LYS 180 Cb 1.10 0.11 -0.14 0.00 0.08 0.00 0.00 32.23 33.38 1p1c h LYS 180 CO -0.01 -0.32 -0.73 0.71 -0.57 0.00 0.00 179.45 178.52 1p1c s TYR 181 N -6.06 2.50 0.00 -1.35 1.51 -0.93 -4.99 117.35 108.03 1p1c s TYR 181 Ca -0.16 -0.28 0.00 0.00 -1.01 0.00 0.00 57.07 55.63 1p1c s TYR 181 Cb 0.07 -1.16 0.00 0.00 -0.11 0.00 0.00 41.96 40.76 1p1c s TYR 181 CO 0.65 0.59 0.37 0.25 -1.11 0.00 0.00 175.55 176.29 1p1c n THR 182 N -0.29 0.00 -3.90 -0.71 -2.24 -1.26 -4.60 114.28 101.27 1p1c n THR 182 Ca -0.09 -0.41 -0.30 0.00 -2.27 0.00 0.00 64.05 60.99 1p1c n THR 182 Cb 0.57 1.17 -0.16 0.00 -2.10 0.00 0.00 70.33 69.82 1p1c n THR 182 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1p1c s ASP 183 N -0.08 3.73 0.53 3.42 2.15 -1.26 -5.02 116.67 120.15 1p1c s ASP 183 Ca 0.00 -1.16 0.22 0.00 0.43 0.00 0.00 52.55 52.03 1p1c s ASP 183 Cb 0.00 -1.08 1.38 0.00 -0.30 0.00 0.00 42.92 42.91 1p1c s ASP 183 CO 0.00 -0.26 2.08 -0.29 -0.17 0.00 0.00 175.17 176.53 1p1c h ILE 184 N 6.64 0.82 0.00 4.11 2.10 -1.97 0.77 117.51 129.97 1p1c h ILE 184 Ca -0.17 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.77 1p1c h ILE 184 Cb 1.08 0.86 0.00 0.00 -1.09 0.00 0.00 36.82 37.67 1p1c h ILE 184 CO 0.40 0.00 -0.48 0.71 -1.08 0.00 0.00 178.15 177.70 1p1c h THR 185 N 0.00 0.00 -0.18 2.19 1.35 -1.99 -2.73 112.91 111.55 1p1c h THR 185 Ca 0.12 -0.97 -0.19 0.00 -0.55 0.00 0.00 66.41 64.82 1p1c h THR 185 Cb 0.50 1.73 0.00 0.00 -1.73 0.00 0.00 68.15 68.65 1p1c h THR 185 CO -0.00 0.00 -0.66 0.00 -0.25 0.00 0.00 175.52 174.61 1p1c h ALA 186 N 2.03 0.50 -0.17 6.62 0.00 -1.31 -1.47 119.26 125.46 1p1c h ALA 186 Ca 0.00 -0.56 -0.05 0.00 0.00 0.00 0.00 54.91 54.30 1p1c h ALA 186 Cb 0.99 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 1p1c h ALA 186 CO 0.00 0.70 -0.09 1.98 0.00 0.00 0.00 179.25 181.84 1p1c h MET 187 N 0.50 0.36 -0.51 0.00 -1.53 -1.34 -1.78 114.93 110.63 1p1c h MET 187 Ca -0.02 -0.16 0.02 0.00 -3.44 0.00 0.00 59.70 56.10 1p1c h MET 187 Cb 1.25 -0.01 -0.03 0.00 -0.55 0.00 0.00 31.60 32.26 1p1c h MET 187 CO 0.13 0.67 0.32 0.35 0.14 0.00 0.00 176.91 178.52 1p1c h PHE 188 N 0.04 0.60 -0.29 1.39 3.04 -1.45 0.22 116.94 120.49 1p1c h PHE 188 Ca 0.04 0.02 -0.01 0.00 3.98 0.00 0.00 57.97 62.00 1p1c h PHE 188 Cb 0.57 -0.20 -0.01 0.00 2.56 0.00 0.00 35.95 38.87 1p1c h PHE 188 CO 0.07 0.36 0.15 1.49 -2.02 0.00 0.00 178.31 178.36 1p1c h GLU 189 N 0.64 0.40 -0.04 1.11 4.57 -1.24 0.86 114.58 120.89 1p1c h GLU 189 Ca 0.20 -0.05 -0.22 0.00 -1.18 0.00 0.00 59.36 58.11 1p1c h GLU 189 Cb -0.02 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 28.50 1p1c h GLU 189 CO -0.07 0.36 -0.88 1.49 -1.18 0.00 0.00 179.01 178.72 1p1c h GLU 190 N 0.35 0.49 0.00 1.92 4.22 -1.10 -3.35 114.58 117.11 1p1c h GLU 190 Ca 0.10 -0.48 -0.16 0.00 0.08 0.00 0.00 59.36 58.91 1p1c h GLU 190 Cb 0.07 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 1p1c h GLU 190 CO -0.02 1.12 -1.84 0.25 -2.18 0.00 0.00 179.01 176.35 1p1c n THR 191 N -3.80 0.59 -0.14 0.32 -2.24 0.75 -4.73 114.28 105.03 1p1c n THR 191 Ca -0.07 -0.49 -0.29 0.00 -2.27 0.00 0.00 64.05 60.94 1p1c n THR 191 Cb 0.80 -0.34 -0.10 0.00 -2.10 0.00 0.00 70.33 68.60 1p1c n THR 191 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1p1c n GLN 192 N -2.32 0.58 0.24 -0.78 1.13 0.29 -4.65 117.38 111.87 1p1c n GLN 192 Ca -0.15 0.26 0.07 0.00 -1.94 0.00 0.00 57.00 55.24 1p1c n GLN 192 Cb 0.74 -1.48 0.59 0.00 0.11 0.00 0.00 30.24 30.19 1p1c n GLN 192 CO 0.00 0.00 0.00 -0.39 -1.44 0.00 0.00 177.06 175.23 1p1c h VAL 193 N -0.99 0.99 -0.71 5.09 -1.51 -1.39 -2.45 116.25 115.27 1p1c h VAL 193 Ca -0.66 -0.45 -0.02 0.00 -1.23 0.00 0.00 66.70 64.33 1p1c h VAL 193 Cb 1.58 1.25 -0.03 0.00 -2.13 0.00 0.00 31.29 31.95 1p1c h VAL 193 CO -0.40 0.12 0.36 -0.65 -1.23 0.00 0.00 177.57 175.77 1p1c h PRO 194 N 0.00 1.01 0.03 5.19 0.11 -1.83 -0.98 132.00 135.52 1p1c h PRO 194 Ca -0.00 -0.13 -0.22 0.00 0.11 0.00 0.00 66.00 65.76 1p1c h PRO 194 Cb 0.24 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 1p1c h PRO 194 CO 0.02 0.76 -0.98 0.00 -0.21 0.00 0.00 178.00 177.59 1p1c h ALA 195 N 1.39 0.39 -0.61 -0.75 0.00 -1.75 -2.45 119.26 115.49 1p1c h ALA 195 Ca 0.25 -0.79 -0.06 0.00 0.00 0.00 0.00 54.91 54.31 1p1c h ALA 195 Cb 0.08 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1p1c h ALA 195 CO -0.03 0.97 0.14 -0.07 0.00 0.00 0.00 179.25 180.26 1p1c h LEU 196 N 0.09 0.92 -0.71 0.00 4.07 -1.23 -1.01 115.31 117.44 1p1c h LEU 196 Ca -0.06 -0.24 -0.01 0.00 0.08 0.00 0.00 57.88 57.66 1p1c h LEU 196 Cb 1.65 -0.24 -0.03 0.00 1.08 0.00 0.00 40.66 43.11 1p1c h LEU 196 CO 0.15 0.92 0.41 -0.07 -1.08 0.00 0.00 178.44 178.77 1p1c h LEU 197 N 0.89 0.87 -2.33 1.67 4.07 -1.17 -0.00 115.31 119.31 1p1c h LEU 197 Ca 0.19 -0.08 -0.01 0.00 0.08 0.00 0.00 57.88 58.06 1p1c h LEU 197 Cb 0.36 -0.22 -0.00 0.00 1.08 0.00 0.00 40.66 41.88 1p1c h LEU 197 CO 0.00 0.69 -0.04 -0.33 -1.08 0.00 0.00 178.44 177.68 1p1c h GLU 198 N 0.97 0.00 0.00 1.13 5.08 -0.83 0.03 114.58 120.95 1p1c h GLU 198 Ca 0.25 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.52 1p1c h GLU 198 Cb -0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1p1c h GLU 198 CO -0.04 0.04 -0.43 0.00 -1.00 0.00 0.00 179.01 177.58 1p1c h ALA 199 N 1.96 0.98 0.00 3.43 0.00 0.28 -3.47 119.26 122.44 1p1c h ALA 199 Ca -0.00 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1p1c h ALA 199 Cb 0.16 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1p1c h ALA 199 CO 0.01 0.54 0.00 0.41 0.00 0.00 0.00 179.25 180.21 1p1c n GLY 200 N 0.27 0.91 3.80 0.00 0.00 -0.00 -4.88 105.19 105.28 1p1c n GLY 200 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1p1c n GLY 200 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1p1c s PHE 201 N -1.11 2.99 0.18 1.61 0.40 -1.15 -5.01 117.98 115.89 1p1c s PHE 201 Ca 0.00 1.51 0.06 0.00 -0.60 0.00 0.00 56.93 57.90 1p1c s PHE 201 Cb 0.00 -3.01 -0.04 0.00 0.51 0.00 0.00 43.02 40.48 1p1c s PHE 201 CO 0.00 -1.10 0.12 -0.65 0.70 0.00 0.00 175.22 174.30 1p1c s GLN 202 N -4.03 2.82 0.40 0.44 1.11 -1.26 -4.25 119.66 114.89 1p1c s GLN 202 Ca 0.64 -0.94 0.17 0.00 0.01 0.00 0.00 55.36 55.23 1p1c s GLN 202 Cb -0.16 -2.58 1.05 0.00 -1.01 0.00 0.00 33.01 30.31 1p1c s GLN 202 CO 0.36 0.47 1.81 -0.09 0.01 0.00 0.00 175.29 177.84 1p1c h ARG 203 N 2.31 0.43 -0.81 2.91 9.65 -1.96 0.45 114.38 127.37 1p1c h ARG 203 Ca -0.48 -0.03 0.05 0.00 -1.10 0.00 0.00 59.98 58.43 1p1c h ARG 203 Cb 1.21 -0.10 -0.05 0.00 -1.39 0.00 0.00 29.97 29.64 1p1c h ARG 203 CO 0.62 0.29 0.53 1.05 2.80 0.00 0.00 179.97 185.26 1p1c h GLU 204 N 0.45 0.93 0.00 0.20 4.11 -2.00 -2.31 114.58 115.95 1p1c h GLU 204 Ca 0.54 -0.06 0.00 0.00 0.07 0.00 0.00 59.36 59.91 1p1c h GLU 204 Cb 1.29 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1p1c h GLU 204 CO -0.25 0.61 0.00 -0.91 0.07 0.00 0.00 179.01 178.53 1p1c h ASN 205 N 0.96 0.00 -3.37 3.06 -0.26 -0.38 -3.44 115.58 112.15 1p1c h ASN 205 Ca 0.34 0.00 -0.64 0.00 -0.56 0.00 0.00 56.30 55.44 1p1c h ASN 205 Cb 0.12 0.00 -0.22 0.00 -1.06 0.00 0.00 38.32 37.16 1p1c h ASN 205 CO -0.11 0.00 -0.66 -0.51 -1.06 0.00 0.00 177.43 175.09 1p1c s ILE 206 N -3.70 3.97 0.36 2.81 1.10 -0.87 -1.12 121.20 123.74 1p1c s ILE 206 Ca 0.00 -0.32 0.04 0.00 -0.51 0.00 0.00 60.65 59.86 1p1c s ILE 206 Cb 0.10 -2.77 -0.04 0.00 0.15 0.00 0.00 42.46 39.90 1p1c s ILE 206 CO 0.50 0.46 0.13 0.00 -2.11 0.00 0.00 174.94 173.92 1p1c s THR 208 N -3.37 0.03 -0.09 0.00 -4.23 -1.26 -0.18 115.64 106.55 1p1c s THR 208 Ca 0.30 -1.48 -0.03 0.00 -1.18 0.00 0.00 61.69 59.30 1p1c s THR 208 Cb 0.04 -2.06 0.05 0.00 1.34 0.00 0.00 72.50 71.87 1p1c s THR 208 CO 0.16 -0.15 0.13 -0.70 -0.54 0.00 0.00 174.62 173.52 1p1c s GLU 209 N -4.01 0.01 -0.21 3.99 2.12 -0.05 -4.93 118.70 115.62 1p1c s GLU 209 Ca 0.22 0.41 -0.09 0.00 0.36 0.00 0.00 54.97 55.87 1p1c s GLU 209 Cb 0.03 -0.60 -0.04 0.00 0.26 0.00 0.00 34.13 33.78 1p1c s GLU 209 CO 0.05 -0.38 0.10 0.08 -0.54 0.00 0.00 175.26 174.56 1p1c s VAL 210 N 2.24 4.92 0.21 3.70 1.01 -1.26 0.38 120.40 131.59 1p1c s VAL 210 Ca 0.04 0.02 0.11 0.00 0.00 0.00 0.00 61.98 62.15 1p1c s VAL 210 Cb -0.13 -3.26 -0.05 0.00 0.00 0.00 0.00 36.38 32.95 1p1c s VAL 210 CO -0.06 0.40 -0.23 0.00 0.00 0.00 0.00 175.10 175.21 1p1c s MET 211 N 0.82 1.56 -0.37 2.72 0.23 -0.45 -4.97 119.30 118.85 1p1c s MET 211 Ca 0.05 -1.56 -0.21 0.00 -1.03 0.00 0.00 55.69 52.95 1p1c s MET 211 Cb -0.13 -1.84 0.01 0.00 -1.53 0.00 0.00 34.83 31.33 1p1c s MET 211 CO 0.02 0.39 0.64 0.00 -2.03 0.00 0.00 175.02 174.05 1p1c s ALA 212 N -1.82 3.44 -0.14 3.16 0.00 -1.26 -1.56 121.76 123.58 1p1c s ALA 212 Ca 0.22 -0.89 -0.04 0.00 0.00 0.00 0.00 51.96 51.25 1p1c s ALA 212 Cb -0.07 -3.20 0.06 0.00 0.00 0.00 0.00 23.12 19.91 1p1c s ALA 212 CO 0.11 -1.41 0.16 -1.17 0.00 0.00 0.00 175.76 173.45 1p1c s LEU 213 N 2.75 0.02 -0.37 0.00 0.20 -0.44 -4.98 118.68 115.86 1p1c s LEU 213 Ca 0.24 -0.08 -0.20 0.00 0.69 0.00 0.00 54.13 54.78 1p1c s LEU 213 Cb -0.14 0.17 0.00 0.00 -0.43 0.00 0.00 46.19 45.79 1p1c s LEU 213 CO 0.16 -0.30 0.62 -0.69 -0.29 0.00 0.00 176.35 175.85 1p1c s VAL 214 N 2.26 4.89 0.56 1.68 1.01 -1.26 -3.37 120.40 126.18 1p1c s VAL 214 Ca 0.04 0.50 -0.19 0.00 0.00 0.00 0.00 61.98 62.33 1p1c s VAL 214 Cb -0.14 -4.08 -0.05 0.00 0.00 0.00 0.00 36.38 32.11 1p1c s VAL 214 CO -0.08 -0.34 1.14 -2.16 0.00 0.00 0.00 175.10 173.66 1p1c s PRO 215 N 2.69 3.23 0.69 2.72 0.04 -1.26 -5.00 135.00 138.11 1p1c s PRO 215 Ca 0.24 1.62 -0.16 0.00 0.04 0.00 0.00 61.00 62.74 1p1c s PRO 215 Cb -0.14 -1.99 0.02 0.00 0.04 0.00 0.00 34.50 32.43 1p1c s PRO 215 CO 0.15 -0.95 1.19 -2.14 0.04 0.00 0.00 177.00 175.29 1p1c s PRO 216 N -3.38 2.42 0.42 0.56 0.02 -1.26 -4.91 135.00 128.88 1p1c s PRO 216 Ca 0.73 1.70 0.23 0.00 0.02 0.00 0.00 61.00 63.68 1p1c s PRO 216 Cb -0.25 -1.87 1.22 0.00 0.02 0.00 0.00 34.50 33.62 1p1c s PRO 216 CO 0.29 -1.61 1.74 0.00 -0.33 0.00 0.00 177.00 177.10 1p1c h ALA 217 N -0.01 2.43 -0.61 -1.55 0.00 -1.96 0.07 119.26 117.63 1p1c h ALA 217 Ca -0.48 0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.34 1p1c h ALA 217 Cb 1.29 0.08 -0.09 0.00 0.00 0.00 0.00 17.79 19.06 1p1c h ALA 217 CO 0.52 -0.89 0.17 -0.40 0.00 0.00 0.00 179.25 178.64 1p1c n ASP 218 N -4.60 4.62 -4.62 0.00 3.85 -1.26 -4.93 116.55 109.62 1p1c n ASP 218 Ca 0.28 -3.20 -0.43 0.00 -0.71 0.00 0.00 54.79 50.73 1p1c n ASP 218 Cb 1.04 -0.70 -0.02 0.00 -1.35 0.00 0.00 41.12 40.09 1p1c n ASP 218 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1p1c n ARG 220 N 7.90 0.03 -0.00 0.00 5.12 -1.26 -4.01 116.66 124.44 1p1c n ARG 220 Ca 0.19 0.03 0.01 0.00 -1.93 0.00 0.00 57.85 56.14 1p1c n ARG 220 Cb 0.46 -1.50 -0.01 0.00 -1.16 0.00 0.00 32.46 30.25 1p1c n ARG 220 CO 0.00 0.00 0.00 2.48 -1.93 0.00 0.00 177.63 178.18 1p1c n TYR 221 N -1.48 0.00 -3.79 -1.55 4.11 -1.26 -5.05 117.16 108.14 1p1c n TYR 221 Ca 0.07 0.00 -0.13 0.00 -0.00 0.00 0.00 57.90 57.84 1p1c n TYR 221 Cb 0.31 -0.01 -0.13 0.00 -0.00 0.00 0.00 39.34 39.52 1p1c n TYR 221 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.86 176.39 1p1c s TYR 222 N -1.33 -0.18 0.00 -3.48 6.14 -1.26 -4.28 117.35 112.97 1p1c s TYR 222 Ca 0.00 0.47 0.00 0.00 0.64 0.00 0.00 57.07 58.18 1p1c s TYR 222 Cb 0.01 0.02 0.00 0.00 0.42 0.00 0.00 41.96 42.41 1p1c s TYR 222 CO 0.05 -0.12 0.03 0.00 0.64 0.00 0.00 175.55 176.15 1p1c n ALA 223 N 3.43 0.98 -2.06 3.97 0.00 -1.26 -4.66 120.51 120.91 1p1c n ALA 223 Ca -0.17 -0.03 -0.41 0.00 0.00 0.00 0.00 53.44 52.82 1p1c n ALA 223 Cb 0.56 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.98 1p1c n ALA 223 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1p1c s PHE 224 N -0.41 3.47 -1.53 0.00 5.36 -1.26 -4.74 117.98 118.88 1p1c s PHE 224 Ca 0.00 1.47 0.00 0.00 -0.96 0.00 0.00 56.93 57.44 1p1c s PHE 224 Cb 0.00 -3.39 0.00 0.00 -0.34 0.00 0.00 43.02 39.29 1p1c s PHE 224 CO 0.00 -1.04 0.73 -0.35 -1.46 0.00 0.00 175.22 173.11 1p1c n PRO 225 N 2.46 0.96 -3.98 10.12 -0.04 -1.26 -4.34 135.00 138.92 1p1c n PRO 225 Ca 0.04 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.39 1p1c n PRO 225 Cb 0.45 -1.23 -0.12 0.00 -0.04 0.00 0.00 33.50 32.57 1p1c n PRO 225 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1p1c s GLN 226 N -1.53 0.29 0.07 0.54 -0.21 -1.22 -1.33 119.66 116.28 1p1c s GLN 226 Ca 0.00 -0.49 0.09 0.00 0.02 0.00 0.00 55.36 54.98 1p1c s GLN 226 Cb 0.00 -0.00 -0.03 0.00 1.00 0.00 0.00 33.01 33.97 1p1c s GLN 226 CO 0.00 -0.02 -0.24 -1.64 -2.12 0.00 0.00 175.29 171.27 1p1c s MET 227 N -1.13 1.76 -0.11 2.91 -1.94 -0.60 -4.88 119.30 115.31 1p1c s MET 227 Ca -0.11 -1.15 0.03 0.00 -1.71 0.00 0.00 55.69 52.75 1p1c s MET 227 Cb -0.08 -2.01 -0.00 0.00 2.01 0.00 0.00 34.83 34.75 1p1c s MET 227 CO -0.01 0.50 -0.22 -1.50 -0.01 0.00 0.00 175.02 173.79 1p1c s ILE 228 N -0.92 2.25 -0.37 2.53 2.07 -1.26 -1.34 121.20 124.16 1p1c s ILE 228 Ca 0.13 -0.95 -0.07 0.00 -1.41 0.00 0.00 60.65 58.36 1p1c s ILE 228 Cb -0.10 -1.88 0.06 0.00 0.13 0.00 0.00 42.46 40.67 1p1c s ILE 228 CO 0.04 0.55 0.16 -0.89 -1.91 0.00 0.00 174.94 172.90 1p1c s THR 229 N 0.39 3.87 0.27 4.00 2.01 0.16 -4.92 115.64 121.41 1p1c s THR 229 Ca -0.16 -1.30 -0.29 0.00 0.31 0.00 0.00 61.69 60.24 1p1c s THR 229 Cb -0.17 -3.29 -0.09 0.00 0.01 0.00 0.00 72.50 68.95 1p1c s THR 229 CO 0.07 -0.33 1.25 -2.84 -0.69 0.00 0.00 174.62 172.08 1p1c s PRO 230 N 1.38 4.45 -0.49 4.92 0.02 -1.26 -0.87 135.00 143.15 1p1c s PRO 230 Ca 0.01 2.04 0.03 0.00 0.02 0.00 0.00 61.00 63.09 1p1c s PRO 230 Cb -0.21 -3.15 0.14 0.00 0.02 0.00 0.00 34.50 31.30 1p1c s PRO 230 CO 0.02 -0.10 0.29 -0.51 -0.33 0.00 0.00 177.00 176.37 1p1c s LEU 231 N -1.06 3.23 -0.35 -5.54 1.43 0.75 -4.40 118.68 112.74 1p1c s LEU 231 Ca 0.50 -2.93 -0.11 0.00 -1.03 0.00 0.00 54.13 50.56 1p1c s LEU 231 Cb -0.36 -1.19 0.01 0.00 0.03 0.00 0.00 46.19 44.67 1p1c s LEU 231 CO 0.44 -0.22 0.20 -0.69 0.23 0.00 0.00 176.35 176.31 1p1c s VAL 232 N -0.08 4.75 -0.09 -1.59 1.01 -0.65 -1.14 120.40 122.61 1p1c s VAL 232 Ca 0.20 -0.57 -0.02 0.00 0.00 0.00 0.00 61.98 61.59 1p1c s VAL 232 Cb -0.19 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.63 1p1c s VAL 232 CO -0.04 -0.08 0.00 0.28 0.00 0.00 0.00 175.10 175.25 1p1c s THR 233 N 1.61 4.29 0.17 3.92 -1.32 -0.28 0.41 115.64 124.45 1p1c s THR 233 Ca 0.04 -0.25 -0.30 0.00 -1.21 0.00 0.00 61.69 59.97 1p1c s THR 233 Cb -0.18 -2.81 -0.08 0.00 -1.51 0.00 0.00 72.50 67.91 1p1c s THR 233 CO 0.07 0.59 1.30 -0.75 -2.21 0.00 0.00 174.62 173.63 1p1c s LYS 234 N -0.75 4.39 0.00 7.08 2.47 0.16 -4.75 119.74 128.34 1p1c s LYS 234 Ca 0.12 2.02 0.30 0.00 -1.56 0.00 0.00 55.97 56.85 1p1c s LYS 234 Cb -0.12 -3.22 1.80 0.00 -1.46 0.00 0.00 37.83 34.84 1p1c s LYS 234 CO 0.02 -0.27 2.13 1.58 0.16 0.00 0.00 175.35 178.98