#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pvh s SER 7 N 0.00 7.31 0.07 6.12 0.15 -1.26 -5.05 113.70 121.03 2pvh s SER 7 Ca 0.00 1.74 -0.10 0.00 0.70 0.00 0.00 55.95 58.29 2pvh s SER 7 Cb 0.00 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 2pvh s SER 7 CO 0.00 -0.01 0.21 -1.59 1.20 0.00 0.00 173.24 173.05 2pvh s LYS 8 N -1.90 0.79 0.37 5.44 -2.85 -1.26 -4.27 119.74 116.06 2pvh s LYS 8 Ca 0.47 -0.79 -0.28 0.00 -1.00 0.00 0.00 55.97 54.37 2pvh s LYS 8 Cb -0.19 0.33 -0.10 0.00 -2.06 0.00 0.00 37.83 35.80 2pvh s LYS 8 CO 0.24 -0.25 1.38 0.00 0.10 0.00 0.00 175.35 176.82 2pvh s ALA 9 N -3.27 3.47 -0.83 0.59 0.00 -1.26 -4.91 121.76 115.55 2pvh s ALA 9 Ca 0.00 1.39 0.27 0.00 0.00 0.00 0.00 51.96 53.62 2pvh s ALA 9 Cb 0.02 -3.54 0.91 0.00 0.00 0.00 0.00 23.12 20.52 2pvh s ALA 9 CO -0.08 -0.86 1.78 0.54 0.00 0.00 0.00 175.76 177.15 2pvh n ARG 10 N 0.51 0.16 -4.01 0.00 1.74 -1.26 -4.54 116.66 109.26 2pvh n ARG 10 Ca 0.01 0.12 -0.08 0.00 -0.77 0.00 0.00 57.85 57.13 2pvh n ARG 10 Cb 0.41 -1.68 -0.10 0.00 -1.02 0.00 0.00 32.46 30.08 2pvh n ARG 10 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2pvh s VAL 11 N -3.07 0.18 -1.12 1.55 -7.23 -1.26 -4.86 120.40 104.59 2pvh s VAL 11 Ca 0.12 -1.46 0.00 0.00 -1.81 0.00 0.00 61.98 58.83 2pvh s VAL 11 Cb 0.15 -1.20 0.00 0.00 0.56 0.00 0.00 36.38 35.89 2pvh s VAL 11 CO 0.59 -0.81 0.00 -1.22 -0.31 0.00 0.00 175.10 173.35 2pvh n TYR 12 N 0.43 -0.63 0.09 2.82 4.01 -1.26 -4.82 117.16 117.79 2pvh n TYR 12 Ca -0.17 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.63 2pvh n TYR 12 Cb 0.60 -2.33 0.50 0.00 -0.31 0.00 0.00 39.34 37.81 2pvh n TYR 12 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2pvh h ALA 13 N 0.97 1.83 -0.64 -0.72 0.00 -1.89 -2.92 119.26 115.88 2pvh h ALA 13 Ca -0.23 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2pvh h ALA 13 Cb 0.78 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.46 2pvh h ALA 13 CO 0.32 0.16 0.00 -0.40 0.00 0.00 0.00 179.25 179.33 2pvh n ASP 14 N -4.50 4.32 0.04 0.00 3.85 -1.26 -4.42 116.55 114.59 2pvh n ASP 14 Ca 0.01 -2.27 -0.11 0.00 -0.71 0.00 0.00 54.79 51.71 2pvh n ASP 14 Cb 0.08 -0.52 -0.04 0.00 -1.35 0.00 0.00 41.12 39.29 2pvh n ASP 14 CO 0.00 0.00 0.00 0.58 -1.01 0.00 0.00 177.20 176.77 2pvh h VAL 15 N 3.93 0.46 0.00 2.12 2.07 -1.87 -1.11 116.25 121.85 2pvh h VAL 15 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2pvh h VAL 15 Cb 1.23 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.47 2pvh h VAL 15 CO 0.13 0.00 0.00 0.78 0.02 0.00 0.00 177.57 178.50 2pvh h ASN 16 N -0.34 0.00 0.04 0.57 2.35 -1.83 -2.73 115.58 113.64 2pvh h ASN 16 Ca 0.07 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.65 2pvh h ASN 16 Cb 0.44 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.80 2pvh h ASN 16 CO -0.23 0.00 -0.58 0.58 -1.65 0.00 0.00 177.43 175.55 2pvh h VAL 17 N 0.00 1.32 0.00 2.81 2.07 -1.66 -3.23 116.25 117.56 2pvh h VAL 17 Ca 0.00 -1.84 -0.03 0.00 0.82 0.00 0.00 66.70 65.65 2pvh h VAL 17 Cb 0.71 1.82 -0.00 0.00 -1.52 0.00 0.00 31.29 32.29 2pvh h VAL 17 CO 0.00 0.57 -0.65 -0.07 0.02 0.00 0.00 177.57 177.45 2pvh h LEU 18 N 0.42 0.00-10.13 2.57 3.38 -1.10 -3.47 115.31 106.98 2pvh h LEU 18 Ca 0.00 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.47 2pvh h LEU 18 Cb 1.13 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.88 2pvh h LEU 18 CO 0.11 0.12 0.00 -0.13 0.09 0.00 0.00 178.44 178.63 2pvh s ARG 19 N -3.22 3.71 0.38 1.13 0.52 -1.04 -5.03 118.95 115.40 2pvh s ARG 19 Ca 0.02 0.25 -0.26 0.00 -0.52 0.00 0.00 55.73 55.22 2pvh s ARG 19 Cb 0.08 -2.51 -0.11 0.00 0.52 0.00 0.00 34.95 32.93 2pvh s ARG 19 CO 0.75 0.07 1.21 -2.30 0.02 0.00 0.00 175.30 175.05 2pvh n PRO 20 N -1.15 1.84 0.08 3.54 -0.02 -1.26 -4.84 135.00 133.19 2pvh n PRO 20 Ca 0.00 0.65 0.21 0.00 -2.02 0.00 0.00 63.50 62.34 2pvh n PRO 20 Cb 0.54 -2.26 0.73 0.00 -0.02 0.00 0.00 33.50 32.49 2pvh n PRO 20 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2pvh h LYS 21 N 2.13 0.00 0.00 -0.52 3.64 -1.96 0.17 116.57 120.04 2pvh h LYS 21 Ca -0.46 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.92 2pvh h LYS 21 Cb 1.30 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.12 2pvh h LYS 21 CO 0.60 0.00 0.00 1.05 -2.27 0.00 0.00 179.45 178.83 2pvh h GLU 22 N 0.00 0.00 -0.17 1.90 9.09 -1.90 0.16 114.58 123.66 2pvh h GLU 22 Ca 0.20 0.00 -0.08 0.00 0.05 0.00 0.00 59.36 59.54 2pvh h GLU 22 Cb 1.17 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.27 2pvh h GLU 22 CO -0.00 0.00 -0.19 -0.92 0.05 0.00 0.00 179.01 177.94 2pvh h TYR 23 N 0.00 0.53 0.00 2.06 3.20 -0.99 -3.36 116.97 118.41 2pvh h TYR 23 Ca 0.00 -0.16 0.00 0.00 3.14 0.00 0.00 58.73 61.71 2pvh h TYR 23 Cb 0.52 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.68 2pvh h TYR 23 CO 0.00 0.82 -0.99 -2.67 -1.64 0.00 0.00 178.16 173.68 2pvh n TRP 24 N -4.47 0.00 -2.09 -3.82 4.27 -1.18 -4.76 117.44 105.38 2pvh n TRP 24 Ca -0.06 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.13 2pvh n TRP 24 Cb 0.40 -0.08 0.00 0.00 -1.36 0.00 0.00 31.31 30.27 2pvh n TRP 24 CO 0.00 0.00 0.00 -3.47 -2.29 0.00 0.00 177.69 171.93 2pvh n ASP 25 N -1.54 4.35 0.23 -0.67 2.03 0.56 -4.76 116.55 116.75 2pvh n ASP 25 Ca 0.02 -2.89 0.16 0.00 0.52 0.00 0.00 54.79 52.60 2pvh n ASP 25 Cb 0.30 -1.68 0.79 0.00 -0.72 0.00 0.00 41.12 39.82 2pvh n ASP 25 CO 0.00 0.00 0.00 0.10 -1.92 0.00 0.00 177.20 175.38 2pvh h TYR 26 N 6.55 0.00 0.00 -0.67 -0.00 -1.86 -2.39 116.97 118.60 2pvh h TYR 26 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.24 2pvh h TYR 26 Cb 0.72 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.45 2pvh h TYR 26 CO 1.43 0.00 0.00 0.39 -0.00 0.00 0.00 178.16 179.98 2pvh n GLU 27 N -2.63 0.19 0.00 0.10 1.02 -1.26 -2.79 120.64 115.27 2pvh n GLU 27 Ca -0.01 0.22 0.12 0.00 -0.02 0.00 0.00 57.16 57.47 2pvh n GLU 27 Cb 0.11 -1.75 0.27 0.00 -0.02 0.00 0.00 31.44 30.05 2pvh n GLU 27 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2pvh n ALA 28 N -1.72 3.37 -1.76 0.62 0.00 -0.90 -4.94 120.51 115.19 2pvh n ALA 28 Ca 0.05 -0.43 -0.41 0.00 0.00 0.00 0.00 53.44 52.65 2pvh n ALA 28 Cb 0.36 -1.07 -0.01 0.00 0.00 0.00 0.00 19.45 18.73 2pvh n ALA 28 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2pvh n LEU 29 N -0.89 4.57 -4.05 0.00 7.94 -1.12 -4.98 117.00 118.48 2pvh n LEU 29 Ca 0.09 1.18 -0.33 0.00 -1.11 0.00 0.00 56.01 55.85 2pvh n LEU 29 Cb 0.36 -1.61 -0.14 0.00 0.53 0.00 0.00 43.42 42.56 2pvh n LEU 29 CO 0.30 0.17 -0.25 0.42 -1.11 0.00 0.00 177.39 176.91 2pvh s THR 30 N -0.49 2.66 0.21 1.96 -4.23 -1.26 -5.08 115.64 109.41 2pvh s THR 30 Ca 0.59 -2.37 -0.32 0.00 -1.18 0.00 0.00 61.69 58.41 2pvh s THR 30 Cb -0.48 -2.89 -0.13 0.00 1.34 0.00 0.00 72.50 70.33 2pvh s THR 30 CO 0.55 -0.66 1.64 0.52 -0.54 0.00 0.00 174.62 176.14 2pvh n VAL 31 N 4.22 0.19 -3.45 2.29 0.31 -1.26 -4.96 118.33 115.68 2pvh n VAL 31 Ca 0.02 -0.05 -0.43 0.00 -0.01 0.00 0.00 64.34 63.87 2pvh n VAL 31 Cb 0.41 -1.81 -0.06 0.00 -0.91 0.00 0.00 33.84 31.47 2pvh n VAL 31 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 2pvh s GLN 32 N 0.77 2.97 0.17 5.55 -1.52 -1.26 -5.06 119.66 121.28 2pvh s GLN 32 Ca 0.74 -2.09 -0.31 0.00 -1.95 0.00 0.00 55.36 51.75 2pvh s GLN 32 Cb -0.57 -4.15 -0.09 0.00 -0.22 0.00 0.00 33.01 27.98 2pvh s GLN 32 CO 0.37 -1.25 1.44 -1.58 -0.25 0.00 0.00 175.29 174.01 2pvh s TRP 33 N 0.82 3.16 0.00 0.91 0.52 -1.26 -4.80 118.94 118.28 2pvh s TRP 33 Ca 0.11 0.92 0.00 0.00 0.02 0.00 0.00 56.10 57.14 2pvh s TRP 33 Cb -0.21 -3.76 0.00 0.00 -1.15 0.00 0.00 33.47 28.35 2pvh s TRP 33 CO -0.03 -2.65 0.00 0.41 0.02 0.00 0.00 176.95 174.71 2pvh n GLY 34 N 3.16 0.82 3.35 0.98 0.00 0.15 -5.00 105.19 108.65 2pvh n GLY 34 Ca 0.10 -1.59 -0.39 0.00 0.00 0.00 0.00 46.02 44.14 2pvh n GLY 34 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2pvh s GLU 35 N 0.70 2.90 0.26 1.61 0.41 -1.26 -4.79 118.70 118.53 2pvh s GLU 35 Ca 0.00 -1.01 -0.02 0.00 -0.41 0.00 0.00 54.97 53.53 2pvh s GLU 35 Cb 0.00 -3.56 0.57 0.00 -1.78 0.00 0.00 34.13 29.36 2pvh s GLU 35 CO 0.00 -0.60 1.67 0.37 -0.49 0.00 0.00 175.26 176.21 2pvh h GLN 36 N 8.33 0.26 0.00 1.61 5.75 -1.93 -1.49 115.11 127.63 2pvh h GLN 36 Ca -0.27 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.21 2pvh h GLN 36 Cb 1.11 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.60 2pvh h GLN 36 CO 0.63 0.17 0.00 -0.44 -2.65 0.00 0.00 178.83 176.54 2pvh h ASP 37 N 0.27 0.00 0.49 -0.69 3.32 -1.95 -3.10 116.42 114.76 2pvh h ASP 37 Ca 0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.53 2pvh h ASP 37 Cb 0.87 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.42 2pvh h ASP 37 CO -0.56 0.00 0.00 0.44 -1.72 0.00 0.00 179.24 177.40 2pvh h ASP 38 N 0.00 0.00 -3.72 6.45 3.32 -1.67 -3.42 116.42 117.38 2pvh h ASP 38 Ca 0.00 0.00 -0.61 0.00 0.02 0.00 0.00 57.03 56.44 2pvh h ASP 38 Cb 0.40 0.00 -0.32 0.00 0.22 0.00 0.00 39.33 39.63 2pvh h ASP 38 CO 0.00 0.00 -0.85 -0.31 -1.72 0.00 0.00 179.24 176.36 2pvh s TYR 39 N -3.89 2.00 -0.01 4.55 2.02 -1.17 -0.39 117.35 120.46 2pvh s TYR 39 Ca -0.02 -0.67 0.07 0.00 -0.37 0.00 0.00 57.07 56.08 2pvh s TYR 39 Cb 0.11 -1.35 -0.02 0.00 -0.40 0.00 0.00 41.96 40.30 2pvh s TYR 39 CO 0.47 -0.25 -0.23 -1.21 -1.57 0.00 0.00 175.55 172.76 2pvh s GLU 40 N 0.17 1.80 0.10 -0.62 2.02 -0.83 -4.96 118.70 116.37 2pvh s GLU 40 Ca -0.09 -0.84 -0.31 0.00 0.02 0.00 0.00 54.97 53.75 2pvh s GLU 40 Cb -0.14 -1.77 -0.06 0.00 0.10 0.00 0.00 34.13 32.26 2pvh s GLU 40 CO 0.04 0.48 1.23 0.08 0.02 0.00 0.00 175.26 177.11 2pvh s VAL 41 N -0.57 3.82 -0.24 2.63 1.01 -1.26 -1.61 120.40 124.17 2pvh s VAL 41 Ca 0.09 1.34 -0.08 0.00 0.00 0.00 0.00 61.98 63.33 2pvh s VAL 41 Cb -0.09 -3.86 -0.12 0.00 0.00 0.00 0.00 36.38 32.32 2pvh s VAL 41 CO -0.00 0.13 -0.28 0.52 0.00 0.00 0.00 175.10 175.46 2pvh n VAL 42 N 3.65 1.32 -3.61 2.92 0.31 0.29 -4.94 118.33 118.27 2pvh n VAL 42 Ca 0.08 -0.38 -0.10 0.00 -0.01 0.00 0.00 64.34 63.93 2pvh n VAL 42 Cb 0.45 -1.69 -0.06 0.00 -0.91 0.00 0.00 33.84 31.63 2pvh n VAL 42 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2pvh s ARG 43 N -2.45 0.58 0.22 5.55 1.70 -1.03 -4.98 118.95 118.55 2pvh s ARG 43 Ca -0.33 0.40 -0.30 0.00 -0.47 0.00 0.00 55.73 55.04 2pvh s ARG 43 Cb 0.12 0.28 -0.09 0.00 -0.57 0.00 0.00 34.95 34.69 2pvh s ARG 43 CO 0.45 -0.13 1.20 0.21 -1.08 0.00 0.00 175.30 175.95 2pvh s LYS 44 N -0.39 4.50 0.00 3.89 2.20 -1.26 0.33 119.74 129.01 2pvh s LYS 44 Ca 0.00 1.91 0.00 0.00 -0.36 0.00 0.00 55.97 57.53 2pvh s LYS 44 Cb -0.03 -3.21 0.00 0.00 -1.51 0.00 0.00 37.83 33.09 2pvh s LYS 44 CO -0.02 -0.04 0.00 1.33 -0.36 0.00 0.00 175.35 176.26 2pvh n VAL 45 N 2.03 0.00 -3.72 4.02 0.24 -0.29 -4.83 118.33 115.78 2pvh n VAL 45 Ca 0.03 -0.11 -0.08 0.00 -2.04 0.00 0.00 64.34 62.13 2pvh n VAL 45 Cb 0.44 0.56 -0.02 0.00 -1.47 0.00 0.00 33.84 33.35 2pvh n VAL 45 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2pvh s GLY 46 N -1.03 -0.26 0.08 7.63 0.00 -0.87 -5.01 107.32 107.85 2pvh s GLY 46 Ca 0.00 -0.00 -0.25 0.00 0.00 0.00 0.00 44.72 44.46 2pvh s GLY 46 CO 0.00 0.00 0.62 1.09 0.00 0.00 0.00 173.10 174.81 2pvh s ARG 47 N -3.79 1.18 0.37 2.90 1.04 -1.26 -0.68 118.95 118.71 2pvh s ARG 47 Ca 0.08 -0.21 -0.14 0.00 -1.04 0.00 0.00 55.73 54.42 2pvh s ARG 47 Cb -0.04 0.55 0.05 0.00 -2.04 0.00 0.00 34.95 33.47 2pvh s ARG 47 CO 0.00 -0.47 0.73 0.41 -0.04 0.00 0.00 175.30 175.94 2pvh n GLY 48 N 0.11 1.07 0.00 3.88 0.00 0.07 -4.98 105.19 105.35 2pvh n GLY 48 Ca -0.18 -1.25 0.11 0.00 0.00 0.00 0.00 46.02 44.71 2pvh n GLY 48 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2pvh n LYS 49 N -0.50 0.04 0.00 1.61 2.85 -1.26 -3.30 118.16 117.60 2pvh n LYS 49 Ca -0.08 0.11 0.03 0.00 -1.05 0.00 0.00 58.31 57.32 2pvh n LYS 49 Cb 0.55 -1.50 -0.01 0.00 -0.65 0.00 0.00 35.03 33.42 2pvh n LYS 49 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2pvh n TYR 50 N -1.48 0.00 -3.75 5.58 4.01 -1.26 -4.92 117.16 115.34 2pvh n TYR 50 Ca 0.06 0.00 -0.00 0.00 -0.16 0.00 0.00 57.90 57.80 2pvh n TYR 50 Cb 0.25 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.28 2pvh n TYR 50 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 2pvh s SER 51 N -1.13 -0.07 -0.05 7.72 1.04 -1.21 -1.32 113.70 118.69 2pvh s SER 51 Ca 0.04 -0.30 0.04 0.00 0.48 0.00 0.00 55.95 56.21 2pvh s SER 51 Cb 0.05 0.29 -0.00 0.00 0.10 0.00 0.00 66.02 66.46 2pvh s SER 51 CO 0.17 -0.56 -0.16 -1.61 0.98 0.00 0.00 173.24 172.06 2pvh s GLU 52 N -2.53 1.77 -0.07 4.02 2.02 -0.40 -0.75 118.70 122.76 2pvh s GLU 52 Ca 0.17 -0.58 0.03 0.00 0.02 0.00 0.00 54.97 54.61 2pvh s GLU 52 Cb 0.01 -1.52 -0.02 0.00 0.10 0.00 0.00 34.13 32.70 2pvh s GLU 52 CO -0.00 0.21 -0.15 0.08 0.02 0.00 0.00 175.26 175.42 2pvh s VAL 53 N 0.12 2.99 0.04 2.63 1.01 0.14 -0.51 120.40 126.83 2pvh s VAL 53 Ca -0.05 -0.73 0.03 0.00 0.00 0.00 0.00 61.98 61.23 2pvh s VAL 53 Cb -0.12 -2.19 -0.02 0.00 0.00 0.00 0.00 36.38 34.05 2pvh s VAL 53 CO 0.02 0.57 -0.10 -0.36 0.00 0.00 0.00 175.10 175.24 2pvh s PHE 54 N -0.40 0.86 0.15 5.22 0.40 0.00 -1.14 117.98 123.07 2pvh s PHE 54 Ca 0.04 -0.41 -0.30 0.00 -0.60 0.00 0.00 56.93 55.67 2pvh s PHE 54 Cb -0.12 -0.51 -0.07 0.00 0.51 0.00 0.00 43.02 42.83 2pvh s PHE 54 CO 0.02 -0.02 1.00 -2.00 0.70 0.00 0.00 175.22 174.92 2pvh s GLU 55 N -1.32 4.70 0.07 0.44 2.12 0.15 -0.46 118.70 124.40 2pvh s GLU 55 Ca -0.05 1.54 0.01 0.00 0.36 0.00 0.00 54.97 56.83 2pvh s GLU 55 Cb -0.08 -3.33 -0.00 0.00 0.26 0.00 0.00 34.13 30.97 2pvh s GLU 55 CO 0.01 0.23 0.03 0.41 -0.54 0.00 0.00 175.26 175.39 2pvh n GLY 56 N 2.05 3.95 2.92 -1.50 0.00 0.13 -0.55 105.19 112.19 2pvh n GLY 56 Ca 0.02 -1.95 -0.14 0.00 0.00 0.00 0.00 46.02 43.95 2pvh n GLY 56 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2pvh s ILE 57 N -1.81 -0.04 -0.54 -0.61 2.07 -0.63 -2.11 121.20 117.52 2pvh s ILE 57 Ca 0.04 0.16 -0.28 0.00 -1.41 0.00 0.00 60.65 59.16 2pvh s ILE 57 Cb 0.00 -0.22 0.03 0.00 0.13 0.00 0.00 42.46 42.40 2pvh s ILE 57 CO 0.03 0.07 1.17 0.21 -1.91 0.00 0.00 174.94 174.51 2pvh s ASN 58 N 1.04 6.52 0.56 4.50 3.84 -0.53 -1.97 114.94 128.90 2pvh s ASN 58 Ca -0.08 0.24 0.26 0.00 0.21 0.00 0.00 52.86 53.49 2pvh s ASN 58 Cb -0.10 -2.55 1.49 0.00 -0.55 0.00 0.00 41.25 39.53 2pvh s ASN 58 CO -0.05 -1.40 2.02 -0.37 -2.79 0.00 0.00 177.10 174.51 2pvh h VAL 59 N 6.19 0.60 0.19 -5.21 -1.51 -1.03 0.74 116.25 116.22 2pvh h VAL 59 Ca -0.24 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.22 2pvh h VAL 59 Cb 1.06 0.76 0.00 0.00 -2.13 0.00 0.00 31.29 30.98 2pvh h VAL 59 CO 1.17 0.00 -0.09 0.78 -1.23 0.00 0.00 177.57 178.19 2pvh h ASN 60 N 0.00 -0.22 0.47 4.19 2.35 -1.90 -3.36 115.58 117.11 2pvh h ASN 60 Ca 0.17 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.93 2pvh h ASN 60 Cb 0.81 0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.23 2pvh h ASN 60 CO -0.00 -0.09 -0.32 -0.46 -1.65 0.00 0.00 177.43 174.90 2pvh n ASN 61 N -3.05 0.58 -1.42 5.81 0.23 -1.16 -4.95 115.26 111.28 2pvh n ASN 61 Ca -0.03 -0.38 -0.18 0.00 -0.53 0.00 0.00 54.58 53.46 2pvh n ASN 61 Cb 0.10 0.09 -0.07 0.00 -2.08 0.00 0.00 39.78 37.82 2pvh n ASN 61 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2pvh n ASN 62 N -1.20 -5.12 -4.93 0.53 4.13 0.26 -5.00 115.26 103.93 2pvh n ASN 62 Ca 0.09 0.38 -0.25 0.00 1.68 0.00 0.00 54.58 56.48 2pvh n ASN 62 Cb 0.33 -4.17 -0.01 0.00 -1.54 0.00 0.00 39.78 34.38 2pvh n ASN 62 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 2pvh s GLU 63 N -3.65 3.52 0.81 3.52 2.02 -1.24 -4.81 118.70 118.86 2pvh s GLU 63 Ca 0.00 -0.23 -0.11 0.00 0.02 0.00 0.00 54.97 54.65 2pvh s GLU 63 Cb 0.00 -2.64 0.08 0.00 0.10 0.00 0.00 34.13 31.67 2pvh s GLU 63 CO 0.00 0.14 1.09 0.15 0.02 0.00 0.00 175.26 176.66 2pvh s LYS 64 N -4.18 1.97 0.23 1.61 1.02 -1.26 -1.45 119.74 117.68 2pvh s LYS 64 Ca 0.41 1.00 -0.22 0.00 0.02 0.00 0.00 55.97 57.18 2pvh s LYS 64 Cb -0.10 -1.88 0.04 0.00 -0.52 0.00 0.00 37.83 35.38 2pvh s LYS 64 CO 0.36 -1.80 0.84 0.00 -0.92 0.00 0.00 175.35 173.83 2pvh s ILE 66 N -3.44 2.64 -0.33 0.00 -1.09 0.97 0.20 121.20 120.15 2pvh s ILE 66 Ca 0.12 -0.81 -0.04 0.00 -2.23 0.00 0.00 60.65 57.69 2pvh s ILE 66 Cb -0.04 -2.08 0.05 0.00 -1.58 0.00 0.00 42.46 38.82 2pvh s ILE 66 CO 0.05 0.54 0.07 -0.63 -1.23 0.00 0.00 174.94 173.74 2pvh s ILE 67 N 0.39 3.41 -0.52 2.92 1.01 0.39 -0.97 121.20 127.84 2pvh s ILE 67 Ca -0.13 -1.31 -0.16 0.00 0.00 0.00 0.00 60.65 59.05 2pvh s ILE 67 Cb -0.17 -2.97 0.11 0.00 0.01 0.00 0.00 42.46 39.45 2pvh s ILE 67 CO 0.06 -0.18 0.47 -0.75 0.00 0.00 0.00 174.94 174.53 2pvh s LYS 68 N 1.32 2.96 -0.25 2.79 2.20 -0.64 -0.82 119.74 127.31 2pvh s LYS 68 Ca -0.03 -1.62 -0.24 0.00 -0.36 0.00 0.00 55.97 53.73 2pvh s LYS 68 Cb -0.20 -4.24 -0.01 0.00 -1.51 0.00 0.00 37.83 31.87 2pvh s LYS 68 CO 0.01 -1.25 0.79 0.42 -0.36 0.00 0.00 175.35 174.96 2pvh s ILE 69 N 1.60 4.86 0.11 5.43 1.01 0.33 -1.29 121.20 133.25 2pvh s ILE 69 Ca 0.03 1.48 -0.25 0.00 0.00 0.00 0.00 60.65 61.91 2pvh s ILE 69 Cb -0.28 -4.08 -0.07 0.00 0.01 0.00 0.00 42.46 38.04 2pvh s ILE 69 CO 0.04 -0.05 0.78 -0.76 0.00 0.00 0.00 174.94 174.95 2pvh s LEU 70 N 2.78 4.52 0.66 2.97 1.43 -0.39 -1.27 118.68 129.38 2pvh s LEU 70 Ca 0.33 1.56 -0.11 0.00 -1.03 0.00 0.00 54.13 54.88 2pvh s LEU 70 Cb -0.15 -3.28 -0.02 0.00 0.03 0.00 0.00 46.19 42.77 2pvh s LEU 70 CO 0.08 0.10 1.05 -0.54 0.23 0.00 0.00 176.35 177.27 2pvh s LYS 71 N -0.58 3.27 -0.07 1.70 1.02 -0.44 -4.50 119.74 120.15 2pvh s LYS 71 Ca 0.38 0.74 -0.39 0.00 0.02 0.00 0.00 55.97 56.72 2pvh s LYS 71 Cb -0.22 -2.04 -0.18 0.00 -0.52 0.00 0.00 37.83 34.87 2pvh s LYS 71 CO 0.25 -0.81 1.38 -2.30 -0.92 0.00 0.00 175.35 172.95 2pvh n PRO 72 N -2.91 0.73 -3.49 -1.68 -0.02 -1.26 -4.93 135.00 121.45 2pvh n PRO 72 Ca 0.07 0.27 -0.14 0.00 -2.02 0.00 0.00 63.50 61.67 2pvh n PRO 72 Cb 0.54 -1.87 -0.04 0.00 -0.02 0.00 0.00 33.50 32.12 2pvh n PRO 72 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2pvh s VAL 73 N 1.26 0.01 0.39 -1.45 0.11 -1.26 -5.09 120.40 114.36 2pvh s VAL 73 Ca 0.91 -0.08 -0.27 0.00 -2.93 0.00 0.00 61.98 59.62 2pvh s VAL 73 Cb -1.12 -1.00 -0.11 0.00 -1.53 0.00 0.00 36.38 32.62 2pvh s VAL 73 CO 0.57 -0.04 1.36 0.29 -3.33 0.00 0.00 175.10 173.95 2pvh n LYS 74 N 0.13 2.24 -0.19 1.54 4.76 -1.26 -4.88 118.16 120.51 2pvh n LYS 74 Ca -0.18 0.79 0.17 0.00 -2.87 0.00 0.00 58.31 56.23 2pvh n LYS 74 Cb 0.62 -2.47 0.52 0.00 -1.84 0.00 0.00 35.03 31.85 2pvh n LYS 74 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 2pvh h LYS 75 N 2.50 0.37 -0.41 1.97 3.11 -2.01 -1.76 116.57 120.35 2pvh h LYS 75 Ca -0.48 -0.02 -0.03 0.00 -2.81 0.00 0.00 60.65 57.31 2pvh h LYS 75 Cb 1.27 -0.08 -0.02 0.00 -1.00 0.00 0.00 32.23 32.40 2pvh h LYS 75 CO 0.62 0.25 0.15 -0.22 -2.81 0.00 0.00 179.45 177.44 2pvh h LYS 76 N 0.38 0.62 -0.57 1.90 3.64 -1.98 -2.52 116.57 118.04 2pvh h LYS 76 Ca 0.40 -0.12 -0.08 0.00 -1.27 0.00 0.00 60.65 59.58 2pvh h LYS 76 Cb 0.99 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.69 2pvh h LYS 76 CO -0.13 0.60 0.04 -0.22 -2.27 0.00 0.00 179.45 177.47 2pvh h LYS 77 N 0.52 0.95 -0.29 1.90 3.64 -1.69 -2.35 116.57 119.25 2pvh h LYS 77 Ca 0.13 -0.26 -0.13 0.00 -1.27 0.00 0.00 60.65 59.12 2pvh h LYS 77 Cb 0.22 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 2pvh h LYS 77 CO -0.01 0.91 -0.37 0.97 -2.27 0.00 0.00 179.45 178.69 2pvh h ILE 78 N 0.89 1.29 -0.00 2.00 2.10 -1.43 -2.38 117.51 119.98 2pvh h ILE 78 Ca 0.17 -1.52 -0.09 0.00 1.08 0.00 0.00 64.86 64.50 2pvh h ILE 78 Cb 0.46 1.46 -0.01 0.00 -1.09 0.00 0.00 36.82 37.64 2pvh h ILE 78 CO 0.02 0.49 -0.41 0.11 -1.08 0.00 0.00 178.15 177.28 2pvh h LYS 79 N 0.56 0.01 -0.15 2.19 1.57 -1.34 -2.29 116.57 117.11 2pvh h LYS 79 Ca 0.05 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 2pvh h LYS 79 Cb 0.89 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.19 2pvh h LYS 79 CO 0.08 0.41 -0.01 -0.09 -0.57 0.00 0.00 179.45 179.27 2pvh h ARG 80 N 0.01 0.28 -0.61 3.15 2.43 -1.01 -0.12 114.38 118.50 2pvh h ARG 80 Ca -0.00 -0.09 -0.08 0.00 -0.81 0.00 0.00 59.98 59.00 2pvh h ARG 80 Cb 0.72 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.23 2pvh h ARG 80 CO 0.05 0.52 0.07 1.49 -1.51 0.00 0.00 179.97 180.59 2pvh h GLU 81 N 0.01 1.00 -0.07 0.20 4.81 -1.33 -1.56 114.58 117.64 2pvh h GLU 81 Ca 0.04 -0.27 -0.01 0.00 -0.13 0.00 0.00 59.36 59.00 2pvh h GLU 81 Cb 0.40 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.66 2pvh h GLU 81 CO 0.01 0.94 0.01 0.82 -0.73 0.00 0.00 179.01 180.07 2pvh h ILE 82 N 0.94 1.20 -0.60 2.32 2.04 -1.33 -0.28 117.51 121.80 2pvh h ILE 82 Ca 0.18 -0.61 0.01 0.00 1.00 0.00 0.00 64.86 65.45 2pvh h ILE 82 Cb 0.45 1.48 -0.03 0.00 -0.74 0.00 0.00 36.82 37.97 2pvh h ILE 82 CO 0.02 0.17 0.39 0.50 0.00 0.00 0.00 178.15 179.22 2pvh h LYS 83 N -0.11 0.76 -0.67 2.37 1.63 -0.92 0.04 116.57 119.68 2pvh h LYS 83 Ca 0.02 -0.05 -0.06 0.00 -0.85 0.00 0.00 60.65 59.71 2pvh h LYS 83 Cb 0.26 -0.17 -0.03 0.00 -0.60 0.00 0.00 32.23 31.69 2pvh h LYS 83 CO 0.00 0.50 0.18 0.82 -3.45 0.00 0.00 179.45 177.50 2pvh h ILE 84 N 0.78 1.26 -0.68 2.00 2.04 -1.20 -0.42 117.51 121.30 2pvh h ILE 84 Ca 0.23 -0.93 -0.07 0.00 1.00 0.00 0.00 64.86 65.10 2pvh h ILE 84 Cb -0.05 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 36.58 2pvh h ILE 84 CO -0.07 0.35 0.16 -0.07 0.00 0.00 0.00 178.15 178.53 2pvh h LEU 85 N 0.99 1.01 -0.42 1.44 3.38 -0.44 -1.07 115.31 120.20 2pvh h LEU 85 Ca 0.21 -0.21 -0.12 0.00 0.09 0.00 0.00 57.88 57.86 2pvh h LEU 85 Cb 0.35 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2pvh h LEU 85 CO -0.00 0.97 -0.19 1.56 0.09 0.00 0.00 178.44 180.87 2pvh h GLN 86 N 1.02 0.86 -0.28 1.13 4.20 -0.72 -3.04 115.11 118.28 2pvh h GLN 86 Ca 0.21 -0.37 -0.07 0.00 0.06 0.00 0.00 58.65 58.48 2pvh h GLN 86 Cb 0.36 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.10 2pvh h GLN 86 CO 0.00 1.02 -0.11 -0.91 -0.67 0.00 0.00 178.83 178.16 2pvh h ASN 87 N 0.68 0.45 -3.55 1.46 2.35 -0.80 -3.47 115.58 112.70 2pvh h ASN 87 Ca 0.09 -0.11 -0.61 0.00 -0.55 0.00 0.00 56.30 55.12 2pvh h ASN 87 Cb 0.75 -0.12 -0.12 0.00 0.05 0.00 0.00 38.32 38.88 2pvh h ASN 87 CO 0.06 0.60 0.00 -0.76 -1.65 0.00 0.00 177.43 175.68 2pvh s LEU 88 N -8.87 4.07 0.00 1.61 1.43 -0.43 -4.96 118.68 111.53 2pvh s LEU 88 Ca -0.07 0.57 0.00 0.00 -1.03 0.00 0.00 54.13 53.60 2pvh s LEU 88 Cb 0.15 -2.69 0.00 0.00 0.03 0.00 0.00 46.19 43.67 2pvh s LEU 88 CO 0.77 -0.27 0.00 0.61 0.23 0.00 0.00 176.35 177.68 2pvh n GLY 90 N 4.26 0.00 3.79 -3.19 0.00 -1.26 -4.88 105.19 103.92 2pvh n GLY 90 Ca -0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 2pvh n GLY 90 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2pvh s GLY 91 N -0.56 1.64 -0.13 -0.02 0.00 -1.26 -4.93 107.32 102.06 2pvh s GLY 91 Ca 0.00 -0.05 -0.34 0.00 0.00 0.00 0.00 44.72 44.33 2pvh s GLY 91 CO 0.00 0.35 1.93 -1.05 0.00 0.00 0.00 173.10 174.33 2pvh n PRO 92 N -3.43 2.03 -1.99 2.90 -0.02 -1.26 -2.31 135.00 130.92 2pvh n PRO 92 Ca 0.07 0.72 -0.17 0.00 -2.02 0.00 0.00 63.50 62.11 2pvh n PRO 92 Cb 0.55 -2.65 -0.04 0.00 -0.02 0.00 0.00 33.50 31.34 2pvh n PRO 92 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2pvh n ASN 93 N 7.27 -4.75 -4.71 2.55 3.02 -1.26 -3.59 115.26 113.78 2pvh n ASN 93 Ca 0.25 0.24 -0.37 0.00 -0.03 0.00 0.00 54.58 54.67 2pvh n ASN 93 Cb 0.29 -4.12 -0.07 0.00 -0.61 0.00 0.00 39.78 35.27 2pvh n ASN 93 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2pvh s ILE 94 N -2.65 5.25 0.40 2.41 -1.09 -0.98 -0.69 121.20 123.85 2pvh s ILE 94 Ca 0.00 0.70 -0.25 0.00 -2.23 0.00 0.00 60.65 58.88 2pvh s ILE 94 Cb 0.00 -3.71 -0.11 0.00 -1.58 0.00 0.00 42.46 37.06 2pvh s ILE 94 CO 0.00 0.34 0.94 0.55 -1.23 0.00 0.00 174.94 175.53 2pvh n VAL 95 N 3.80 2.28 -3.60 2.92 3.14 -1.04 -4.71 118.33 121.13 2pvh n VAL 95 Ca -0.10 -0.50 -0.40 0.00 -2.96 0.00 0.00 64.34 60.38 2pvh n VAL 95 Cb 0.52 -1.03 -0.11 0.00 -1.06 0.00 0.00 33.84 32.15 2pvh n VAL 95 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 2pvh s LYS 96 N -1.87 3.13 -0.25 1.45 2.20 -1.26 -4.81 119.74 118.32 2pvh s LYS 96 Ca 0.63 -0.88 -0.29 0.00 -0.36 0.00 0.00 55.97 55.07 2pvh s LYS 96 Cb -0.59 -3.70 -0.00 0.00 -1.51 0.00 0.00 37.83 32.03 2pvh s LYS 96 CO 0.57 -0.56 1.23 -1.17 -0.36 0.00 0.00 175.35 175.07 2pvh s LEU 97 N 1.61 4.01 -0.18 5.43 2.96 -1.26 -1.71 118.68 129.55 2pvh s LEU 97 Ca 0.04 1.37 0.08 0.00 -0.22 0.00 0.00 54.13 55.39 2pvh s LEU 97 Cb -0.18 -3.54 -0.22 0.00 0.50 0.00 0.00 46.19 42.75 2pvh s LEU 97 CO 0.07 -0.91 0.12 0.18 -1.32 0.00 0.00 176.35 174.50 2pvh n LEU 98 N 7.06 1.59 -3.71 -0.68 4.77 0.17 -4.97 117.00 121.22 2pvh n LEU 98 Ca 0.14 0.06 -0.09 0.00 -0.03 0.00 0.00 56.01 56.09 2pvh n LEU 98 Cb 0.46 -0.30 -0.03 0.00 -2.33 0.00 0.00 43.42 41.22 2pvh n LEU 98 CO 0.59 0.69 0.39 -0.62 -1.33 0.00 0.00 177.39 177.11 2pvh s ASP 99 N -6.20 -0.34 -0.05 -1.43 -1.08 -0.97 -4.99 116.67 101.61 2pvh s ASP 99 Ca -0.19 -0.42 -0.00 0.00 -0.52 0.00 0.00 52.55 51.41 2pvh s ASP 99 Cb 0.07 0.65 0.03 0.00 -1.46 0.00 0.00 42.92 42.21 2pvh s ASP 99 CO 0.74 -1.16 -0.01 -0.63 0.52 0.00 0.00 175.17 174.64 2pvh s ILE 100 N -3.86 0.32 0.08 4.11 1.01 -1.26 -0.10 121.20 121.49 2pvh s ILE 100 Ca 0.08 0.07 -0.01 0.00 0.00 0.00 0.00 60.65 60.79 2pvh s ILE 100 Cb -0.03 -0.43 -0.04 0.00 0.01 0.00 0.00 42.46 41.97 2pvh s ILE 100 CO -0.01 0.21 0.00 0.68 0.00 0.00 0.00 174.94 175.82 2pvh s VAL 101 N 1.43 0.18 0.05 2.92 -7.23 0.05 0.33 120.40 118.13 2pvh s VAL 101 Ca -0.04 -1.82 0.00 0.00 -1.81 0.00 0.00 61.98 58.32 2pvh s VAL 101 Cb -0.13 -1.67 -0.03 0.00 0.56 0.00 0.00 36.38 35.11 2pvh s VAL 101 CO -0.03 -0.83 -0.04 0.00 -0.31 0.00 0.00 175.10 173.89 2pvh s ARG 102 N -3.96 0.53 -0.25 4.82 1.70 -1.26 0.13 118.95 120.66 2pvh s ARG 102 Ca 0.12 -0.96 -0.26 0.00 -0.47 0.00 0.00 55.73 54.16 2pvh s ARG 102 Cb 0.08 0.04 -0.00 0.00 -0.57 0.00 0.00 34.95 34.50 2pvh s ARG 102 CO -0.07 -0.05 0.88 0.34 -1.08 0.00 0.00 175.30 175.32 2pvh s ASP 103 N -2.25 6.87 0.16 -2.89 2.15 0.39 -4.69 116.67 116.40 2pvh s ASP 103 Ca -0.02 1.06 -0.25 0.00 0.43 0.00 0.00 52.55 53.76 2pvh s ASP 103 Cb -0.01 -2.46 0.03 0.00 -0.30 0.00 0.00 42.92 40.18 2pvh s ASP 103 CO -0.05 -0.58 1.59 -0.61 -0.17 0.00 0.00 175.17 175.35 2pvh h GLN 104 N 7.71 -0.29 0.37 4.34 4.15 -1.95 0.99 115.11 130.43 2pvh h GLN 104 Ca -0.22 0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.20 2pvh h GLN 104 Cb 1.08 0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.85 2pvh h GLN 104 CO 0.90 -0.20 -0.18 1.25 -1.93 0.00 0.00 178.83 178.68 2pvh h HIS 105 N -0.31 -0.47 0.00 3.99 2.76 -1.99 -3.31 115.15 115.82 2pvh h HIS 105 Ca 0.15 -0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 58.24 2pvh h HIS 105 Cb 0.56 0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.67 2pvh h HIS 105 CO -0.56 -0.17 -0.81 0.66 -1.30 0.00 0.00 177.93 175.75 2pvh h SER 106 N -0.73 0.00 -0.17 3.26 4.64 -1.98 -3.47 113.55 115.10 2pvh h SER 106 Ca -0.05 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.20 2pvh h SER 106 Cb 0.50 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.57 2pvh h SER 106 CO 0.08 0.28 -0.07 0.29 -0.87 0.00 0.00 176.83 176.55 2pvh n LYS 107 N -2.95 -0.42 -1.94 4.77 4.76 0.34 -4.96 118.16 117.75 2pvh n LYS 107 Ca -0.02 0.49 -0.42 0.00 -2.87 0.00 0.00 58.31 55.49 2pvh n LYS 107 Cb 0.67 -4.10 -0.03 0.00 -1.84 0.00 0.00 35.03 29.73 2pvh n LYS 107 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 2pvh s THR 108 N -2.04 3.46 0.31 -0.18 2.01 -1.24 -4.59 115.64 113.37 2pvh s THR 108 Ca 0.00 0.54 -0.14 0.00 0.31 0.00 0.00 61.69 62.41 2pvh s THR 108 Cb 0.00 -3.41 -0.09 0.00 0.01 0.00 0.00 72.50 69.02 2pvh s THR 108 CO 0.00 -0.11 0.70 -2.16 -0.69 0.00 0.00 174.62 172.36 2pvh s PRO 109 N 4.52 3.96 -0.03 4.92 0.04 -1.26 -0.47 135.00 146.68 2pvh s PRO 109 Ca 0.78 0.58 0.02 0.00 0.04 0.00 0.00 61.00 62.42 2pvh s PRO 109 Cb -0.32 -2.47 0.01 0.00 0.04 0.00 0.00 34.50 31.75 2pvh s PRO 109 CO 0.32 0.18 -0.06 -1.12 0.04 0.00 0.00 177.00 176.36 2pvh s SER 110 N -2.32 0.92 -0.17 6.66 0.01 0.34 -1.26 113.70 117.88 2pvh s SER 110 Ca 0.53 -0.14 -0.06 0.00 1.31 0.00 0.00 55.95 57.59 2pvh s SER 110 Cb -0.10 -0.29 -0.04 0.00 0.21 0.00 0.00 66.02 65.80 2pvh s SER 110 CO 0.18 0.02 0.03 -0.76 0.41 0.00 0.00 173.24 173.12 2pvh s LEU 111 N 0.38 3.63 -0.23 2.44 1.43 -0.42 -0.77 118.68 125.14 2pvh s LEU 111 Ca -0.05 0.02 -0.10 0.00 -1.03 0.00 0.00 54.13 52.97 2pvh s LEU 111 Cb -0.09 -1.90 -0.05 0.00 0.03 0.00 0.00 46.19 44.18 2pvh s LEU 111 CO 0.00 0.18 0.14 -0.63 0.23 0.00 0.00 176.35 176.27 2pvh s ILE 112 N 0.31 5.28 0.18 -0.59 -1.09 0.86 -1.61 121.20 124.53 2pvh s ILE 112 Ca 0.01 0.15 0.10 0.00 -2.23 0.00 0.00 60.65 58.68 2pvh s ILE 112 Cb -0.13 -3.44 -0.04 0.00 -1.58 0.00 0.00 42.46 37.26 2pvh s ILE 112 CO 0.01 0.38 -0.22 -0.36 -1.23 0.00 0.00 174.94 173.52 2pvh s PHE 113 N 0.86 2.09 0.64 3.97 0.08 -0.14 0.42 117.98 125.90 2pvh s PHE 113 Ca 0.07 -0.40 -0.18 0.00 0.12 0.00 0.00 56.93 56.54 2pvh s PHE 113 Cb -0.13 -1.04 -0.01 0.00 -0.57 0.00 0.00 43.02 41.26 2pvh s PHE 113 CO 0.03 0.42 1.27 -2.00 -0.10 0.00 0.00 175.22 174.84 2pvh s GLU 114 N -2.66 2.61 0.38 0.44 2.12 -0.69 -0.02 118.70 120.88 2pvh s GLU 114 Ca 0.18 2.01 -0.21 0.00 0.36 0.00 0.00 54.97 57.30 2pvh s GLU 114 Cb -0.07 -1.86 -0.10 0.00 0.26 0.00 0.00 34.13 32.35 2pvh s GLU 114 CO 0.08 -1.54 0.91 -0.47 -0.54 0.00 0.00 175.26 173.70 2pvh s TYR 115 N -1.46 3.42 -0.06 5.30 5.04 -1.26 -4.36 117.35 123.97 2pvh s TYR 115 Ca 0.81 1.59 -0.03 0.00 -2.44 0.00 0.00 57.07 57.01 2pvh s TYR 115 Cb -0.36 -2.82 0.04 0.00 0.35 0.00 0.00 41.96 39.17 2pvh s TYR 115 CO 0.39 0.01 0.11 0.08 -1.34 0.00 0.00 175.55 174.80 2pvh s VAL 116 N -1.99 -0.17 -1.08 3.14 1.01 -1.26 -5.01 120.40 115.04 2pvh s VAL 116 Ca 0.57 0.37 -0.19 0.00 0.00 0.00 0.00 61.98 62.73 2pvh s VAL 116 Cb -0.12 -0.22 0.10 0.00 0.00 0.00 0.00 36.38 36.14 2pvh s VAL 116 CO 0.16 0.15 1.41 0.21 0.00 0.00 0.00 175.10 177.04 2pvh s ASN 117 N 2.09 6.69 0.68 3.32 2.47 -1.26 -4.99 114.94 123.94 2pvh s ASN 117 Ca 0.02 -2.05 -0.11 0.00 0.42 0.00 0.00 52.86 51.14 2pvh s ASN 117 Cb -0.12 -2.50 0.00 0.00 -1.45 0.00 0.00 41.25 37.18 2pvh s ASN 117 CO -0.04 -1.20 1.07 0.21 -3.72 0.00 0.00 177.10 173.41 2pvh s ASN 118 N 4.13 5.60 -0.17 -4.21 2.47 -1.26 -3.92 114.94 117.57 2pvh s ASN 118 Ca 0.43 1.33 -0.00 0.00 0.42 0.00 0.00 52.86 55.04 2pvh s ASN 118 Cb -0.01 -2.22 0.04 0.00 -1.45 0.00 0.00 41.25 37.61 2pvh s ASN 118 CO -0.05 -1.27 -0.07 -0.89 -3.72 0.00 0.00 177.10 171.11 2pvh s THR 119 N -3.22 1.28 -0.23 -5.21 2.01 -0.91 -4.96 115.64 104.40 2pvh s THR 119 Ca 0.57 -0.74 -0.35 0.00 0.31 0.00 0.00 61.69 61.48 2pvh s THR 119 Cb -0.12 -1.42 -0.16 0.00 0.01 0.00 0.00 72.50 70.81 2pvh s THR 119 CO 0.53 0.15 1.10 -0.67 -0.69 0.00 0.00 174.62 175.04 2pvh n ASP 120 N 4.82 0.55 0.28 3.53 2.03 -1.26 -4.57 116.55 121.92 2pvh n ASP 120 Ca -0.13 0.94 0.11 0.00 0.52 0.00 0.00 54.79 56.23 2pvh n ASP 120 Cb 0.47 -0.72 0.75 0.00 -0.72 0.00 0.00 41.12 40.91 2pvh n ASP 120 CO 0.00 0.00 0.00 2.19 -1.92 0.00 0.00 177.20 177.47 2pvh h PHE 121 N 3.32 0.00 0.00 -0.67 -0.00 -1.94 -0.45 116.94 117.20 2pvh h PHE 121 Ca -0.38 0.00 -0.02 0.00 -0.00 0.00 0.00 57.97 57.57 2pvh h PHE 121 Cb 1.12 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 37.07 2pvh h PHE 121 CO 0.49 0.00 -0.10 0.87 -0.00 0.00 0.00 178.31 179.58 2pvh h LYS 122 N 0.00 0.00 0.00 6.09 1.79 -2.00 -1.87 116.57 120.58 2pvh h LYS 122 Ca -0.00 0.00 -0.36 0.00 -2.18 0.00 0.00 60.65 58.11 2pvh h LYS 122 Cb 0.01 0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 30.59 2pvh h LYS 122 CO 0.00 0.10 -2.38 0.28 -1.08 0.00 0.00 179.45 176.37 2pvh n VAL 123 N -4.19 1.38 0.26 0.50 0.31 -0.66 -4.62 118.33 111.32 2pvh n VAL 123 Ca -0.03 -0.64 -0.13 0.00 -0.01 0.00 0.00 64.34 63.54 2pvh n VAL 123 Cb 0.18 -1.07 -0.07 0.00 -0.91 0.00 0.00 33.84 31.98 2pvh n VAL 123 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 2pvh h LEU 124 N 0.00 -0.60 -0.85 7.52 5.85 -1.02 -3.36 115.31 122.85 2pvh h LEU 124 Ca -0.54 -0.04 0.19 0.00 0.84 0.00 0.00 57.88 58.32 2pvh h LEU 124 Cb 1.97 0.16 -0.16 0.00 0.37 0.00 0.00 40.66 43.00 2pvh h LEU 124 CO -0.05 -0.21 -0.14 1.88 -0.34 0.00 0.00 178.44 179.59 2pvh h TYR 125 N -1.09 -0.31 0.00 1.25 -1.99 -1.60 0.06 116.97 113.30 2pvh h TYR 125 Ca -0.07 0.07 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2pvh h TYR 125 Cb 0.61 0.27 0.00 0.00 2.00 0.00 0.00 36.73 39.61 2pvh h TYR 125 CO 0.01 -0.35 0.15 -1.35 -0.00 0.00 0.00 178.16 176.62 2pvh h PRO 126 N 0.02 0.00 -0.00 4.88 0.11 -1.79 -1.48 132.00 133.74 2pvh h PRO 126 Ca 0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.55 2pvh h PRO 126 Cb 0.73 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.84 2pvh h PRO 126 CO -0.84 0.00 -0.85 0.25 -0.21 0.00 0.00 178.00 176.35 2pvh n THR 127 N -2.88 0.00 -1.92 -1.15 -2.24 -0.00 -4.97 114.28 101.11 2pvh n THR 127 Ca -0.02 -0.08 -0.41 0.00 -2.27 0.00 0.00 64.05 61.27 2pvh n THR 127 Cb 0.21 1.02 -0.02 0.00 -2.10 0.00 0.00 70.33 69.43 2pvh n THR 127 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2pvh s LEU 128 N -2.84 4.37 0.77 3.22 1.43 -0.56 -5.01 118.68 120.07 2pvh s LEU 128 Ca 0.08 2.77 -0.09 0.00 -1.03 0.00 0.00 54.13 55.86 2pvh s LEU 128 Cb 0.14 -3.63 0.09 0.00 0.03 0.00 0.00 46.19 42.83 2pvh s LEU 128 CO 0.75 -0.78 1.11 0.42 0.23 0.00 0.00 176.35 178.07 2pvh s THR 129 N -0.00 2.15 0.21 5.49 -4.23 -1.26 -4.86 115.64 113.14 2pvh s THR 129 Ca 0.61 -0.18 -0.09 0.00 -1.18 0.00 0.00 61.69 60.85 2pvh s THR 129 Cb -0.44 -2.97 0.15 0.00 1.34 0.00 0.00 72.50 70.59 2pvh s THR 129 CO 0.45 0.00 1.74 -0.78 -0.54 0.00 0.00 174.62 175.49 2pvh h ASP 130 N -0.88 0.20 0.09 3.99 1.82 -1.95 -1.14 116.42 118.54 2pvh h ASP 130 Ca -0.44 0.09 -0.10 0.00 -0.39 0.00 0.00 57.03 56.18 2pvh h ASP 130 Cb 1.30 0.07 -0.01 0.00 0.68 0.00 0.00 39.33 41.38 2pvh h ASP 130 CO 0.57 0.11 -0.34 0.22 -1.61 0.00 0.00 179.24 178.20 2pvh h TYR 131 N 0.39 0.41 -0.78 0.28 3.20 -1.96 -2.86 116.97 115.65 2pvh h TYR 131 Ca 0.32 -0.10 -0.04 0.00 3.14 0.00 0.00 58.73 62.05 2pvh h TYR 131 Cb 0.41 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.55 2pvh h TYR 131 CO -0.18 0.65 0.33 -0.44 -1.64 0.00 0.00 178.16 176.89 2pvh h ASP 132 N 0.31 1.05 -0.54 -2.11 3.32 -1.59 -0.56 116.42 116.29 2pvh h ASP 132 Ca 0.04 -0.15 -0.03 0.00 0.02 0.00 0.00 57.03 56.91 2pvh h ASP 132 Cb 0.74 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 40.00 2pvh h ASP 132 CO 0.06 0.92 0.23 0.40 -1.72 0.00 0.00 179.24 179.12 2pvh h ILE 133 N 1.12 1.22 -0.13 0.35 2.04 -1.13 -0.24 117.51 120.74 2pvh h ILE 133 Ca 0.26 -0.66 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 2pvh h ILE 133 Cb 0.18 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 2pvh h ILE 133 CO -0.03 0.26 0.03 0.03 0.00 0.00 0.00 178.15 178.44 2pvh h ARG 134 N 0.74 0.22 0.42 2.37 3.08 -1.31 -1.03 114.38 118.86 2pvh h ARG 134 Ca 0.18 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.17 2pvh h ARG 134 Cb 0.18 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 2pvh h ARG 134 CO -0.02 0.38 -0.38 -0.92 -1.07 0.00 0.00 179.97 177.97 2pvh h TYR 135 N 0.01 -1.03 -0.69 3.04 3.20 -0.95 -0.08 116.97 120.47 2pvh h TYR 135 Ca 0.04 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.85 2pvh h TYR 135 Cb 0.26 0.39 -0.03 0.00 1.54 0.00 0.00 36.73 38.90 2pvh h TYR 135 CO 0.01 -0.54 0.18 1.88 -1.64 0.00 0.00 178.16 178.05 2pvh h TYR 136 N -0.81 1.16 -0.37 -3.82 0.05 -1.05 -0.94 116.97 111.19 2pvh h TYR 136 Ca -0.04 -0.13 -0.05 0.00 0.05 0.00 0.00 58.73 58.56 2pvh h TYR 136 Cb 0.71 -0.33 -0.02 0.00 1.01 0.00 0.00 36.73 38.10 2pvh h TYR 136 CO -0.19 0.94 0.00 0.82 -1.05 0.00 0.00 178.16 178.68 2pvh h ILE 137 N 1.04 1.21 -0.28 -2.88 1.08 -1.11 -0.12 117.51 116.44 2pvh h ILE 137 Ca 0.22 -0.82 -0.04 0.00 -0.39 0.00 0.00 64.86 63.83 2pvh h ILE 137 Cb 0.36 0.92 -0.01 0.00 -3.07 0.00 0.00 36.82 35.02 2pvh h ILE 137 CO 0.00 0.28 0.04 0.22 -0.69 0.00 0.00 178.15 178.00 2pvh h TYR 138 N 0.55 0.50 -0.82 1.37 3.20 -0.50 -1.01 116.97 120.26 2pvh h TYR 138 Ca 0.12 -0.07 -0.03 0.00 3.14 0.00 0.00 58.73 61.89 2pvh h TYR 138 Cb 0.35 -0.14 -0.04 0.00 1.54 0.00 0.00 36.73 38.44 2pvh h TYR 138 CO 0.01 0.58 0.40 0.93 -1.64 0.00 0.00 178.16 178.45 2pvh h GLU 139 N 0.28 1.17 -0.33 1.82 4.39 -0.68 -1.29 114.58 119.95 2pvh h GLU 139 Ca 0.08 -0.16 -0.07 0.00 0.34 0.00 0.00 59.36 59.55 2pvh h GLU 139 Cb 0.35 -0.22 -0.02 0.00 -0.10 0.00 0.00 28.75 28.77 2pvh h GLU 139 CO 0.01 0.89 -0.08 1.25 -1.16 0.00 0.00 179.01 179.93 2pvh h LEU 140 N 1.16 0.52 -1.39 1.33 5.85 -0.85 -2.33 115.31 119.61 2pvh h LEU 140 Ca 0.28 -0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.84 2pvh h LEU 140 Cb 0.10 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 2pvh h LEU 140 CO -0.04 0.64 -0.06 -0.07 -0.34 0.00 0.00 178.44 178.58 2pvh h LEU 141 N 0.51 0.31 -0.66 2.25 3.38 -0.07 -1.90 115.31 119.12 2pvh h LEU 141 Ca 0.10 -0.05 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 2pvh h LEU 141 Cb 0.44 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 2pvh h LEU 141 CO 0.02 0.42 0.09 0.11 0.09 0.00 0.00 178.44 179.17 2pvh h LYS 142 N 0.32 1.10 -0.57 1.13 1.57 -0.79 -1.09 116.57 118.25 2pvh h LYS 142 Ca 0.07 -0.31 -0.04 0.00 -1.87 0.00 0.00 60.65 58.50 2pvh h LYS 142 Cb 0.32 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.48 2pvh h LYS 142 CO 0.01 1.02 0.19 0.00 -0.57 0.00 0.00 179.45 180.11 2pvh h ALA 143 N 1.04 0.74 -0.19 3.86 0.00 -1.24 -1.18 119.26 122.29 2pvh h ALA 143 Ca 0.20 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 2pvh h ALA 143 Cb 0.46 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 2pvh h ALA 143 CO 0.02 0.39 -0.20 -0.07 0.00 0.00 0.00 179.25 179.38 2pvh h LEU 144 N 0.79 0.50 -1.24 0.00 3.38 -1.17 -1.19 115.31 116.37 2pvh h LEU 144 Ca 0.18 -0.48 -0.03 0.00 0.09 0.00 0.00 57.88 57.64 2pvh h LEU 144 Cb 0.26 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 2pvh h LEU 144 CO -0.01 0.88 0.22 -0.78 0.09 0.00 0.00 178.44 178.84 2pvh h ASP 145 N 0.13 0.67 0.21 -0.43 3.58 -1.18 -0.12 116.42 119.28 2pvh h ASP 145 Ca 0.03 -0.07 -0.01 0.00 0.42 0.00 0.00 57.03 57.39 2pvh h ASP 145 Cb 0.75 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.63 2pvh h ASP 145 CO 0.05 0.60 -0.10 0.22 -2.88 0.00 0.00 179.24 177.13 2pvh h TYR 146 N 0.74 -0.26 -0.59 0.28 3.20 -1.07 -0.60 116.97 118.67 2pvh h TYR 146 Ca 0.18 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.00 2pvh h TYR 146 Cb 0.13 0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.46 2pvh h TYR 146 CO 0.01 0.05 0.20 0.00 -1.64 0.00 0.00 178.16 176.78 2pvh h HIS 148 N 0.85 1.10 0.00 0.00 3.86 -0.97 -0.63 115.15 119.35 2pvh h HIS 148 Ca 0.20 -0.10 0.00 0.00 -1.16 0.00 0.00 60.37 59.31 2pvh h HIS 148 Cb 0.23 -0.32 0.00 0.00 1.06 0.00 0.00 27.41 28.37 2pvh h HIS 148 CO 0.01 0.86 0.00 0.66 0.86 0.00 0.00 177.93 180.33 2pvh h SER 149 N 1.01 0.00 -0.51 2.45 4.64 -0.35 -0.24 113.55 120.56 2pvh h SER 149 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 2pvh h SER 149 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 2pvh h SER 149 CO -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.95 2pvh n GLN 150 N -2.48 4.10 -2.20 4.77 1.13 -0.58 -4.95 117.38 117.17 2pvh n GLN 150 Ca 0.00 -2.99 -0.13 0.00 -1.94 0.00 0.00 57.00 51.94 2pvh n GLN 150 Cb 0.15 -2.04 -0.01 0.00 0.11 0.00 0.00 30.24 28.45 2pvh n GLN 150 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2pvh n GLY 151 N 0.47 -0.09 3.11 1.08 0.00 -0.10 -4.90 105.19 104.75 2pvh n GLY 151 Ca 0.25 -0.32 -0.24 0.00 0.00 0.00 0.00 46.02 45.71 2pvh n GLY 151 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2pvh s ILE 152 N -2.66 1.23 -0.16 -0.61 1.01 -0.35 -0.49 121.20 119.16 2pvh s ILE 152 Ca 0.00 -0.62 -0.07 0.00 0.00 0.00 0.00 60.65 59.96 2pvh s ILE 152 Cb 0.00 -1.05 -0.04 0.00 0.01 0.00 0.00 42.46 41.38 2pvh s ILE 152 CO 0.00 0.36 0.06 -0.04 0.00 0.00 0.00 174.94 175.32 2pvh s MET 153 N -0.05 3.81 0.05 2.79 -1.94 -0.13 -3.18 119.30 120.64 2pvh s MET 153 Ca -0.01 -0.34 -0.19 0.00 -1.71 0.00 0.00 55.69 53.45 2pvh s MET 153 Cb -0.09 -3.15 -0.15 0.00 2.01 0.00 0.00 34.83 33.44 2pvh s MET 153 CO 0.01 0.37 1.29 1.25 -0.01 0.00 0.00 175.02 177.93 2pvh h HIS 154 N 6.35 0.60 -0.47 -0.03 2.76 -1.91 -1.48 115.15 120.97 2pvh h HIS 154 Ca -0.40 -0.22 -0.20 0.00 -2.20 0.00 0.00 60.37 57.35 2pvh h HIS 154 Cb 1.18 -0.11 -0.08 0.00 1.55 0.00 0.00 27.41 29.95 2pvh h HIS 154 CO 0.59 0.94 -0.18 0.54 -1.30 0.00 0.00 177.93 178.51 2pvh n ARG 155 N -4.37 -1.27 -2.55 5.26 1.74 -1.26 -2.41 116.66 111.79 2pvh n ARG 155 Ca -0.07 0.80 -0.02 0.00 -0.77 0.00 0.00 57.85 57.80 2pvh n ARG 155 Cb 0.48 -4.97 0.11 0.00 -1.02 0.00 0.00 32.46 27.06 2pvh n ARG 155 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2pvh n ASP 156 N -0.65 -1.15 -4.70 0.55 2.03 -1.26 -0.53 116.55 110.83 2pvh n ASP 156 Ca -0.10 -2.18 -0.42 0.00 0.52 0.00 0.00 54.79 52.60 2pvh n ASP 156 Cb 0.47 0.55 -0.03 0.00 -0.72 0.00 0.00 41.12 41.40 2pvh n ASP 156 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2pvh s VAL 157 N -0.22 3.32 -0.18 5.18 1.01 -1.26 -4.80 120.40 123.44 2pvh s VAL 157 Ca 0.10 0.85 -0.33 0.00 0.00 0.00 0.00 61.98 62.60 2pvh s VAL 157 Cb 0.41 -3.55 0.14 0.00 0.00 0.00 0.00 36.38 33.38 2pvh s VAL 157 CO -0.11 0.03 1.17 -1.59 0.00 0.00 0.00 175.10 174.60 2pvh s LYS 158 N 1.84 0.36 0.30 2.72 -2.85 -1.26 -4.75 119.74 116.10 2pvh s LYS 158 Ca 0.67 -0.07 -0.00 0.00 -1.00 0.00 0.00 55.97 55.57 2pvh s LYS 158 Cb -0.36 0.17 0.69 0.00 -2.06 0.00 0.00 37.83 36.27 2pvh s LYS 158 CO 0.30 -0.15 1.58 -1.35 0.10 0.00 0.00 175.35 175.83 2pvh h PRO 159 N 2.09 0.02 0.00 1.78 0.11 -1.93 0.15 132.00 134.23 2pvh h PRO 159 Ca -0.12 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.99 2pvh h PRO 159 Cb 1.18 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 2pvh h PRO 159 CO 0.25 0.02 -0.00 0.45 -0.21 0.00 0.00 178.00 178.50 2pvh h HIS 160 N 0.02 0.00 -0.54 0.65 3.86 -1.97 -1.31 115.15 115.86 2pvh h HIS 160 Ca 0.57 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.78 2pvh h HIS 160 Cb 1.13 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.60 2pvh h HIS 160 CO -0.51 0.00 0.00 0.09 0.86 0.00 0.00 177.93 178.38 2pvh n ASN 161 N -3.18 3.77 -4.05 2.45 3.02 0.52 -4.77 115.26 113.03 2pvh n ASN 161 Ca -0.03 -2.18 -0.32 0.00 -0.03 0.00 0.00 54.58 52.03 2pvh n ASN 161 Cb 0.09 -0.42 -0.14 0.00 -0.61 0.00 0.00 39.78 38.69 2pvh n ASN 161 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2pvh s VAL 162 N -1.32 2.42 -0.04 2.41 1.01 -0.49 -0.01 120.40 124.37 2pvh s VAL 162 Ca 0.40 -2.18 -0.29 0.00 0.00 0.00 0.00 61.98 59.91 2pvh s VAL 162 Cb 0.23 -2.71 -0.03 0.00 0.00 0.00 0.00 36.38 33.88 2pvh s VAL 162 CO 0.23 -0.52 0.93 -0.04 0.00 0.00 0.00 175.10 175.71 2pvh s MET 163 N 0.97 4.49 -0.11 2.72 -1.94 0.29 -4.92 119.30 120.81 2pvh s MET 163 Ca 0.07 1.31 0.00 0.00 -1.71 0.00 0.00 55.69 55.36 2pvh s MET 163 Cb -0.20 -3.48 0.02 0.00 2.01 0.00 0.00 34.83 33.18 2pvh s MET 163 CO -0.07 -0.11 -0.09 0.42 -0.01 0.00 0.00 175.02 175.16 2pvh s ILE 164 N 1.27 1.12 -0.77 2.53 1.01 -1.26 -1.11 121.20 123.99 2pvh s ILE 164 Ca 0.48 -0.36 -0.15 0.00 0.00 0.00 0.00 60.65 60.62 2pvh s ILE 164 Cb -0.20 -1.10 0.19 0.00 0.01 0.00 0.00 42.46 41.36 2pvh s ILE 164 CO 0.23 0.38 0.75 -0.62 0.00 0.00 0.00 174.94 175.68 2pvh s ASP 165 N 1.51 6.62 0.54 3.58 -1.08 -0.23 -2.14 116.67 125.46 2pvh s ASP 165 Ca 0.02 -2.40 0.20 0.00 -0.52 0.00 0.00 52.55 49.85 2pvh s ASP 165 Cb -0.13 -2.23 1.42 0.00 -1.46 0.00 0.00 42.92 40.52 2pvh s ASP 165 CO -0.07 -0.70 2.17 -0.74 0.52 0.00 0.00 175.17 176.36 2pvh h HIS 166 N 8.15 0.00 -0.02 -5.34 -0.00 -1.83 0.47 115.15 116.57 2pvh h HIS 166 Ca 0.02 0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 60.38 2pvh h HIS 166 Cb 1.05 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 28.46 2pvh h HIS 166 CO 0.98 0.00 -0.00 1.49 -0.00 0.00 0.00 177.93 180.40 2pvh h GLU 167 N 0.00 0.05 -0.08 5.26 4.57 -1.92 -3.13 114.58 119.33 2pvh h GLU 167 Ca 0.01 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 2pvh h GLU 167 Cb 0.05 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.63 2pvh h GLU 167 CO -0.00 0.38 0.00 1.28 -1.18 0.00 0.00 179.01 179.49 2pvh n LEU 168 N -4.89 1.85 -4.04 1.64 4.77 -1.00 -4.94 117.00 110.39 2pvh n LEU 168 Ca -0.08 -0.67 -0.31 0.00 -0.03 0.00 0.00 56.01 54.92 2pvh n LEU 168 Cb 0.20 -0.04 -0.01 0.00 -2.33 0.00 0.00 43.42 41.24 2pvh n LEU 168 CO 0.34 0.34 -0.03 0.54 -1.33 0.00 0.00 177.39 177.24 2pvh n ARG 169 N 0.44 -4.04 -4.21 3.23 1.74 0.16 -4.96 116.66 109.02 2pvh n ARG 169 Ca 0.18 0.46 -0.35 0.00 -0.77 0.00 0.00 57.85 57.37 2pvh n ARG 169 Cb 0.39 -5.10 -0.08 0.00 -1.02 0.00 0.00 32.46 26.65 2pvh n ARG 169 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2pvh s LYS 170 N -6.69 3.09 0.00 5.56 1.02 -0.91 -4.96 119.74 116.85 2pvh s LYS 170 Ca 0.51 -0.37 0.04 0.00 0.02 0.00 0.00 55.97 56.17 2pvh s LYS 170 Cb -0.27 -2.89 -0.01 0.00 -0.52 0.00 0.00 37.83 34.14 2pvh s LYS 170 CO 0.88 0.71 -0.13 -1.17 -0.92 0.00 0.00 175.35 174.71 2pvh s LEU 171 N -1.10 2.07 -0.02 3.17 0.20 -1.26 -1.07 118.68 120.67 2pvh s LEU 171 Ca 0.16 -0.30 0.00 0.00 0.69 0.00 0.00 54.13 54.67 2pvh s LEU 171 Cb -0.12 -0.65 0.02 0.00 -0.43 0.00 0.00 46.19 45.01 2pvh s LEU 171 CO 0.05 0.12 0.02 -0.13 -0.29 0.00 0.00 176.35 176.12 2pvh s ARG 172 N -0.56 0.01 -0.24 1.98 1.81 -0.27 -4.54 118.95 117.14 2pvh s ARG 172 Ca 0.04 0.14 -0.20 0.00 -1.72 0.00 0.00 55.73 53.99 2pvh s ARG 172 Cb -0.06 -0.23 -0.02 0.00 -0.45 0.00 0.00 34.95 34.19 2pvh s ARG 172 CO 0.00 -0.13 0.62 -1.17 -0.68 0.00 0.00 175.30 173.94 2pvh s LEU 173 N 0.85 4.08 0.00 2.53 2.96 0.14 -0.55 118.68 128.69 2pvh s LEU 173 Ca -0.07 0.72 0.01 0.00 -0.22 0.00 0.00 54.13 54.57 2pvh s LEU 173 Cb -0.10 -2.84 0.01 0.00 0.50 0.00 0.00 46.19 43.76 2pvh s LEU 173 CO -0.02 -0.34 0.11 2.30 -1.32 0.00 0.00 176.35 177.08 2pvh n ILE 174 N 5.07 0.00 -3.19 6.68 -5.35 0.99 -2.50 119.36 121.07 2pvh n ILE 174 Ca -0.01 -2.00 -0.23 0.00 -0.27 0.00 0.00 62.75 60.25 2pvh n ILE 174 Cb 0.49 0.25 0.02 0.00 -1.74 0.00 0.00 39.64 38.67 2pvh n ILE 174 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 2pvh n ASP 175 N -1.45 -6.74 -1.21 7.28 -0.08 -1.26 -4.83 116.55 108.25 2pvh n ASP 175 Ca -0.13 0.15 0.04 0.00 -1.51 0.00 0.00 54.79 53.34 2pvh n ASP 175 Cb 0.55 -3.57 0.21 0.00 2.34 0.00 0.00 41.12 40.65 2pvh n ASP 175 CO 0.00 0.00 0.00 0.79 0.12 0.00 0.00 177.20 178.11 2pvh n TRP 176 N -0.36 1.07 0.28 -0.67 7.02 -1.26 -4.39 117.44 119.12 2pvh n TRP 176 Ca 0.01 -0.37 0.17 0.00 -1.02 0.00 0.00 57.50 56.28 2pvh n TRP 176 Cb 0.57 -0.31 0.93 0.00 -2.42 0.00 0.00 31.31 30.08 2pvh n TRP 176 CO 0.00 0.00 0.00 0.78 -2.02 0.00 0.00 177.69 176.45 2pvh h GLY 177 N 4.52 0.00 -1.25 6.99 0.00 -1.91 -1.54 103.07 109.88 2pvh h GLY 177 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2pvh h GLY 177 CO 0.25 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.83 2pvh n LEU 178 N -3.70 2.43 -4.66 3.11 4.77 -1.26 -4.84 117.00 112.85 2pvh n LEU 178 Ca -0.02 -1.27 -0.30 0.00 -0.03 0.00 0.00 56.01 54.39 2pvh n LEU 178 Cb 0.17 -0.08 0.17 0.00 -2.33 0.00 0.00 43.42 41.35 2pvh n LEU 178 CO 0.26 0.50 0.63 0.00 -1.33 0.00 0.00 177.39 177.46 2pvh s ALA 179 N -1.11 1.05 0.01 -1.18 0.00 -0.58 -4.62 121.76 115.33 2pvh s ALA 179 Ca 0.20 0.05 -0.27 0.00 0.00 0.00 0.00 51.96 51.94 2pvh s ALA 179 Cb 0.13 -3.25 0.06 0.00 0.00 0.00 0.00 23.12 20.05 2pvh s ALA 179 CO 0.18 -2.79 0.61 -2.00 0.00 0.00 0.00 175.76 171.77 2pvh s GLU 180 N -4.77 1.08 0.31 0.00 2.56 -0.56 -4.92 118.70 112.41 2pvh s GLU 180 Ca 0.65 -0.01 -0.27 0.00 0.00 0.00 0.00 54.97 55.35 2pvh s GLU 180 Cb -0.21 0.50 -0.10 0.00 2.00 0.00 0.00 34.13 36.33 2pvh s GLU 180 CO 0.59 -0.38 0.97 -0.06 -0.56 0.00 0.00 175.26 175.82 2pvh s PHE 181 N -1.96 3.69 -0.13 5.30 0.40 -1.26 -0.95 117.98 123.07 2pvh s PHE 181 Ca -0.08 1.79 -0.18 0.00 -0.60 0.00 0.00 56.93 57.86 2pvh s PHE 181 Cb -0.01 -2.98 -0.04 0.00 0.51 0.00 0.00 43.02 40.50 2pvh s PHE 181 CO 0.03 0.10 0.47 -0.47 0.70 0.00 0.00 175.22 176.05 2pvh s TYR 182 N -1.51 3.50 -0.09 0.36 5.04 0.36 -4.89 117.35 120.12 2pvh s TYR 182 Ca 0.49 0.87 -0.00 0.00 -2.44 0.00 0.00 57.07 55.99 2pvh s TYR 182 Cb -0.21 -2.55 0.02 0.00 0.35 0.00 0.00 41.96 39.57 2pvh s TYR 182 CO 0.27 0.15 -0.05 -1.01 -1.34 0.00 0.00 175.55 173.57 2pvh s HIS 183 N 0.69 1.15 -0.05 4.97 3.76 -1.26 -4.56 115.29 119.99 2pvh s HIS 183 Ca 0.25 -0.48 -0.38 0.00 -0.15 0.00 0.00 55.06 54.30 2pvh s HIS 183 Cb -0.15 -1.02 -0.17 0.00 1.11 0.00 0.00 32.58 32.35 2pvh s HIS 183 CO 0.10 -0.40 1.45 -2.30 -0.85 0.00 0.00 174.74 172.74 2pvh n PRO 184 N 4.80 1.01 0.00 8.40 -0.02 -1.26 -1.23 135.00 146.70 2pvh n PRO 184 Ca -0.13 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 2pvh n PRO 184 Cb 0.50 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 2pvh n PRO 184 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2pvh n GLY 185 N 2.98 2.86 3.76 -1.23 0.00 -1.26 -5.01 105.19 107.30 2pvh n GLY 185 Ca 0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.82 2pvh n GLY 185 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2pvh s LYS 186 N -0.07 4.24 -0.35 1.61 2.20 -0.36 -4.90 119.74 122.10 2pvh s LYS 186 Ca 0.00 2.37 -0.17 0.00 -0.36 0.00 0.00 55.97 57.82 2pvh s LYS 186 Cb 0.00 -3.06 -0.01 0.00 -1.51 0.00 0.00 37.83 33.26 2pvh s LYS 186 CO 0.00 -0.41 0.43 -1.21 -0.36 0.00 0.00 175.35 173.80 2pvh s GLU 187 N -1.13 3.55 0.37 4.03 2.02 -1.26 -4.26 118.70 122.03 2pvh s GLU 187 Ca 0.56 -0.33 0.06 0.00 0.02 0.00 0.00 54.97 55.27 2pvh s GLU 187 Cb -0.43 -3.82 -0.00 0.00 0.10 0.00 0.00 34.13 29.98 2pvh s GLU 187 CO 0.51 -0.60 0.53 0.71 0.02 0.00 0.00 175.26 176.42 2pvh s TYR 188 N 2.18 3.08 0.19 1.61 1.51 -0.60 -4.96 117.35 120.36 2pvh s TYR 188 Ca 0.15 -0.17 -0.30 0.00 -1.01 0.00 0.00 57.07 55.74 2pvh s TYR 188 Cb -0.16 -2.13 -0.08 0.00 -0.11 0.00 0.00 41.96 39.48 2pvh s TYR 188 CO 0.12 -0.15 1.18 1.21 -1.11 0.00 0.00 175.55 176.80 2pvh s ASN 189 N -4.21 7.12 0.00 2.29 3.84 -1.26 -4.66 114.94 118.05 2pvh s ASN 189 Ca 0.47 2.21 0.28 0.00 0.21 0.00 0.00 52.86 56.03 2pvh s ASN 189 Cb -0.10 -2.61 1.08 0.00 -0.55 0.00 0.00 41.25 39.08 2pvh s ASN 189 CO 0.33 -0.34 1.76 1.33 -2.79 0.00 0.00 177.10 177.39 2pvh n VAL 190 N 2.44 0.00 -1.74 -5.21 0.24 -1.26 -4.42 118.33 108.38 2pvh n VAL 190 Ca 0.04 -0.18 -0.40 0.00 -2.04 0.00 0.00 64.34 61.76 2pvh n VAL 190 Cb 0.45 0.33 -0.01 0.00 -1.47 0.00 0.00 33.84 33.13 2pvh n VAL 190 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2pvh n ARG 191 N -0.22 4.12 -4.50 7.34 1.74 -1.26 -4.87 116.66 119.01 2pvh n ARG 191 Ca 0.18 -2.94 -0.25 0.00 -0.77 0.00 0.00 57.85 54.07 2pvh n ARG 191 Cb 0.32 -2.74 -0.09 0.00 -1.02 0.00 0.00 32.46 28.93 2pvh n ARG 191 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2pvh s VAL 192 N 0.41 0.69 0.37 1.55 -7.23 -1.26 -5.10 120.40 109.83 2pvh s VAL 192 Ca 0.59 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.76 2pvh s VAL 192 Cb 0.18 -2.42 0.00 0.00 0.56 0.00 0.00 36.38 34.69 2pvh s VAL 192 CO -0.08 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 174.71 2pvh n ALA 193 N -0.87 -3.60 -2.78 1.32 0.00 0.31 -4.81 120.51 110.08 2pvh n ALA 193 Ca -0.05 0.51 -0.35 0.00 0.00 0.00 0.00 53.44 53.55 2pvh n ALA 193 Cb 0.65 -1.29 -0.08 0.00 0.00 0.00 0.00 19.45 18.74 2pvh n ALA 193 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2pvh s SER 194 N -7.02 5.75 0.20 0.00 0.01 -1.26 -4.96 113.70 106.42 2pvh s SER 194 Ca 0.00 0.25 -0.09 0.00 1.31 0.00 0.00 55.95 57.42 2pvh s SER 194 Cb 0.00 -1.71 0.28 0.00 0.21 0.00 0.00 66.02 64.80 2pvh s SER 194 CO 0.00 0.35 1.17 -1.14 0.41 0.00 0.00 173.24 174.03 2pvh n ARG 195 N 1.76 -0.11 0.31 12.44 0.63 -1.26 -0.22 116.66 130.21 2pvh n ARG 195 Ca -0.17 1.17 0.20 0.00 -0.92 0.00 0.00 57.85 58.13 2pvh n ARG 195 Cb 0.54 -1.74 1.01 0.00 0.45 0.00 0.00 32.46 32.72 2pvh n ARG 195 CO 0.00 0.00 0.00 1.88 -2.51 0.00 0.00 177.63 177.00 2pvh h TYR 196 N 0.00 0.00 -0.18 -0.14 0.05 -1.90 -2.34 116.97 112.46 2pvh h TYR 196 Ca 0.32 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.10 2pvh h TYR 196 Cb 0.51 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.25 2pvh h TYR 196 CO -0.61 0.02 0.00 1.19 -1.05 0.00 0.00 178.16 177.71 2pvh n PHE 197 N -3.22 0.48 -2.67 4.88 3.72 0.69 -4.65 117.46 116.69 2pvh n PHE 197 Ca -0.02 -0.78 -0.42 0.00 -0.05 0.00 0.00 57.45 56.18 2pvh n PHE 197 Cb 0.15 -0.18 -0.03 0.00 -0.94 0.00 0.00 39.48 38.48 2pvh n PHE 197 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2pvh s LYS 198 N -2.22 4.45 0.68 -1.08 1.02 -0.88 -4.20 119.74 117.51 2pvh s LYS 198 Ca 0.30 1.43 -0.11 0.00 0.02 0.00 0.00 55.97 57.61 2pvh s LYS 198 Cb 0.23 -3.52 -0.00 0.00 -0.52 0.00 0.00 37.83 34.02 2pvh s LYS 198 CO 0.08 -0.26 1.05 0.20 -0.92 0.00 0.00 175.35 175.50 2pvh s GLY 199 N 1.10 1.66 0.35 -3.33 0.00 -1.26 -4.87 107.32 100.97 2pvh s GLY 199 Ca 0.50 -0.04 0.13 0.00 0.00 0.00 0.00 44.72 45.31 2pvh s GLY 199 CO 0.21 0.27 1.76 -2.55 0.00 0.00 0.00 173.10 172.78 2pvh h PRO 200 N -0.60 0.50 -0.79 2.90 0.11 -1.92 -0.44 132.00 131.77 2pvh h PRO 200 Ca -0.44 -0.03 0.11 0.00 0.11 0.00 0.00 66.00 65.74 2pvh h PRO 200 Cb 1.21 -0.11 -0.08 0.00 0.11 0.00 0.00 31.00 32.13 2pvh h PRO 200 CO 0.59 0.33 0.42 1.05 -0.21 0.00 0.00 178.00 180.19 2pvh h GLU 201 N 0.52 0.66 -0.13 1.05 9.09 -1.90 -0.06 114.58 123.81 2pvh h GLU 201 Ca 0.61 -0.04 -0.16 0.00 0.05 0.00 0.00 59.36 59.82 2pvh h GLU 201 Cb 1.31 -0.15 -0.01 0.00 -1.65 0.00 0.00 28.75 28.26 2pvh h GLU 201 CO -0.38 0.44 -0.60 -0.07 0.05 0.00 0.00 179.01 178.45 2pvh h LEU 202 N 0.68 0.51 -0.41 3.06 3.38 -1.32 0.18 115.31 121.39 2pvh h LEU 202 Ca 0.39 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2pvh h LEU 202 Cb 0.43 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2pvh h LEU 202 CO -0.28 0.99 0.00 -0.07 0.09 0.00 0.00 178.44 179.17 2pvh h LEU 203 N 0.33 0.00 -3.02 1.67 3.38 -1.02 -3.15 115.31 113.50 2pvh h LEU 203 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2pvh h LEU 203 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 2pvh h LEU 203 CO 0.11 0.00 0.00 1.33 0.09 0.00 0.00 178.44 179.97 2pvh n VAL 204 N -2.62 1.44 -2.55 1.22 0.24 -0.13 -4.99 118.33 110.93 2pvh n VAL 204 Ca 0.04 -1.42 -0.18 0.00 -2.04 0.00 0.00 64.34 60.74 2pvh n VAL 204 Cb 0.39 0.20 0.01 0.00 -1.47 0.00 0.00 33.84 32.97 2pvh n VAL 204 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2pvh n ASP 205 N -0.34 -5.14 -4.52 -1.34 9.92 -1.01 -4.93 116.55 109.19 2pvh n ASP 205 Ca 0.11 -0.11 -0.43 0.00 -0.53 0.00 0.00 54.79 53.84 2pvh n ASP 205 Cb 0.52 -4.13 -0.04 0.00 -0.64 0.00 0.00 41.12 36.83 2pvh n ASP 205 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 2pvh s LEU 206 N -5.16 3.97 0.16 0.64 0.20 0.59 -4.89 118.68 114.18 2pvh s LEU 206 Ca 0.10 -0.41 0.05 0.00 0.69 0.00 0.00 54.13 54.56 2pvh s LEU 206 Cb -0.05 -2.77 -0.05 0.00 -0.43 0.00 0.00 46.19 42.89 2pvh s LEU 206 CO 0.13 -1.37 1.36 1.56 -0.29 0.00 0.00 176.35 177.74 2pvh h GLN 207 N 9.46 0.09 -3.08 1.98 4.20 -1.83 -3.38 115.11 122.56 2pvh h GLN 207 Ca -0.27 -0.12 -0.71 0.00 0.06 0.00 0.00 58.65 57.62 2pvh h GLN 207 Cb 1.07 0.04 -0.05 0.00 0.30 0.00 0.00 27.48 28.84 2pvh h GLN 207 CO 1.14 0.94 3.10 -0.40 -0.67 0.00 0.00 178.83 182.94 2pvh n ASP 208 N -3.55 7.42 -4.72 1.46 5.75 -1.26 -1.55 116.55 120.10 2pvh n ASP 208 Ca -0.02 -2.85 -0.23 0.00 -0.01 0.00 0.00 54.79 51.68 2pvh n ASP 208 Cb 0.85 -1.50 0.11 0.00 -1.03 0.00 0.00 41.12 39.54 2pvh n ASP 208 CO 0.00 0.00 0.00 -0.72 -0.11 0.00 0.00 177.20 176.37 2pvh s TYR 209 N 1.08 1.30 0.00 2.11 -0.85 -1.26 -4.62 117.35 115.11 2pvh s TYR 209 Ca 0.58 -0.45 0.00 0.00 -0.52 0.00 0.00 57.07 56.69 2pvh s TYR 209 Cb 0.17 -2.82 0.00 0.00 0.38 0.00 0.00 41.96 39.68 2pvh s TYR 209 CO -0.07 -1.71 0.00 -0.40 -1.52 0.00 0.00 175.55 171.85 2pvh n ASP 210 N -2.76 0.00 -0.28 -0.18 5.68 -1.26 -4.94 116.55 112.81 2pvh n ASP 210 Ca 0.16 0.00 0.28 0.00 -0.50 0.00 0.00 54.79 54.74 2pvh n ASP 210 Cb 0.61 0.00 0.65 0.00 -1.14 0.00 0.00 41.12 41.24 2pvh n ASP 210 CO 0.00 0.00 0.00 1.88 -1.33 0.00 0.00 177.20 177.75 2pvh h TYR 211 N 0.00 0.25 -0.06 2.11 0.05 -1.94 -0.97 116.97 116.40 2pvh h TYR 211 Ca 0.00 0.01 0.02 0.00 0.05 0.00 0.00 58.73 58.81 2pvh h TYR 211 Cb 0.00 -0.07 -0.00 0.00 1.01 0.00 0.00 36.73 37.66 2pvh h TYR 211 CO 0.00 0.03 0.22 0.66 -1.05 0.00 0.00 178.16 178.02 2pvh h SER 212 N 0.16 0.00 -0.80 3.88 4.64 -1.95 -0.77 113.55 118.71 2pvh h SER 212 Ca 0.53 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.86 2pvh h SER 212 Cb 1.81 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.86 2pvh h SER 212 CO -0.11 0.00 0.53 0.25 -0.87 0.00 0.00 176.83 176.63 2pvh h LEU 213 N 0.00 0.92 -1.55 5.97 5.85 -1.53 -2.12 115.31 122.85 2pvh h LEU 213 Ca 0.03 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 2pvh h LEU 213 Cb 0.46 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 2pvh h LEU 213 CO -0.00 0.66 -0.16 0.44 -0.34 0.00 0.00 178.44 179.04 2pvh h ASP 214 N 1.08 0.09 0.37 1.25 3.32 -1.34 -2.55 116.42 118.64 2pvh h ASP 214 Ca 0.30 -0.02 -0.13 0.00 0.02 0.00 0.00 57.03 57.20 2pvh h ASP 214 Cb -0.12 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 2pvh h ASP 214 CO -0.07 0.26 -0.55 0.24 -1.72 0.00 0.00 179.24 177.40 2pvh h MET 215 N 0.09 0.19 -0.29 3.56 2.86 -1.46 -0.05 114.93 119.82 2pvh h MET 215 Ca 0.02 -0.11 -0.07 0.00 -2.06 0.00 0.00 59.70 57.48 2pvh h MET 215 Cb 0.34 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.00 2pvh h MET 215 CO 0.02 0.68 -0.08 2.35 1.06 0.00 0.00 176.91 180.95 2pvh h TRP 216 N 0.14 0.64 0.11 -0.22 2.91 -1.25 -0.42 115.95 117.86 2pvh h TRP 216 Ca 0.00 -0.14 0.01 0.00 1.13 0.00 0.00 58.89 59.89 2pvh h TRP 216 Cb 1.01 -0.16 -0.02 0.00 -0.51 0.00 0.00 29.16 29.48 2pvh h TRP 216 CO 0.01 0.77 -0.16 0.77 -1.03 0.00 0.00 178.44 178.80 2pvh h SER 217 N 0.33 -0.45 -0.67 2.65 0.02 -1.28 -0.40 113.55 113.75 2pvh h SER 217 Ca 0.07 0.05 0.12 0.00 -0.84 0.00 0.00 61.79 61.19 2pvh h SER 217 Cb 0.56 0.17 -0.09 0.00 0.14 0.00 0.00 62.40 63.19 2pvh h SER 217 CO 0.03 -0.24 0.23 0.25 -1.14 0.00 0.00 176.83 175.96 2pvh h LEU 218 N -0.33 0.18 -1.22 5.07 5.85 -0.94 0.53 115.31 124.46 2pvh h LEU 218 Ca 0.02 0.10 0.06 0.00 0.84 0.00 0.00 57.88 58.90 2pvh h LEU 218 Cb 0.34 0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.41 2pvh h LEU 218 CO -0.08 0.09 0.55 1.23 -0.34 0.00 0.00 178.44 179.88 2pvh h GLY 219 N 0.38 1.20 0.99 3.75 0.00 -0.21 0.15 103.07 109.34 2pvh h GLY 219 Ca 0.35 -0.38 -0.07 0.00 0.00 0.00 0.00 47.33 47.23 2pvh h GLY 219 CO -0.38 0.29 0.04 0.00 0.00 0.00 0.00 176.54 176.49 2pvh h MET 221 N 0.70 0.18 -0.48 0.00 2.07 -0.27 -1.86 114.93 115.26 2pvh h MET 221 Ca 0.14 -0.03 0.03 0.00 -2.07 0.00 0.00 59.70 57.78 2pvh h MET 221 Cb 0.46 -0.03 -0.04 0.00 -1.87 0.00 0.00 31.60 30.12 2pvh h MET 221 CO 0.02 0.26 0.26 0.35 1.07 0.00 0.00 176.91 178.87 2pvh h PHE 222 N 0.06 0.48 -0.75 -0.22 3.57 -0.61 -1.50 116.94 117.97 2pvh h PHE 222 Ca 0.04 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.53 2pvh h PHE 222 Cb 0.14 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 38.70 2pvh h PHE 222 CO -0.02 0.25 0.36 0.00 -2.23 0.00 0.00 178.31 176.67 2pvh h ALA 223 N 1.24 1.22 -0.34 2.41 0.00 -0.97 -1.76 119.26 121.06 2pvh h ALA 223 Ca 0.21 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 2pvh h ALA 223 Cb 0.08 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2pvh h ALA 223 CO -0.13 0.60 -0.15 0.78 0.00 0.00 0.00 179.25 180.35 2pvh h GLY 224 N 1.11 0.65 0.52 0.00 0.00 -0.79 -1.62 103.07 102.93 2pvh h GLY 224 Ca 0.26 -0.48 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 2pvh h GLY 224 CO -0.03 0.44 -0.09 -0.33 0.00 0.00 0.00 176.54 176.53 2pvh h MET 225 N 0.54 -0.25 -0.30 4.80 2.07 -0.75 -0.58 114.93 120.46 2pvh h MET 225 Ca 0.09 0.02 -0.12 0.00 -2.07 0.00 0.00 59.70 57.62 2pvh h MET 225 Cb 0.57 0.06 -0.01 0.00 -1.87 0.00 0.00 31.60 30.34 2pvh h MET 225 CO 0.04 0.14 -0.31 -0.84 1.07 0.00 0.00 176.91 177.01 2pvh h ILE 226 N -0.75 1.28 -0.01 -1.22 3.07 -1.37 -2.80 117.51 115.72 2pvh h ILE 226 Ca -0.03 -1.43 0.00 0.00 1.55 0.00 0.00 64.86 64.95 2pvh h ILE 226 Cb 0.51 1.39 0.00 0.00 -0.27 0.00 0.00 36.82 38.45 2pvh h ILE 226 CO 0.04 0.46 -0.16 0.49 -1.05 0.00 0.00 178.15 177.94 2pvh n PHE 227 N -4.08 0.00 -3.64 0.16 3.72 -0.61 -4.46 117.46 108.55 2pvh n PHE 227 Ca -0.01 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.16 2pvh n PHE 227 Cb 0.47 -0.11 0.04 0.00 -0.94 0.00 0.00 39.48 38.94 2pvh n PHE 227 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2pvh n ARG 228 N -0.55 -3.40 -3.62 -1.08 1.74 -0.40 -4.74 116.66 104.61 2pvh n ARG 228 Ca 0.15 0.60 -0.27 0.00 -0.77 0.00 0.00 57.85 57.55 2pvh n ARG 228 Cb 0.33 -4.94 -0.16 0.00 -1.02 0.00 0.00 32.46 26.66 2pvh n ARG 228 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2pvh s LYS 229 N -5.78 0.19 -0.30 5.56 2.20 -0.36 -5.04 119.74 116.21 2pvh s LYS 229 Ca 0.20 -0.24 -0.05 0.00 -0.36 0.00 0.00 55.97 55.52 2pvh s LYS 229 Cb -0.06 -1.75 0.03 0.00 -1.51 0.00 0.00 37.83 34.54 2pvh s LYS 229 CO 0.82 -0.74 0.05 -2.00 -0.36 0.00 0.00 175.35 173.12 2pvh s GLU 230 N 2.08 2.78 0.58 4.03 -6.30 -1.26 -2.36 118.70 118.24 2pvh s GLU 230 Ca 0.03 -1.05 -0.01 0.00 -2.50 0.00 0.00 54.97 51.44 2pvh s GLU 230 Cb -0.16 -3.30 0.04 0.00 0.00 0.00 0.00 34.13 30.71 2pvh s GLU 230 CO -0.14 -0.54 0.82 -1.25 0.02 0.00 0.00 175.26 174.17 2pvh s PRO 231 N 1.39 2.49 -0.03 4.30 0.04 -1.26 -5.08 135.00 136.86 2pvh s PRO 231 Ca -0.01 -0.65 -0.26 0.00 0.04 0.00 0.00 61.00 60.12 2pvh s PRO 231 Cb -0.18 -2.42 -0.20 0.00 0.04 0.00 0.00 34.50 31.73 2pvh s PRO 231 CO 0.01 -0.81 1.25 0.35 0.04 0.00 0.00 177.00 177.84 2pvh h PHE 232 N -0.06 0.01 -3.37 0.56 3.57 -1.71 -3.38 116.94 112.56 2pvh h PHE 232 Ca -0.43 -0.00 -0.75 0.00 3.53 0.00 0.00 57.97 60.32 2pvh h PHE 232 Cb 1.30 -0.00 -0.27 0.00 2.79 0.00 0.00 35.95 39.76 2pvh h PHE 232 CO 0.37 0.51 -0.21 -0.06 -2.23 0.00 0.00 178.31 176.69 2pvh s PHE 233 N -4.17 3.44 -1.05 0.41 0.08 -1.26 -5.01 117.98 110.42 2pvh s PHE 233 Ca -0.16 -1.77 -0.14 0.00 0.12 0.00 0.00 56.93 54.98 2pvh s PHE 233 Cb 0.01 -3.66 0.20 0.00 -0.57 0.00 0.00 43.02 39.01 2pvh s PHE 233 CO 0.68 -0.99 1.15 -0.47 -0.10 0.00 0.00 175.22 175.49 2pvh s TYR 234 N 1.03 3.67 0.11 0.36 5.04 -1.26 -4.63 117.35 121.66 2pvh s TYR 234 Ca 0.09 -2.09 0.03 0.00 -2.44 0.00 0.00 57.07 52.66 2pvh s TYR 234 Cb -0.23 -4.09 -0.04 0.00 0.35 0.00 0.00 41.96 37.95 2pvh s TYR 234 CO -0.02 -1.22 0.15 0.20 -1.34 0.00 0.00 175.55 173.32 2pvh s GLY 235 N 2.48 1.94 0.03 8.97 0.00 -1.26 -4.98 107.32 114.49 2pvh s GLY 235 Ca 0.32 -1.03 0.11 0.00 0.00 0.00 0.00 44.72 44.13 2pvh s GLY 235 CO -0.06 -1.02 0.88 0.45 0.00 0.00 0.00 173.10 173.35 2pvh h HIS 236 N 2.88 0.00 -4.29 1.90 3.86 -1.96 -3.45 115.15 114.09 2pvh h HIS 236 Ca -0.47 0.00 -0.35 0.00 -1.16 0.00 0.00 60.37 58.39 2pvh h HIS 236 Cb 1.18 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 29.56 2pvh h HIS 236 CO 0.59 0.94 -0.26 -0.40 0.86 0.00 0.00 177.93 179.66 2pvh n ASP 237 N -3.12 -1.10 -0.28 2.45 5.68 -1.26 -5.02 116.55 113.90 2pvh n ASP 237 Ca -0.11 -2.97 -0.01 0.00 -0.50 0.00 0.00 54.79 51.20 2pvh n ASP 237 Cb 0.99 2.18 0.18 0.00 -1.14 0.00 0.00 41.12 43.33 2pvh n ASP 237 CO 0.00 0.00 0.00 0.78 -1.33 0.00 0.00 177.20 176.65 2pvh h ASN 238 N 1.97 0.99 -0.14 -1.12 2.35 -1.97 0.42 115.58 118.07 2pvh h ASN 238 Ca -0.25 -0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.44 2pvh h ASN 238 Cb 1.17 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 39.29 2pvh h ASN 238 CO 0.35 0.73 0.03 0.45 -1.65 0.00 0.00 177.43 177.34 2pvh h HIS 239 N 1.16 0.25 0.00 1.19 3.86 -1.97 -2.89 115.15 116.75 2pvh h HIS 239 Ca 0.31 -0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.43 2pvh h HIS 239 Cb -0.10 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.29 2pvh h HIS 239 CO 0.00 0.40 -0.28 0.22 0.86 0.00 0.00 177.93 179.13 2pvh h ASP 240 N 0.02 0.00 -0.77 2.45 3.58 -1.89 -2.55 116.42 117.27 2pvh h ASP 240 Ca 0.04 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.46 2pvh h ASP 240 Cb 0.29 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.30 2pvh h ASP 240 CO 0.00 0.28 0.36 -0.61 -2.88 0.00 0.00 179.24 176.40 2pvh h GLN 241 N 0.00 1.10 -0.23 0.28 5.75 -0.72 -1.12 115.11 120.18 2pvh h GLN 241 Ca -0.00 -0.17 -0.12 0.00 -0.15 0.00 0.00 58.65 58.21 2pvh h GLN 241 Cb 0.54 -0.20 -0.01 0.00 1.07 0.00 0.00 27.48 28.88 2pvh h GLN 241 CO 0.04 0.86 -0.35 1.25 -2.65 0.00 0.00 178.83 177.98 2pvh h LEU 242 N 1.08 0.53 -0.53 -2.39 5.85 -1.31 -2.87 115.31 115.66 2pvh h LEU 242 Ca 0.26 -0.22 -0.06 0.00 0.84 0.00 0.00 57.88 58.71 2pvh h LEU 242 Cb 0.13 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 2pvh h LEU 242 CO -0.03 0.84 0.10 0.58 -0.34 0.00 0.00 178.44 179.59 2pvh h VAL 243 N 0.43 1.25 -0.45 1.05 2.07 -1.08 -0.29 116.25 119.23 2pvh h VAL 243 Ca 0.05 -0.93 -0.05 0.00 0.82 0.00 0.00 66.70 66.59 2pvh h VAL 243 Cb 0.82 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 2pvh h VAL 243 CO 0.07 0.34 0.08 0.11 0.02 0.00 0.00 177.57 178.18 2pvh h LYS 244 N 0.76 0.69 -0.25 1.57 1.79 -1.15 -1.30 116.57 118.68 2pvh h LYS 244 Ca 0.16 -0.14 -0.08 0.00 -2.18 0.00 0.00 60.65 58.41 2pvh h LYS 244 Cb 0.39 -0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 30.93 2pvh h LYS 244 CO 0.01 0.65 -0.17 0.82 -1.08 0.00 0.00 179.45 179.68 2pvh h ILE 245 N 0.66 1.31 -0.69 1.86 2.04 -1.27 -3.23 117.51 118.20 2pvh h ILE 245 Ca 0.15 -1.29 0.02 0.00 1.00 0.00 0.00 64.86 64.73 2pvh h ILE 245 Cb 0.30 1.60 -0.04 0.00 -0.74 0.00 0.00 36.82 37.94 2pvh h ILE 245 CO 0.00 0.40 0.45 0.00 0.00 0.00 0.00 178.15 179.00 2pvh h ALA 246 N 0.71 0.89 0.00 1.87 0.00 -0.53 -0.72 119.26 121.48 2pvh h ALA 246 Ca 0.05 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2pvh h ALA 246 Cb 0.70 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2pvh h ALA 246 CO 0.05 0.25 0.00 1.63 0.00 0.00 0.00 179.25 181.18 2pvh n LYS 247 N -4.64 0.12 -0.07 0.00 5.02 -0.54 -0.38 118.16 117.67 2pvh n LYS 247 Ca 0.07 0.52 -0.08 0.00 -2.02 0.00 0.00 58.31 56.80 2pvh n LYS 247 Cb 0.05 -1.81 -0.03 0.00 -0.02 0.00 0.00 35.03 33.23 2pvh n LYS 247 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2pvh n VAL 248 N -2.04 1.35 0.30 -0.18 0.31 -0.59 -4.53 118.33 112.94 2pvh n VAL 248 Ca 0.00 0.19 0.15 0.00 -0.01 0.00 0.00 64.34 64.67 2pvh n VAL 248 Cb 0.10 -2.22 0.50 0.00 -0.91 0.00 0.00 33.84 31.30 2pvh n VAL 248 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2pvh h LEU 249 N -0.85 0.00 0.00 7.52 3.38 -1.21 0.38 115.31 124.53 2pvh h LEU 249 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2pvh h LEU 249 Cb 0.85 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.60 2pvh h LEU 249 CO 0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 2pvh n GLY 250 N 0.43 1.33 0.18 0.83 0.00 0.49 -4.35 105.19 104.09 2pvh n GLY 250 Ca 0.02 -1.69 0.09 0.00 0.00 0.00 0.00 46.02 44.44 2pvh n GLY 250 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2pvh h THR 251 N 0.00 0.26 -0.41 2.61 1.35 -0.77 -3.29 112.91 112.66 2pvh h THR 251 Ca 0.00 -1.39 -0.01 0.00 -0.55 0.00 0.00 66.41 64.46 2pvh h THR 251 Cb 0.00 2.06 -0.02 0.00 -1.73 0.00 0.00 68.15 68.47 2pvh h THR 251 CO 0.00 0.15 0.20 0.44 -0.25 0.00 0.00 175.52 176.06 2pvh h ASP 252 N 0.00 0.54 -0.79 5.36 3.32 -1.89 0.17 116.42 123.14 2pvh h ASP 252 Ca -0.01 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 56.92 2pvh h ASP 252 Cb 1.13 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 40.51 2pvh h ASP 252 CO 0.02 0.51 0.49 1.23 -1.72 0.00 0.00 179.24 179.78 2pvh h GLY 253 N 0.53 1.13 0.82 2.75 0.00 -1.83 0.92 103.07 107.38 2pvh h GLY 253 Ca 0.14 -0.45 -0.03 0.00 0.00 0.00 0.00 47.33 46.99 2pvh h GLY 253 CO -0.02 0.44 -0.01 -2.00 0.00 0.00 0.00 176.54 174.95 2pvh h LEU 254 N 1.08 0.36 -0.83 3.11 5.85 -1.44 -0.53 115.31 122.91 2pvh h LEU 254 Ca 0.29 -0.32 -0.05 0.00 0.84 0.00 0.00 57.88 58.63 2pvh h LEU 254 Cb -0.08 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 40.83 2pvh h LEU 254 CO -0.06 0.59 0.24 0.78 -0.34 0.00 0.00 178.44 179.65 2pvh h ASN 255 N 0.11 1.03 -0.40 1.25 -0.26 -0.27 0.11 115.58 117.15 2pvh h ASN 255 Ca 0.06 -0.18 -0.01 0.00 -0.56 0.00 0.00 56.30 55.60 2pvh h ASN 255 Cb 0.41 -0.27 -0.02 0.00 -1.06 0.00 0.00 38.32 37.38 2pvh h ASN 255 CO 0.01 0.95 0.21 0.00 -1.06 0.00 0.00 177.43 177.54 2pvh h ALA 256 N 1.19 0.52 0.10 -0.83 0.00 -0.70 -1.07 119.26 118.47 2pvh h ALA 256 Ca 0.24 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.06 2pvh h ALA 256 Cb 0.28 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2pvh h ALA 256 CO -0.01 0.05 -0.14 -0.92 0.00 0.00 0.00 179.25 178.24 2pvh h TYR 257 N 0.51 -0.35 -0.80 0.00 3.20 -0.50 -0.60 116.97 118.44 2pvh h TYR 257 Ca 0.14 0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.07 2pvh h TYR 257 Cb 0.08 0.14 -0.05 0.00 1.54 0.00 0.00 36.73 38.44 2pvh h TYR 257 CO -0.02 -0.21 0.52 -0.07 -1.64 0.00 0.00 178.16 176.75 2pvh h LEU 258 N -0.28 0.78 -0.18 2.82 3.38 -0.61 -2.45 115.31 118.76 2pvh h LEU 258 Ca 0.01 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.81 2pvh h LEU 258 Cb 0.29 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2pvh h LEU 258 CO -0.06 0.51 -0.56 0.78 0.09 0.00 0.00 178.44 179.20 2pvh h ASN 259 N 0.89 0.81 -0.59 -0.43 2.35 -0.80 0.44 115.58 118.25 2pvh h ASN 259 Ca 0.34 -0.59 0.08 0.00 -0.55 0.00 0.00 56.30 55.58 2pvh h ASN 259 Cb 0.21 -0.24 -0.07 0.00 0.05 0.00 0.00 38.32 38.28 2pvh h ASN 259 CO -0.12 1.26 0.24 0.50 -1.65 0.00 0.00 177.43 177.66 2pvh h LYS 260 N 0.40 0.42 -0.64 0.81 3.64 -0.67 -1.24 116.57 119.30 2pvh h LYS 260 Ca -0.02 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2pvh h LYS 260 Cb 1.18 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 2pvh h LYS 260 CO 0.12 0.28 0.00 0.66 -2.27 0.00 0.00 179.45 178.24 2pvh n TYR 261 N -4.96 1.69 -4.12 1.91 4.01 -1.00 -4.94 117.16 109.74 2pvh n TYR 261 Ca 0.08 -0.60 -0.36 0.00 -0.16 0.00 0.00 57.90 56.86 2pvh n TYR 261 Cb 0.24 -0.41 -0.03 0.00 -0.31 0.00 0.00 39.34 38.83 2pvh n TYR 261 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2pvh n ARG 262 N 0.61 -1.12 -4.64 -0.72 1.74 -0.47 -4.95 116.66 107.12 2pvh n ARG 262 Ca 0.23 0.17 -0.34 0.00 -0.77 0.00 0.00 57.85 57.14 2pvh n ARG 262 Cb 1.01 -3.42 -0.12 0.00 -1.02 0.00 0.00 32.46 28.91 2pvh n ARG 262 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2pvh s ILE 263 N -3.94 3.63 -0.18 0.55 1.01 0.15 -5.02 121.20 117.40 2pvh s ILE 263 Ca 0.21 -0.50 -0.04 0.00 0.00 0.00 0.00 60.65 60.32 2pvh s ILE 263 Cb -0.11 -2.49 -0.02 0.00 0.01 0.00 0.00 42.46 39.85 2pvh s ILE 263 CO 0.96 0.59 -0.03 -1.61 0.00 0.00 0.00 174.94 174.85 2pvh s GLU 264 N -0.68 3.59 0.31 2.79 2.02 -1.26 -4.59 118.70 120.88 2pvh s GLU 264 Ca 0.10 -0.55 -0.27 0.00 0.02 0.00 0.00 54.97 54.28 2pvh s GLU 264 Cb -0.11 -2.96 -0.09 0.00 0.10 0.00 0.00 34.13 31.06 2pvh s GLU 264 CO 0.02 0.10 0.98 -1.17 0.02 0.00 0.00 175.26 175.21 2pvh s LEU 265 N 0.73 4.40 0.21 1.80 2.96 -1.26 -4.98 118.68 122.53 2pvh s LEU 265 Ca -0.01 1.95 -0.32 0.00 -0.22 0.00 0.00 54.13 55.52 2pvh s LEU 265 Cb -0.14 -3.91 -0.13 0.00 0.50 0.00 0.00 46.19 42.51 2pvh s LEU 265 CO 0.02 -0.10 1.60 0.47 -1.32 0.00 0.00 176.35 177.02 2pvh n ASP 266 N 0.73 3.43 -0.33 3.68 9.92 -1.26 -4.67 116.55 128.05 2pvh n ASP 266 Ca 0.01 1.10 0.17 0.00 -0.53 0.00 0.00 54.79 55.53 2pvh n ASP 266 Cb 0.49 -1.50 0.33 0.00 -0.64 0.00 0.00 41.12 39.80 2pvh n ASP 266 CO 0.00 0.00 0.00 -0.65 0.13 0.00 0.00 177.20 176.68 2pvh h PRO 267 N 5.74 0.04 0.71 -0.24 0.11 -1.98 0.33 132.00 136.71 2pvh h PRO 267 Ca -0.45 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.63 2pvh h PRO 267 Cb 1.24 -0.01 0.01 0.00 0.11 0.00 0.00 31.00 32.34 2pvh h PRO 267 CO 0.87 0.03 -0.34 0.37 -0.21 0.00 0.00 178.00 178.72 2pvh h GLN 268 N 0.04 -0.92 -0.42 1.05 4.15 -1.99 -1.56 115.11 115.46 2pvh h GLN 268 Ca 0.62 0.06 0.08 0.00 0.77 0.00 0.00 58.65 60.19 2pvh h GLN 268 Cb 1.34 0.21 -0.07 0.00 0.21 0.00 0.00 27.48 29.17 2pvh h GLN 268 CO -0.85 -0.59 -0.05 1.25 -1.93 0.00 0.00 178.83 176.66 2pvh h LEU 269 N -1.02 -0.27 -2.27 -2.39 5.85 -1.24 0.19 115.31 114.15 2pvh h LEU 269 Ca -0.10 0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.76 2pvh h LEU 269 Cb 0.75 0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.99 2pvh h LEU 269 CO 0.16 -0.09 0.10 -0.08 -0.34 0.00 0.00 178.44 178.18 2pvh h GLU 270 N 0.06 0.00 0.08 1.25 4.81 -0.38 0.13 114.58 120.52 2pvh h GLU 270 Ca 0.21 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 59.25 2pvh h GLU 270 Cb 0.31 0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.71 2pvh h GLU 270 CO -0.39 0.00 -0.77 0.00 -0.73 0.00 0.00 179.01 177.12 2pvh h ALA 271 N 1.90 -0.01 -0.21 2.92 0.00 0.36 -3.10 119.26 121.12 2pvh h ALA 271 Ca 0.05 -0.65 -0.01 0.00 0.00 0.00 0.00 54.91 54.30 2pvh h ALA 271 Cb 0.24 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2pvh h ALA 271 CO -0.00 0.40 0.08 -0.07 0.00 0.00 0.00 179.25 179.66 2pvh h LEU 272 N -0.18 0.29 -1.07 0.00 3.38 -0.25 -2.99 115.31 114.49 2pvh h LEU 272 Ca -0.12 -0.17 0.10 0.00 0.09 0.00 0.00 57.88 57.79 2pvh h LEU 272 Cb 1.53 -0.08 -0.07 0.00 0.09 0.00 0.00 40.66 42.13 2pvh h LEU 272 CO 0.15 0.38 0.62 0.58 0.09 0.00 0.00 178.44 180.26 2pvh h VAL 273 N 0.19 0.97 0.00 1.22 2.07 -1.12 -3.47 116.25 116.11 2pvh h VAL 273 Ca 0.07 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.25 2pvh h VAL 273 Cb 0.18 -0.12 0.00 0.00 -1.52 0.00 0.00 31.29 29.83 2pvh h VAL 273 CO -0.01 0.18 0.00 0.61 0.02 0.00 0.00 177.57 178.38 2pvh n GLY 274 N -1.37 3.24 2.76 2.17 0.00 -1.13 -4.65 105.19 106.20 2pvh n GLY 274 Ca 0.17 -0.26 -0.17 0.00 0.00 0.00 0.00 46.02 45.76 2pvh n GLY 274 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2pvh s ARG 275 N 0.00 -0.04 0.01 1.61 3.52 -1.26 -4.99 118.95 117.80 2pvh s ARG 275 Ca 0.00 0.30 -0.00 0.00 -0.13 0.00 0.00 55.73 55.90 2pvh s ARG 275 Cb 0.00 -0.34 -0.01 0.00 -1.56 0.00 0.00 34.95 33.04 2pvh s ARG 275 CO 0.00 -0.24 -0.02 -1.01 -0.81 0.00 0.00 175.30 173.23 2pvh s HIS 276 N 1.57 0.14 0.54 5.12 3.76 -1.26 -4.99 115.29 120.17 2pvh s HIS 276 Ca -0.03 -0.29 -0.10 0.00 -0.15 0.00 0.00 55.06 54.49 2pvh s HIS 276 Cb -0.12 -0.10 -0.05 0.00 1.11 0.00 0.00 32.58 33.41 2pvh s HIS 276 CO -0.04 -0.10 0.92 -1.54 -0.85 0.00 0.00 174.74 173.14 2pvh s SER 277 N -0.79 6.33 0.19 1.40 1.04 -1.26 -0.28 113.70 120.33 2pvh s SER 277 Ca -0.09 1.27 -0.30 0.00 0.48 0.00 0.00 55.95 57.32 2pvh s SER 277 Cb -0.05 -2.40 -0.08 0.00 0.10 0.00 0.00 66.02 63.59 2pvh s SER 277 CO -0.01 -0.69 1.17 -0.60 0.98 0.00 0.00 173.24 174.09 2pvh s ARG 278 N -4.73 4.52 -0.29 4.02 3.52 -1.26 -4.10 118.95 120.63 2pvh s ARG 278 Ca 0.53 1.84 -0.10 0.00 -0.13 0.00 0.00 55.73 57.87 2pvh s ARG 278 Cb -0.11 -3.25 -0.03 0.00 -1.56 0.00 0.00 34.95 30.01 2pvh s ARG 278 CO 0.45 -0.04 0.16 0.21 -0.81 0.00 0.00 175.30 175.28 2pvh s LYS 279 N -0.34 3.63 0.31 5.12 2.20 0.13 -4.92 119.74 125.87 2pvh s LYS 279 Ca 0.52 -0.53 -0.29 0.00 -0.36 0.00 0.00 55.97 55.31 2pvh s LYS 279 Cb -0.32 -3.58 -0.13 0.00 -1.51 0.00 0.00 37.83 32.29 2pvh s LYS 279 CO 0.37 -0.30 1.25 -2.30 -0.36 0.00 0.00 175.35 174.01 2pvh n PRO 280 N 5.01 1.93 0.17 4.03 -0.02 -1.26 -4.80 135.00 140.06 2pvh n PRO 280 Ca -0.14 0.68 0.17 0.00 -2.02 0.00 0.00 63.50 62.19 2pvh n PRO 280 Cb 0.51 -2.23 0.79 0.00 -0.02 0.00 0.00 33.50 32.55 2pvh n PRO 280 CO 0.00 0.00 0.00 -1.49 1.98 0.00 0.00 175.50 175.99 2pvh h TRP 281 N 2.74 0.00 0.00 6.00 4.06 -1.97 -1.75 115.95 125.03 2pvh h TRP 281 Ca -0.44 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.50 2pvh h TRP 281 Cb 1.29 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.45 2pvh h TRP 281 CO 0.51 0.00 -0.02 -0.07 -3.56 0.00 0.00 178.44 175.30 2pvh h LEU 282 N 0.00 0.00 0.00 -4.49 3.38 -1.99 -2.80 115.31 109.41 2pvh h LEU 282 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2pvh h LEU 282 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 2pvh h LEU 282 CO -0.00 0.02 0.00 0.29 0.09 0.00 0.00 178.44 178.84 2pvh n LYS 283 N -3.11 0.20 0.00 1.13 5.02 -0.66 -1.45 118.16 119.29 2pvh n LYS 283 Ca 0.01 0.15 0.11 0.00 -2.02 0.00 0.00 58.31 56.56 2pvh n LYS 283 Cb 0.36 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 33.93 2pvh n LYS 283 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2pvh n PHE 284 N -1.25 0.00 -2.90 2.13 3.72 -1.06 -4.96 117.46 113.14 2pvh n PHE 284 Ca 0.06 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.09 2pvh n PHE 284 Cb 0.09 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.57 2pvh n PHE 284 CO 0.00 0.00 0.00 1.41 -0.05 0.00 0.00 176.76 178.12 2pvh s MET 285 N -2.10 4.54 0.28 -1.08 1.75 -0.53 -4.95 119.30 117.22 2pvh s MET 285 Ca 0.23 1.20 -0.14 0.00 -1.25 0.00 0.00 55.69 55.74 2pvh s MET 285 Cb 0.19 -3.00 0.01 0.00 2.84 0.00 0.00 34.83 34.87 2pvh s MET 285 CO 0.39 0.41 0.56 0.54 -0.65 0.00 0.00 175.02 176.27 2pvh s ASN 286 N -1.45 0.01 0.34 1.11 2.20 -1.26 -5.00 114.94 110.88 2pvh s ASN 286 Ca 0.44 -0.96 0.16 0.00 -0.94 0.00 0.00 52.86 51.56 2pvh s ASN 286 Cb -0.20 0.66 0.89 0.00 -2.00 0.00 0.00 41.25 40.59 2pvh s ASN 286 CO 0.25 -1.27 1.43 0.00 -2.94 0.00 0.00 177.10 174.57 2pvh h ALA 287 N 2.15 1.15 0.00 3.54 0.00 -2.00 0.11 119.26 124.22 2pvh h ALA 287 Ca -0.26 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.56 2pvh h ALA 287 Cb 1.25 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 2pvh h ALA 287 CO 0.34 -0.15 -1.14 -0.44 0.00 0.00 0.00 179.25 177.86 2pvh h ASP 288 N 0.00 0.00 0.00 0.00 5.19 -1.96 -3.39 116.42 116.26 2pvh h ASP 288 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2pvh h ASP 288 Cb 0.45 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.96 2pvh h ASP 288 CO 0.00 0.34 0.00 -0.46 -3.12 0.00 0.00 179.24 176.00 2pvh n ASN 289 N -2.85 1.22 -0.33 6.45 0.23 0.10 -4.76 115.26 115.31 2pvh n ASN 289 Ca -0.05 -1.38 0.09 0.00 -0.53 0.00 0.00 54.58 52.70 2pvh n ASN 289 Cb 0.71 0.00 0.28 0.00 -2.08 0.00 0.00 39.78 38.69 2pvh n ASN 289 CO 0.00 0.00 0.00 -0.61 -0.93 0.00 0.00 177.26 175.72 2pvh h GLN 290 N 0.00 0.88 -0.15 -3.83 4.15 -1.09 -0.16 115.11 114.91 2pvh h GLN 290 Ca 0.00 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.37 2pvh h GLN 290 Cb 0.31 -0.20 0.00 0.00 0.21 0.00 0.00 27.48 27.81 2pvh h GLN 290 CO 0.00 0.58 0.00 -2.39 -1.93 0.00 0.00 178.83 175.09 2pvh n HIS 291 N -4.60 0.00 0.00 3.99 1.44 -1.26 -3.34 115.22 111.44 2pvh n HIS 291 Ca 0.18 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.89 2pvh n HIS 291 Cb 0.39 -0.02 0.00 0.00 0.12 0.00 0.00 29.99 30.48 2pvh n HIS 291 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2pvh n LEU 292 N -0.37 0.00 -2.34 2.39 4.77 -0.12 -4.68 117.00 116.65 2pvh n LEU 292 Ca 0.00 -0.05 -0.27 0.00 -0.03 0.00 0.00 56.01 55.67 2pvh n LEU 292 Cb 0.04 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 2pvh n LEU 292 CO 0.00 0.00 1.45 0.52 -1.33 0.00 0.00 177.39 178.03 2pvh n VAL 293 N -0.32 3.23 -0.84 4.08 0.31 -0.92 -4.87 118.33 119.00 2pvh n VAL 293 Ca 0.00 -2.73 -0.31 0.00 -0.01 0.00 0.00 64.34 61.28 2pvh n VAL 293 Cb 0.00 -1.41 0.15 0.00 -0.91 0.00 0.00 33.84 31.67 2pvh n VAL 293 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2pvh s SER 294 N -0.20 3.22 0.47 4.52 1.04 -1.26 -4.73 113.70 116.75 2pvh s SER 294 Ca 0.50 2.18 0.19 0.00 0.48 0.00 0.00 55.95 59.30 2pvh s SER 294 Cb 0.37 -2.57 1.18 0.00 0.10 0.00 0.00 66.02 65.10 2pvh s SER 294 CO -0.15 -2.91 1.96 -0.65 0.98 0.00 0.00 173.24 172.47 2pvh h PRO 295 N -1.61 0.24 -0.18 4.02 0.11 -2.00 -0.59 132.00 131.99 2pvh h PRO 295 Ca -0.44 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 65.53 2pvh h PRO 295 Cb 1.27 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 2pvh h PRO 295 CO 0.43 0.16 -0.45 0.93 -0.21 0.00 0.00 178.00 178.87 2pvh h GLU 296 N 0.25 0.44 -0.28 1.05 4.39 -1.98 -1.74 114.58 116.71 2pvh h GLU 296 Ca 0.31 -0.24 -0.03 0.00 0.34 0.00 0.00 59.36 59.74 2pvh h GLU 296 Cb 0.86 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.51 2pvh h GLU 296 CO -0.07 0.81 0.04 0.00 -1.16 0.00 0.00 179.01 178.64 2pvh h ALA 297 N 1.16 0.38 -0.22 3.43 0.00 -1.45 -1.43 119.26 121.12 2pvh h ALA 297 Ca 0.02 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2pvh h ALA 297 Cb 0.93 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 2pvh h ALA 297 CO 0.08 0.07 0.08 0.82 0.00 0.00 0.00 179.25 180.30 2pvh h ILE 298 N 0.29 1.18 -0.61 0.00 1.08 -1.37 0.34 117.51 118.42 2pvh h ILE 298 Ca 0.09 -0.56 0.02 0.00 -0.39 0.00 0.00 64.86 64.01 2pvh h ILE 298 Cb 0.34 1.14 -0.04 0.00 -3.07 0.00 0.00 36.82 35.20 2pvh h ILE 298 CO 0.01 0.18 0.38 -0.78 -0.69 0.00 0.00 178.15 177.25 2pvh h ASP 299 N 0.19 0.63 0.11 1.72 3.58 -1.27 0.12 116.42 121.50 2pvh h ASP 299 Ca 0.07 -0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.52 2pvh h ASP 299 Cb 0.21 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 41.13 2pvh h ASP 299 CO -0.00 0.44 -0.05 0.15 -2.88 0.00 0.00 179.24 176.90 2pvh h PHE 300 N 0.75 -0.13 -0.89 0.28 3.57 -1.08 -2.73 116.94 116.71 2pvh h PHE 300 Ca 0.24 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.77 2pvh h PHE 300 Cb -0.00 0.04 -0.05 0.00 2.79 0.00 0.00 35.95 38.73 2pvh h PHE 300 CO -0.05 0.05 0.58 1.25 -2.23 0.00 0.00 178.31 177.91 2pvh h LEU 301 N -0.30 0.97 -1.52 0.59 5.85 -0.70 -2.37 115.31 117.84 2pvh h LEU 301 Ca -0.01 -0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.74 2pvh h LEU 301 Cb 0.24 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 2pvh h LEU 301 CO 0.02 0.67 0.38 -0.78 -0.34 0.00 0.00 178.44 178.40 2pvh h ASP 302 N 1.13 0.53 0.65 1.25 3.58 -0.63 -0.53 116.42 122.41 2pvh h ASP 302 Ca 0.35 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.80 2pvh h ASP 302 Cb -0.02 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 40.91 2pvh h ASP 302 CO -0.11 0.36 -0.04 0.29 -2.88 0.00 0.00 179.24 176.86 2pvh n LYS 303 N -4.47 0.33 -0.13 0.28 5.02 -0.90 -3.84 118.16 114.44 2pvh n LYS 303 Ca 0.07 -0.04 -0.28 0.00 -2.02 0.00 0.00 58.31 56.05 2pvh n LYS 303 Cb 0.18 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.59 2pvh n LYS 303 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2pvh n LEU 304 N -1.30 2.01 -4.20 -0.35 4.77 -0.31 -2.39 117.00 115.23 2pvh n LEU 304 Ca 0.12 0.32 -0.43 0.00 -0.03 0.00 0.00 56.01 55.99 2pvh n LEU 304 Cb 0.28 -0.85 0.00 0.00 -2.33 0.00 0.00 43.42 40.52 2pvh n LEU 304 CO 0.25 0.56 2.18 0.18 -1.33 0.00 0.00 177.39 179.23 2pvh n LEU 305 N -4.21 5.82 -4.30 2.23 4.77 -0.58 -4.56 117.00 116.17 2pvh n LEU 305 Ca -0.50 -4.11 -0.31 0.00 -0.03 0.00 0.00 56.01 51.05 2pvh n LEU 305 Cb 0.86 -1.68 -0.16 0.00 -2.33 0.00 0.00 43.42 40.11 2pvh n LEU 305 CO 0.07 0.66 -0.55 -0.13 -1.33 0.00 0.00 177.39 176.11 2pvh s ARG 306 N 3.27 2.43 0.13 3.23 1.81 -1.26 -4.93 118.95 123.63 2pvh s ARG 306 Ca 0.49 -0.89 -0.25 0.00 -1.72 0.00 0.00 55.73 53.37 2pvh s ARG 306 Cb 0.07 -2.15 -0.04 0.00 -0.45 0.00 0.00 34.95 32.38 2pvh s ARG 306 CO 0.00 0.45 1.64 1.88 -0.68 0.00 0.00 175.30 178.60 2pvh h TYR 307 N 5.84 -0.61 -2.79 -0.53 0.05 -1.91 -3.38 116.97 113.64 2pvh h TYR 307 Ca -0.36 0.02 -0.57 0.00 0.05 0.00 0.00 58.73 57.87 2pvh h TYR 307 Cb 1.16 0.28 -0.03 0.00 1.01 0.00 0.00 36.73 39.14 2pvh h TYR 307 CO 0.42 -0.31 1.20 0.34 -1.05 0.00 0.00 178.16 178.76 2pvh s ASP 308 N -4.95 6.10 0.58 3.88 -1.08 -1.26 -4.70 116.67 115.25 2pvh s ASP 308 Ca -0.15 1.34 0.28 0.00 -0.52 0.00 0.00 52.55 53.50 2pvh s ASP 308 Cb 0.10 -2.53 1.71 0.00 -1.46 0.00 0.00 42.92 40.74 2pvh s ASP 308 CO 0.66 -1.53 2.19 1.12 0.52 0.00 0.00 175.17 178.14 2pvh h HIS 309 N 11.91 0.00 0.00 -5.34 2.07 -1.95 -0.46 115.15 121.38 2pvh h HIS 309 Ca -0.33 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.19 2pvh h HIS 309 Cb 1.16 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.14 2pvh h HIS 309 CO 0.94 0.00 0.00 1.96 -3.07 0.00 0.00 177.93 177.76 2pvh h GLN 310 N 0.00 0.00 0.00 5.12 4.20 -1.93 -3.13 115.11 119.37 2pvh h GLN 310 Ca 0.03 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.54 2pvh h GLN 310 Cb 0.17 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.92 2pvh h GLN 310 CO -0.00 0.00 -1.25 0.93 -0.67 0.00 0.00 178.83 177.84 2pvh h GLU 311 N 0.00 0.00 -7.09 1.46 5.08 -1.45 -3.48 114.58 109.11 2pvh h GLU 311 Ca 0.00 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.81 2pvh h GLU 311 Cb 0.63 0.00 0.15 0.00 0.50 0.00 0.00 28.75 30.02 2pvh h GLU 311 CO 0.00 0.52 0.54 1.03 -1.00 0.00 0.00 179.01 180.10 2pvh s ARG 312 N -2.80 2.80 0.66 2.33 0.52 -1.19 -4.96 118.95 116.31 2pvh s ARG 312 Ca -0.01 2.10 -0.17 0.00 -0.52 0.00 0.00 55.73 57.12 2pvh s ARG 312 Cb 0.09 -1.99 0.00 0.00 0.52 0.00 0.00 34.95 33.56 2pvh s ARG 312 CO 0.80 -1.42 1.21 -0.51 0.02 0.00 0.00 175.30 175.40 2pvh s LEU 313 N -4.05 3.49 0.61 2.53 1.43 -1.01 -5.02 118.68 116.67 2pvh s LEU 313 Ca 0.78 2.36 -0.06 0.00 -1.03 0.00 0.00 54.13 56.19 2pvh s LEU 313 Cb -0.38 -4.59 0.02 0.00 0.03 0.00 0.00 46.19 41.27 2pvh s LEU 313 CO 0.42 -1.90 0.92 0.42 0.23 0.00 0.00 176.35 176.43 2pvh s THR 314 N -1.80 3.30 0.23 5.49 -4.23 -1.26 -4.85 115.64 112.52 2pvh s THR 314 Ca 0.76 -0.09 -0.07 0.00 -1.18 0.00 0.00 61.69 61.11 2pvh s THR 314 Cb -0.30 -3.33 0.21 0.00 1.34 0.00 0.00 72.50 70.42 2pvh s THR 314 CO 0.39 -0.34 1.88 0.00 -0.54 0.00 0.00 174.62 176.01 2pvh h ALA 315 N -0.26 1.14 -0.59 3.99 0.00 -1.93 -0.16 119.26 121.44 2pvh h ALA 315 Ca -0.45 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.40 2pvh h ALA 315 Cb 1.27 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 2pvh h ALA 315 CO 0.60 0.41 0.28 1.25 0.00 0.00 0.00 179.25 181.79 2pvh h LEU 316 N 1.09 0.78 -0.39 0.00 5.85 -1.93 -2.36 115.31 118.35 2pvh h LEU 316 Ca 0.34 -0.14 -0.05 0.00 0.84 0.00 0.00 57.88 58.87 2pvh h LEU 316 Cb -0.00 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 2pvh h LEU 316 CO -0.11 0.70 0.04 -0.33 -0.34 0.00 0.00 178.44 178.39 2pvh h GLU 317 N 0.81 0.67 -0.79 1.25 5.08 -1.80 -3.05 114.58 116.74 2pvh h GLU 317 Ca 0.20 -0.19 0.10 0.00 -1.00 0.00 0.00 59.36 58.47 2pvh h GLU 317 Cb 0.13 -0.07 -0.08 0.00 0.50 0.00 0.00 28.75 29.23 2pvh h GLU 317 CO -0.02 0.74 0.43 0.00 -1.00 0.00 0.00 179.01 179.15 2pvh h ALA 318 N 0.90 1.13 0.00 3.43 0.00 -0.80 -1.51 119.26 122.41 2pvh h ALA 318 Ca 0.12 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2pvh h ALA 318 Cb 0.41 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 2pvh h ALA 318 CO 0.01 0.02 -0.11 0.52 0.00 0.00 0.00 179.25 179.69 2pvh h MET 319 N 0.70 0.00 -0.00 0.00 2.86 -1.33 -2.20 114.93 114.96 2pvh h MET 319 Ca 0.39 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.03 2pvh h MET 319 Cb 0.42 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.08 2pvh h MET 319 CO -0.27 0.11 -0.30 0.25 1.06 0.00 0.00 176.91 177.75 2pvh n THR 320 N -4.38 0.00 -1.73 2.22 -2.24 -0.60 -4.79 114.28 102.76 2pvh n THR 320 Ca -0.03 -0.06 -0.42 0.00 -2.27 0.00 0.00 64.05 61.27 2pvh n THR 320 Cb 0.18 0.19 -0.01 0.00 -2.10 0.00 0.00 70.33 68.59 2pvh n THR 320 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 2pvh n HIS 321 N -1.07 2.64 -0.01 4.78 -0.00 -0.83 -4.83 115.22 115.90 2pvh n HIS 321 Ca 0.10 0.43 0.23 0.00 0.46 0.00 0.00 57.72 58.94 2pvh n HIS 321 Cb 0.33 -2.51 0.71 0.00 -0.12 0.00 0.00 29.99 28.40 2pvh n HIS 321 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 2pvh h PRO 322 N 3.47 0.00 -1.00 1.57 0.11 -1.91 -0.68 132.00 133.56 2pvh h PRO 322 Ca -0.48 0.00 0.24 0.00 0.11 0.00 0.00 66.00 65.88 2pvh h PRO 322 Cb 1.25 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.28 2pvh h PRO 322 CO 0.69 0.00 0.65 -0.92 -0.21 0.00 0.00 178.00 178.21 2pvh h TYR 323 N 0.00 0.62 -0.30 0.65 3.20 -1.88 0.23 116.97 119.49 2pvh h TYR 323 Ca 0.29 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.18 2pvh h TYR 323 Cb 1.46 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 39.55 2pvh h TYR 323 CO 0.00 0.10 0.00 1.19 -1.64 0.00 0.00 178.16 177.81 2pvh n PHE 324 N -4.58 0.39 -0.31 -3.82 3.72 -0.26 -4.61 117.46 107.99 2pvh n PHE 324 Ca 0.23 -0.19 0.16 0.00 -0.05 0.00 0.00 57.45 57.60 2pvh n PHE 324 Cb 0.82 0.00 0.34 0.00 -0.94 0.00 0.00 39.48 39.70 2pvh n PHE 324 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 2pvh h GLN 325 N 3.36 0.19 -0.06 -1.08 -0.00 -0.62 0.38 115.11 117.28 2pvh h GLN 325 Ca 0.00 -0.01 -0.16 0.00 -0.00 0.00 0.00 58.65 58.48 2pvh h GLN 325 Cb 0.74 -0.04 -0.01 0.00 -0.00 0.00 0.00 27.48 28.17 2pvh h GLN 325 CO 0.00 0.12 -0.67 0.37 -0.00 0.00 0.00 178.83 178.65 2pvh h GLN 326 N 0.19 0.25 -0.63 0.06 4.15 -1.81 -1.52 115.11 115.80 2pvh h GLN 326 Ca 0.61 -0.20 -0.08 0.00 0.77 0.00 0.00 58.65 59.76 2pvh h GLN 326 Cb 1.30 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 29.00 2pvh h GLN 326 CO -0.68 0.83 0.09 0.28 -1.93 0.00 0.00 178.83 177.42 2pvh h VAL 327 N 0.18 1.26 -0.31 2.39 2.07 -1.31 -0.89 116.25 119.65 2pvh h VAL 327 Ca -0.02 -1.04 -0.06 0.00 0.82 0.00 0.00 66.70 66.40 2pvh h VAL 327 Cb 1.21 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 2pvh h VAL 327 CO 0.11 0.38 -0.06 0.03 0.02 0.00 0.00 177.57 178.05 2pvh h ARG 328 N 0.96 0.58 -0.73 1.57 3.08 -1.14 -1.97 114.38 116.73 2pvh h ARG 328 Ca 0.19 -0.21 0.03 0.00 0.07 0.00 0.00 59.98 60.06 2pvh h ARG 328 Cb 0.45 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.42 2pvh h ARG 328 CO 0.02 0.76 0.46 0.00 -1.07 0.00 0.00 179.97 180.13 2pvh h ALA 329 N 0.80 0.96 -0.57 0.04 0.00 -1.05 0.09 119.26 119.54 2pvh h ALA 329 Ca 0.08 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 2pvh h ALA 329 Cb 0.53 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2pvh h ALA 329 CO 0.03 0.23 0.15 0.00 0.00 0.00 0.00 179.25 179.66 2pvh h ALA 330 N 1.32 0.75 -0.68 0.00 0.00 -1.07 -2.85 119.26 116.73 2pvh h ALA 330 Ca 0.30 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2pvh h ALA 330 Cb 0.04 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 2pvh h ALA 330 CO -0.12 0.45 0.33 1.49 0.00 0.00 0.00 179.25 181.40 2pvh h GLU 331 N 0.82 0.98 -1.71 0.00 4.81 -0.66 -2.73 114.58 116.08 2pvh h GLU 331 Ca 0.18 -0.14 -0.26 0.00 -0.13 0.00 0.00 59.36 59.01 2pvh h GLU 331 Cb 0.33 -0.18 -0.11 0.00 0.63 0.00 0.00 28.75 29.42 2pvh h GLU 331 CO -0.00 0.77 0.27 0.09 -0.73 0.00 0.00 179.01 179.41 2pvh n ASN 332 N -4.46 6.15 0.00 1.04 3.02 -0.05 -5.10 115.26 115.86 2pvh n ASN 332 Ca 0.05 -2.90 0.00 0.00 -0.03 0.00 0.00 54.58 51.70 2pvh n ASN 332 Cb 0.13 -1.11 0.00 0.00 -0.61 0.00 0.00 39.78 38.18 2pvh n ASN 332 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44