#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vkp h PRO 8 N 0.00 0.00 -0.53 4.33 0.11 -1.90 -1.93 132.00 132.08 1vkp h PRO 8 Ca 0.00 0.00 0.15 0.00 0.11 0.00 0.00 66.00 66.26 1vkp h PRO 8 Cb 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.09 1vkp h PRO 8 CO 0.00 0.05 0.43 0.00 -0.21 0.00 0.00 178.00 178.27 1vkp h ALA 9 N 1.95 2.40 0.00 -0.75 0.00 -1.53 -1.81 119.26 119.52 1vkp h ALA 9 Ca -0.00 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1vkp h ALA 9 Cb 0.12 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1vkp h ALA 9 CO 0.01 -0.70 -0.20 0.93 0.00 0.00 0.00 179.25 179.28 1vkp h GLU 10 N 0.00 0.00 0.00 0.00 3.07 -1.67 -3.13 114.58 112.85 1vkp h GLU 10 Ca 0.25 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.11 1vkp h GLU 10 Cb 1.10 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.01 1vkp h GLU 10 CO -0.00 0.20 -0.01 0.72 -1.40 0.00 0.00 179.01 178.52 1vkp n HIS 11 N -3.57 0.00 -1.78 4.33 -0.00 -1.12 -5.01 115.22 108.08 1vkp n HIS 11 Ca -0.01 -0.70 0.00 0.00 -0.00 0.00 0.00 57.72 57.01 1vkp n HIS 11 Cb 0.35 -0.09 0.00 0.00 -0.00 0.00 0.00 29.99 30.25 1vkp n HIS 11 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1vkp n GLY 12 N -0.89 0.58 3.85 -1.41 0.00 -1.10 -4.93 105.19 101.29 1vkp n GLY 12 Ca 0.07 -0.78 -0.32 0.00 0.00 0.00 0.00 46.02 44.99 1vkp n GLY 12 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1vkp s TYR 13 N -2.03 3.40 0.00 1.61 1.51 -0.70 -4.47 117.35 116.67 1vkp s TYR 13 Ca 0.00 1.28 0.00 0.00 -1.01 0.00 0.00 57.07 57.34 1vkp s TYR 13 Cb 0.00 -2.61 0.00 0.00 -0.11 0.00 0.00 41.96 39.24 1vkp s TYR 13 CO 0.00 -0.07 0.00 2.48 -1.11 0.00 0.00 175.55 176.85 1vkp n TYR 14 N -0.87 0.00 -4.12 2.71 4.11 -0.25 -4.02 117.16 114.72 1vkp n TYR 14 Ca 0.04 0.00 -0.09 0.00 -0.00 0.00 0.00 57.90 57.86 1vkp n TYR 14 Cb 0.54 0.00 -0.10 0.00 -0.00 0.00 0.00 39.34 39.78 1vkp n TYR 14 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.86 175.61 1vkp s PRO 16 N 3.55 0.69 0.66 -3.48 0.04 -1.26 -1.01 135.00 134.19 1vkp s PRO 16 Ca 0.00 -1.24 -0.17 0.00 0.04 0.00 0.00 61.00 59.63 1vkp s PRO 16 Cb 0.00 0.03 0.00 0.00 0.04 0.00 0.00 34.50 34.57 1vkp s PRO 16 CO 0.00 -0.07 1.26 0.00 0.04 0.00 0.00 177.00 178.23 1vkp s ALA 17 N -3.66 2.32 0.49 8.56 0.00 -1.26 -4.77 121.76 123.44 1vkp s ALA 17 Ca 0.08 1.09 0.26 0.00 0.00 0.00 0.00 51.96 53.39 1vkp s ALA 17 Cb 0.06 -3.52 1.52 0.00 0.00 0.00 0.00 23.12 21.19 1vkp s ALA 17 CO -0.07 -1.62 2.13 1.49 0.00 0.00 0.00 175.76 177.69 1vkp h GLU 18 N 0.35 0.00 -0.00 0.00 4.81 -1.95 -1.84 114.58 115.95 1vkp h GLU 18 Ca -0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 1vkp h GLU 18 Cb 1.32 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.70 1vkp h GLU 18 CO 0.52 0.08 -0.02 -2.67 -0.73 0.00 0.00 179.01 176.19 1vkp n TRP 19 N -3.85 0.00 -1.53 0.92 2.14 -1.26 -4.74 117.44 109.12 1vkp n TRP 19 Ca -0.02 0.00 -0.30 0.00 2.07 0.00 0.00 57.50 59.25 1vkp n TRP 19 Cb 0.17 -0.24 0.10 0.00 -0.81 0.00 0.00 31.31 30.54 1vkp n TRP 19 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1vkp s ASP 20 N -2.49 4.22 0.21 -0.67 -0.00 -0.69 -4.93 116.67 112.32 1vkp s ASP 20 Ca 0.31 1.24 -0.30 0.00 -0.00 0.00 0.00 52.55 53.79 1vkp s ASP 20 Cb 0.20 -1.94 -0.10 0.00 -0.00 0.00 0.00 42.92 41.09 1vkp s ASP 20 CO 0.45 -2.13 1.45 -0.55 -0.00 0.00 0.00 175.17 174.40 1vkp s SER 21 N -3.91 6.68 -0.04 0.27 0.15 -1.26 -4.89 113.70 110.70 1vkp s SER 21 Ca 0.62 2.60 -0.04 0.00 0.70 0.00 0.00 55.95 59.83 1vkp s SER 21 Cb -0.15 -2.61 -0.04 0.00 -1.71 0.00 0.00 66.02 61.51 1vkp s SER 21 CO 0.54 -0.71 0.15 -1.00 1.20 0.00 0.00 173.24 173.42 1vkp s HIS 22 N 0.39 3.52 0.04 3.44 3.76 -1.26 -1.32 115.29 123.86 1vkp s HIS 22 Ca 0.62 0.38 -0.16 0.00 -0.15 0.00 0.00 55.06 55.75 1vkp s HIS 22 Cb -0.41 -1.84 -0.32 0.00 1.11 0.00 0.00 32.58 31.12 1vkp s HIS 22 CO 0.39 0.65 1.06 0.00 -0.85 0.00 0.00 174.74 175.99 1vkp h ALA 23 N 4.20 -0.07 -2.50 -1.40 0.00 -0.63 -3.41 119.26 115.45 1vkp h ALA 23 Ca -0.51 -0.80 0.14 0.00 0.00 0.00 0.00 54.91 53.74 1vkp h ALA 23 Cb 1.20 0.14 -0.08 0.00 0.00 0.00 0.00 17.79 19.04 1vkp h ALA 23 CO 0.65 0.67 0.42 1.14 0.00 0.00 0.00 179.25 182.13 1vkp s GLN 24 N -2.83 1.28 -0.07 0.00 -2.07 -1.12 -4.25 119.66 110.60 1vkp s GLN 24 Ca -0.09 -0.68 0.03 0.00 -1.82 0.00 0.00 55.36 52.80 1vkp s GLN 24 Cb 0.05 0.45 -0.02 0.00 -1.09 0.00 0.00 33.01 32.40 1vkp s GLN 24 CO 0.94 -0.58 -0.16 0.99 -1.32 0.00 0.00 175.29 175.15 1vkp s THR 25 N -3.42 2.86 -0.14 3.63 2.01 0.06 -0.51 115.64 120.14 1vkp s THR 25 Ca 0.11 -0.78 -0.06 0.00 0.31 0.00 0.00 61.69 61.27 1vkp s THR 25 Cb -0.02 -2.12 -0.04 0.00 0.01 0.00 0.00 72.50 70.33 1vkp s THR 25 CO 0.01 0.57 0.06 0.26 -0.69 0.00 0.00 174.62 174.84 1vkp s TRP 26 N -0.39 3.31 0.01 4.92 0.52 -0.35 -1.11 118.94 125.85 1vkp s TRP 26 Ca 0.04 0.22 0.01 0.00 0.02 0.00 0.00 56.10 56.39 1vkp s TRP 26 Cb -0.12 -1.96 -0.01 0.00 -1.15 0.00 0.00 33.47 30.23 1vkp s TRP 26 CO 0.02 0.39 -0.03 0.42 0.02 0.00 0.00 176.95 177.77 1vkp s ILE 27 N -0.33 0.18 0.00 2.03 1.01 -0.68 -1.20 121.20 122.20 1vkp s ILE 27 Ca 0.09 -0.30 0.00 0.00 0.00 0.00 0.00 60.65 60.43 1vkp s ILE 27 Cb -0.12 -0.20 0.00 0.00 0.01 0.00 0.00 42.46 42.15 1vkp s ILE 27 CO 0.02 -0.08 0.00 0.61 0.00 0.00 0.00 174.94 175.48 1vkp n GLY 28 N 2.66 -0.19 2.77 6.18 0.00 -1.26 -0.65 105.19 114.71 1vkp n GLY 28 Ca -0.15 -1.80 -0.17 0.00 0.00 0.00 0.00 46.02 43.90 1vkp n GLY 28 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1vkp s TRP 29 N -0.32 -0.02 0.46 1.61 -0.11 -0.93 -4.51 118.94 115.12 1vkp s TRP 29 Ca 0.00 0.29 -0.20 0.00 1.22 0.00 0.00 56.10 57.41 1vkp s TRP 29 Cb 0.00 -0.30 -0.10 0.00 -1.50 0.00 0.00 33.47 31.57 1vkp s TRP 29 CO 0.00 -0.16 0.96 -1.25 -4.62 0.00 0.00 176.95 171.89 1vkp s PRO 30 N 1.61 4.13 0.00 5.86 0.04 -1.26 -4.71 135.00 140.67 1vkp s PRO 30 Ca -0.03 1.09 0.00 0.00 0.04 0.00 0.00 61.00 62.10 1vkp s PRO 30 Cb -0.12 -2.16 0.00 0.00 0.04 0.00 0.00 34.50 32.25 1vkp s PRO 30 CO -0.04 -0.12 0.00 -1.91 0.04 0.00 0.00 177.00 174.97 1vkp n GLU 31 N -0.92 0.00 -2.04 4.56 2.13 -1.26 -4.82 120.64 118.30 1vkp n GLU 31 Ca 0.07 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.47 1vkp n GLU 31 Cb 0.54 -0.03 -0.03 0.00 0.27 0.00 0.00 31.44 32.20 1vkp n GLU 31 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 1vkp s ARG 32 N -1.60 4.27 0.13 5.31 1.70 -1.26 -4.51 118.95 122.98 1vkp s ARG 32 Ca 0.00 2.24 0.27 0.00 -0.47 0.00 0.00 55.73 57.77 1vkp s ARG 32 Cb 0.00 -3.17 0.98 0.00 -0.57 0.00 0.00 34.95 32.18 1vkp s ARG 32 CO 0.00 -0.49 1.83 1.04 -1.08 0.00 0.00 175.30 176.60 1vkp n GLN 33 N 3.52 0.16 -0.08 3.89 6.02 -1.26 -1.71 117.38 127.92 1vkp n GLN 33 Ca 0.11 0.14 0.10 0.00 -0.01 0.00 0.00 57.00 57.34 1vkp n GLN 33 Cb 0.40 -1.69 0.37 0.00 1.02 0.00 0.00 30.24 30.35 1vkp n GLN 33 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 1vkp n ASP 34 N -1.96 1.43 0.00 1.08 5.75 -1.26 -1.63 116.55 119.96 1vkp n ASP 34 Ca 0.06 -1.70 0.00 0.00 -0.01 0.00 0.00 54.79 53.14 1vkp n ASP 34 Cb 0.39 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.38 1vkp n ASP 34 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1vkp n ASN 35 N 0.18 2.02 -4.03 -1.12 5.15 -1.01 -4.80 115.26 111.65 1vkp n ASN 35 Ca 0.15 0.00 -0.31 0.00 -0.60 0.00 0.00 54.58 53.83 1vkp n ASN 35 Cb 0.28 0.31 -0.16 0.00 -0.53 0.00 0.00 39.78 39.69 1vkp n ASN 35 CO 0.00 0.00 0.00 0.26 1.40 0.00 0.00 177.26 178.92 1vkp s TRP 36 N -1.08 2.29 0.62 1.20 0.52 -0.69 -4.46 118.94 117.33 1vkp s TRP 36 Ca 0.00 -1.33 -0.16 0.00 0.02 0.00 0.00 56.10 54.63 1vkp s TRP 36 Cb 0.00 -1.65 -0.02 0.00 -1.15 0.00 0.00 33.47 30.65 1vkp s TRP 36 CO 0.00 -0.70 1.09 -0.98 0.02 0.00 0.00 176.95 176.38 1vkp s ARG 37 N 1.45 3.10 -1.27 4.98 1.70 -1.26 -2.90 118.95 124.75 1vkp s ARG 37 Ca 0.04 1.32 -0.00 0.00 -0.47 0.00 0.00 55.73 56.62 1vkp s ARG 37 Cb -0.13 -2.00 -0.00 0.00 -0.57 0.00 0.00 34.95 32.25 1vkp s ARG 37 CO -0.11 -1.00 0.79 0.72 -1.08 0.00 0.00 175.30 174.63 1vkp n HIS 38 N -2.12 -2.00 -2.89 5.89 8.25 -0.94 -1.75 115.22 119.65 1vkp n HIS 38 Ca 0.10 0.86 -0.20 0.00 -0.26 0.00 0.00 57.72 58.22 1vkp n HIS 38 Cb 0.52 -4.58 0.01 0.00 1.12 0.00 0.00 29.99 27.06 1vkp n HIS 38 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1vkp n ASN 39 N -3.08 -4.79 -0.75 0.41 5.03 -1.26 -1.49 115.26 109.34 1vkp n ASN 39 Ca -0.29 -0.15 -0.10 0.00 0.87 0.00 0.00 54.58 54.91 1vkp n ASN 39 Cb 0.67 -3.95 -0.04 0.00 -1.02 0.00 0.00 39.78 35.44 1vkp n ASN 39 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1vkp n ALA 40 N -2.99 -0.15 -0.13 5.41 0.00 -0.72 -4.91 120.51 117.03 1vkp n ALA 40 Ca -0.11 0.15 -0.11 0.00 0.00 0.00 0.00 53.44 53.38 1vkp n ALA 40 Cb 0.60 -1.71 -0.02 0.00 0.00 0.00 0.00 19.45 18.32 1vkp n ALA 40 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1vkp h LEU 41 N 0.00 0.66 -0.88 0.00 3.38 -1.36 0.48 115.31 117.59 1vkp h LEU 41 Ca -0.20 -0.33 -0.06 0.00 0.09 0.00 0.00 57.88 57.39 1vkp h LEU 41 Cb 1.13 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.68 1vkp h LEU 41 CO 0.29 0.83 0.13 -0.65 0.09 0.00 0.00 178.44 179.13 1vkp h PRO 42 N 0.48 0.96 -0.44 1.13 0.11 -1.79 -2.20 132.00 130.24 1vkp h PRO 42 Ca 0.10 -0.22 -0.13 0.00 0.11 0.00 0.00 66.00 65.86 1vkp h PRO 42 Cb 0.51 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.47 1vkp h PRO 42 CO 0.02 0.86 -0.24 0.00 -0.21 0.00 0.00 178.00 178.44 1vkp h ALA 43 N 1.23 0.75 -0.71 -0.75 0.00 -1.81 -2.70 119.26 115.27 1vkp h ALA 43 Ca 0.19 -0.39 0.07 0.00 0.00 0.00 0.00 54.91 54.78 1vkp h ALA 43 Cb 0.35 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.92 1vkp h ALA 43 CO 0.00 0.66 0.39 1.96 0.00 0.00 0.00 179.25 182.27 1vkp h GLN 44 N 0.78 0.69 -0.44 0.00 4.20 -0.65 0.13 115.11 119.82 1vkp h GLN 44 Ca 0.10 -0.04 -0.06 0.00 0.06 0.00 0.00 58.65 58.71 1vkp h GLN 44 Cb 0.79 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.40 1vkp h GLN 44 CO 0.07 0.45 0.04 0.00 -0.67 0.00 0.00 178.83 178.72 1vkp h ARG 45 N 0.71 0.69 -0.20 1.46 3.08 -1.25 0.29 114.38 119.15 1vkp h ARG 45 Ca 0.32 -0.16 -0.14 0.00 0.07 0.00 0.00 59.98 60.07 1vkp h ARG 45 Cb 0.23 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.19 1vkp h ARG 45 CO -0.20 0.68 -0.44 0.28 -1.07 0.00 0.00 179.97 179.22 1vkp h VAL 46 N 0.65 1.32 -0.92 2.04 2.07 -1.10 -1.39 116.25 118.92 1vkp h VAL 46 Ca 0.14 -1.67 0.01 0.00 0.82 0.00 0.00 66.70 66.00 1vkp h VAL 46 Cb 0.35 1.88 -0.05 0.00 -1.52 0.00 0.00 31.29 31.96 1vkp h VAL 46 CO 0.01 0.52 0.61 -0.26 0.02 0.00 0.00 177.57 178.47 1vkp h PHE 47 N 0.33 1.15 -0.93 1.57 -1.00 -0.53 0.11 116.94 117.65 1vkp h PHE 47 Ca 0.00 0.03 -0.01 0.00 2.81 0.00 0.00 57.97 60.80 1vkp h PHE 47 Cb 1.04 -0.39 -0.04 0.00 3.61 0.00 0.00 35.95 40.17 1vkp h PHE 47 CO 0.09 0.71 0.53 0.00 -1.61 0.00 0.00 178.31 178.03 1vkp h ALA 48 N 1.35 1.19 -0.51 2.45 0.00 -0.84 -0.56 119.26 122.33 1vkp h ALA 48 Ca 0.34 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 55.05 1vkp h ALA 48 Cb -0.11 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.28 1vkp h ALA 48 CO -0.08 0.67 -0.03 0.78 0.00 0.00 0.00 179.25 180.59 1vkp h GLY 49 N 1.29 0.94 0.77 0.00 0.00 -0.54 -0.20 103.07 105.33 1vkp h GLY 49 Ca 0.33 -0.67 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 1vkp h GLY 49 CO -0.06 0.62 0.01 -2.08 0.00 0.00 0.00 176.54 175.03 1vkp h VAL 50 N 0.80 1.22 -0.58 4.60 2.07 -0.50 -1.40 116.25 122.45 1vkp h VAL 50 Ca 0.15 -0.66 0.06 0.00 0.82 0.00 0.00 66.70 67.07 1vkp h VAL 50 Cb 0.52 1.52 -0.05 0.00 -1.52 0.00 0.00 31.29 31.76 1vkp h VAL 50 CO 0.03 0.18 0.29 0.00 0.02 0.00 0.00 177.57 178.09 1vkp h ALA 51 N 0.77 0.76 -0.57 1.67 0.00 -1.04 -0.77 119.26 120.08 1vkp h ALA 51 Ca 0.02 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1vkp h ALA 51 Cb 0.28 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1vkp h ALA 51 CO 0.00 -0.06 0.25 -0.22 0.00 0.00 0.00 179.25 179.22 1vkp h LYS 52 N 0.55 0.84 -0.23 0.00 3.64 -0.99 -0.58 116.57 119.80 1vkp h LYS 52 Ca 0.27 -0.14 -0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1vkp h LYS 52 Cb 0.20 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 1vkp h LYS 52 CO -0.20 0.70 0.14 0.00 -2.27 0.00 0.00 179.45 177.83 1vkp h ALA 53 N 1.09 0.30 -0.57 5.00 0.00 -0.94 -2.17 119.26 121.97 1vkp h ALA 53 Ca 0.19 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1vkp h ALA 53 Cb 0.16 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1vkp h ALA 53 CO -0.02 -0.21 0.25 0.82 0.00 0.00 0.00 179.25 180.10 1vkp h ILE 54 N 0.30 1.20 0.00 0.00 2.04 -0.94 -2.76 117.51 117.35 1vkp h ILE 54 Ca 0.08 -0.58 0.00 0.00 1.00 0.00 0.00 64.86 65.36 1vkp h ILE 54 Cb 0.00 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 36.57 1vkp h ILE 54 CO -0.02 0.24 0.00 0.77 0.00 0.00 0.00 178.15 179.14 1vkp h SER 55 N 0.81 0.00 0.62 1.72 4.64 -0.45 0.50 113.55 121.39 1vkp h SER 55 Ca 0.20 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.49 1vkp h SER 55 Cb 0.12 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.20 1vkp h SER 55 CO -0.02 0.00 -0.15 0.11 -0.87 0.00 0.00 176.83 175.90 1vkp h LYS 56 N 0.00 0.00 0.00 4.77 1.79 -1.25 -3.31 116.57 118.56 1vkp h LYS 56 Ca 0.00 0.00 -0.36 0.00 -2.18 0.00 0.00 60.65 58.11 1vkp h LYS 56 Cb 0.20 0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 30.78 1vkp h LYS 56 CO 0.00 0.15 -2.35 1.19 -1.08 0.00 0.00 179.45 177.36 1vkp n PHE 57 N -3.47 0.00 -3.58 -1.35 3.72 0.10 -5.08 117.46 107.79 1vkp n PHE 57 Ca -0.01 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.30 1vkp n PHE 57 Cb 0.31 -0.94 -0.02 0.00 -0.94 0.00 0.00 39.48 37.89 1vkp n PHE 57 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 176.76 174.88 1vkp s GLU 58 N -2.48 1.33 0.52 -1.08 -1.05 -0.76 -4.61 118.70 110.58 1vkp s GLU 58 Ca -0.21 -0.60 -0.22 0.00 -0.15 0.00 0.00 54.97 53.79 1vkp s GLU 58 Cb 0.07 0.55 -0.06 0.00 -0.44 0.00 0.00 34.13 34.25 1vkp s GLU 58 CO 0.67 -0.60 1.35 -2.14 0.95 0.00 0.00 175.26 175.50 1vkp s PRO 59 N -3.65 3.28 -0.02 -4.83 0.02 -1.26 -3.87 135.00 124.66 1vkp s PRO 59 Ca 0.05 2.22 0.06 0.00 0.02 0.00 0.00 61.00 63.35 1vkp s PRO 59 Cb -0.02 -2.33 -0.01 0.00 0.02 0.00 0.00 34.50 32.15 1vkp s PRO 59 CO -0.06 -1.08 -0.19 0.08 -0.33 0.00 0.00 177.00 175.42 1vkp s VAL 60 N -1.31 1.54 -0.14 3.83 1.01 -1.26 -0.76 120.40 123.31 1vkp s VAL 60 Ca 0.69 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.86 1vkp s VAL 60 Cb -0.40 -1.28 -0.00 0.00 0.00 0.00 0.00 36.38 34.70 1vkp s VAL 60 CO 0.48 0.44 -0.17 -0.89 0.00 0.00 0.00 175.10 174.95 1vkp s THR 61 N -0.37 2.57 -0.17 3.92 2.01 -0.26 -1.85 115.64 121.49 1vkp s THR 61 Ca 0.05 -0.82 -0.08 0.00 0.31 0.00 0.00 61.69 61.16 1vkp s THR 61 Cb -0.08 -2.06 -0.04 0.00 0.01 0.00 0.00 72.50 70.32 1vkp s THR 61 CO -0.00 0.53 0.11 -0.69 -0.69 0.00 0.00 174.62 173.88 1vkp s VAL 62 N 0.64 5.23 -0.19 3.82 1.01 0.11 -1.69 120.40 129.33 1vkp s VAL 62 Ca -0.09 0.12 -0.06 0.00 0.00 0.00 0.00 61.98 61.95 1vkp s VAL 62 Cb -0.16 -3.34 -0.03 0.00 0.00 0.00 0.00 36.38 32.85 1vkp s VAL 62 CO 0.02 0.50 0.02 0.00 0.00 0.00 0.00 175.10 175.65 1vkp s ALA 64 N 0.74 1.14 0.82 0.00 0.00 -0.10 -2.18 121.76 122.18 1vkp s ALA 64 Ca 0.01 -0.90 -0.13 0.00 0.00 0.00 0.00 51.96 50.95 1vkp s ALA 64 Cb -0.14 -0.13 0.09 0.00 0.00 0.00 0.00 23.12 22.94 1vkp s ALA 64 CO 0.02 0.19 1.20 -1.54 0.00 0.00 0.00 175.76 175.63 1vkp s SER 65 N -1.42 3.48 0.25 0.00 1.04 -1.26 -4.12 113.70 111.68 1vkp s SER 65 Ca -0.00 2.37 -0.05 0.00 0.48 0.00 0.00 55.95 58.74 1vkp s SER 65 Cb -0.09 -2.59 0.48 0.00 0.10 0.00 0.00 66.02 63.92 1vkp s SER 65 CO 0.02 -2.74 1.64 -0.65 0.98 0.00 0.00 173.24 172.48 1vkp h PRO 66 N -1.01 0.12 0.00 4.02 0.11 -1.96 -0.32 132.00 132.96 1vkp h PRO 66 Ca -0.46 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.60 1vkp h PRO 66 Cb 1.30 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 1vkp h PRO 66 CO 0.45 0.08 -0.22 0.00 -0.21 0.00 0.00 178.00 178.10 1vkp h ALA 67 N 1.72 1.27 -0.01 -0.75 0.00 -2.05 -3.16 119.26 116.29 1vkp h ALA 67 Ca 0.44 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1vkp h ALA 67 Cb 0.79 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1vkp h ALA 67 CO -0.67 0.27 -0.65 1.04 0.00 0.00 0.00 179.25 179.25 1vkp n GLN 68 N -3.74 0.60 -0.10 0.00 1.13 -0.41 -4.69 117.38 110.17 1vkp n GLN 68 Ca -0.01 -0.47 -0.06 0.00 -1.94 0.00 0.00 57.00 54.52 1vkp n GLN 68 Cb 0.33 -1.49 0.01 0.00 0.11 0.00 0.00 30.24 29.20 1vkp n GLN 68 CO 0.00 0.00 0.00 2.35 -1.44 0.00 0.00 177.06 177.97 1vkp h TRP 69 N 1.15 0.07 -0.60 1.08 7.01 -1.08 -0.85 115.95 122.73 1vkp h TRP 69 Ca 0.00 0.02 -0.10 0.00 2.11 0.00 0.00 58.89 60.92 1vkp h TRP 69 Cb 0.61 0.02 -0.02 0.00 -2.10 0.00 0.00 29.16 27.67 1vkp h TRP 69 CO 0.00 -0.01 -0.02 0.93 -2.79 0.00 0.00 178.44 176.56 1vkp h GLU 70 N 0.15 1.06 0.02 2.65 5.08 -1.83 -0.74 114.58 120.96 1vkp h GLU 70 Ca 0.16 -0.34 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 1vkp h GLU 70 Cb 0.19 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 1vkp h GLU 70 CO -0.23 1.04 -0.02 -0.97 -1.00 0.00 0.00 179.01 177.83 1vkp h ASN 71 N 0.96 -0.05 -0.46 1.42 -1.24 -1.77 -0.34 115.58 114.09 1vkp h ASN 71 Ca 0.17 0.01 0.04 0.00 0.71 0.00 0.00 56.30 57.22 1vkp h ASN 71 Cb 0.57 0.02 -0.04 0.00 0.73 0.00 0.00 38.32 39.60 1vkp h ASN 71 CO 0.03 -0.03 0.24 0.00 -1.29 0.00 0.00 177.43 176.38 1vkp h ALA 72 N 0.93 0.59 -0.68 1.57 0.00 -1.01 -0.89 119.26 119.77 1vkp h ALA 72 Ca 0.00 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1vkp h ALA 72 Cb 0.05 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1vkp h ALA 72 CO -0.01 -0.11 0.30 -0.09 0.00 0.00 0.00 179.25 179.34 1vkp h ARG 73 N 0.47 0.99 -0.47 0.00 9.65 -0.90 -1.79 114.38 122.33 1vkp h ARG 73 Ca 0.20 -0.15 -0.12 0.00 -1.10 0.00 0.00 59.98 58.81 1vkp h ARG 73 Cb 0.10 -0.18 -0.01 0.00 -1.39 0.00 0.00 29.97 28.49 1vkp h ARG 73 CO -0.14 0.79 -0.18 -0.22 2.80 0.00 0.00 179.97 183.02 1vkp h LYS 74 N 0.97 0.93 0.00 0.20 1.63 -0.57 -3.22 116.57 116.53 1vkp h LYS 74 Ca 0.23 -0.37 -0.02 0.00 -0.85 0.00 0.00 60.65 59.64 1vkp h LYS 74 Cb 0.15 -0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 31.73 1vkp h LYS 74 CO -0.02 1.03 -0.10 1.96 -3.45 0.00 0.00 179.45 178.87 1vkp h GLN 75 N 0.82 0.00 -5.80 1.90 4.20 -0.78 -3.46 115.11 111.98 1vkp h GLN 75 Ca 0.11 0.00 -0.67 0.00 0.06 0.00 0.00 58.65 58.16 1vkp h GLN 75 Cb 0.74 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 28.42 1vkp h GLN 75 CO 0.06 0.08 -0.53 -0.51 -0.67 0.00 0.00 178.83 177.26 1vkp s LEU 76 N -6.23 4.10 0.47 1.46 1.43 -0.71 -5.02 118.68 114.18 1vkp s LEU 76 Ca 0.06 0.32 -0.22 0.00 -1.03 0.00 0.00 54.13 53.27 1vkp s LEU 76 Cb 0.05 -2.08 -0.10 0.00 0.03 0.00 0.00 46.19 44.09 1vkp s LEU 76 CO 0.68 0.37 0.71 -2.65 0.23 0.00 0.00 176.35 175.70 1vkp n PRO 77 N 1.81 0.81 0.13 1.29 -0.02 -1.26 -4.86 135.00 132.90 1vkp n PRO 77 Ca -0.18 0.30 0.14 0.00 -2.02 0.00 0.00 63.50 61.74 1vkp n PRO 77 Cb 0.54 -1.76 0.66 0.00 -0.02 0.00 0.00 33.50 32.93 1vkp n PRO 77 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1vkp h GLU 78 N 0.88 0.00 -0.00 -0.52 5.08 -1.98 -1.17 114.58 116.87 1vkp h GLU 78 Ca -0.43 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 1vkp h GLU 78 Cb 1.38 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.63 1vkp h GLU 78 CO 0.52 0.00 -0.05 -0.40 -1.00 0.00 0.00 179.01 178.08 1vkp n ASP 79 N -4.46 0.40 -4.65 1.42 5.75 -1.26 -4.62 116.55 109.13 1vkp n ASP 79 Ca 0.03 -0.74 -0.39 0.00 -0.01 0.00 0.00 54.79 53.68 1vkp n ASP 79 Cb 0.35 -0.08 -0.07 0.00 -1.03 0.00 0.00 41.12 40.29 1vkp n ASP 79 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1vkp s ILE 80 N -2.30 5.09 0.23 2.12 1.01 -0.44 -4.69 121.20 122.21 1vkp s ILE 80 Ca 0.35 0.95 -0.30 0.00 0.00 0.00 0.00 60.65 61.65 1vkp s ILE 80 Cb 0.21 -3.84 -0.09 0.00 0.01 0.00 0.00 42.46 38.75 1vkp s ILE 80 CO 0.43 0.14 1.04 -0.60 0.00 0.00 0.00 174.94 175.95 1vkp s ARG 81 N 1.89 4.70 -0.14 2.79 3.52 -0.77 -4.88 118.95 126.06 1vkp s ARG 81 Ca 0.23 1.67 0.02 0.00 -0.13 0.00 0.00 55.73 57.52 1vkp s ARG 81 Cb -0.15 -3.25 0.01 0.00 -1.56 0.00 0.00 34.95 30.00 1vkp s ARG 81 CO 0.09 0.27 -0.19 0.08 -0.81 0.00 0.00 175.30 174.74 1vkp s VAL 82 N -0.88 1.87 0.11 7.11 1.01 -1.26 -0.71 120.40 127.65 1vkp s VAL 82 Ca 0.45 -0.85 0.09 0.00 0.00 0.00 0.00 61.98 61.66 1vkp s VAL 82 Cb -0.29 -1.68 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 1vkp s VAL 82 CO 0.36 0.51 -0.22 0.68 0.00 0.00 0.00 175.10 176.43 1vkp s VAL 83 N 1.00 1.85 0.69 2.92 -7.23 -0.35 -4.99 120.40 114.28 1vkp s VAL 83 Ca -0.04 -1.61 -0.11 0.00 -1.81 0.00 0.00 61.98 58.41 1vkp s VAL 83 Cb -0.15 -1.68 0.00 0.00 0.56 0.00 0.00 36.38 35.12 1vkp s VAL 83 CO -0.04 -0.04 1.06 -0.70 -0.31 0.00 0.00 175.10 175.07 1vkp s GLU 84 N -1.98 2.98 0.36 4.82 2.12 -1.26 -0.93 118.70 124.81 1vkp s GLU 84 Ca 0.09 0.76 0.08 0.00 0.36 0.00 0.00 54.97 56.26 1vkp s GLU 84 Cb -0.10 -2.01 -0.05 0.00 0.26 0.00 0.00 34.13 32.23 1vkp s GLU 84 CO 0.05 -1.02 0.11 -1.12 -0.54 0.00 0.00 175.26 172.75 1vkp s SER 86 N -4.02 4.48 -0.12 -1.70 0.01 -1.26 -4.84 113.70 106.25 1vkp s SER 86 Ca 0.58 -0.90 0.08 0.00 1.31 0.00 0.00 55.95 57.02 1vkp s SER 86 Cb -0.13 -0.62 -0.13 0.00 0.21 0.00 0.00 66.02 65.35 1vkp s SER 86 CO 0.54 -0.33 -0.00 0.59 0.41 0.00 0.00 173.24 174.45 1vkp n ASN 88 N -1.11 2.31 -2.55 2.44 3.02 -1.26 -4.69 115.26 113.41 1vkp n ASN 88 Ca -0.03 -0.02 -0.10 0.00 -0.03 0.00 0.00 54.58 54.40 1vkp n ASN 88 Cb 0.62 0.54 -0.00 0.00 -0.61 0.00 0.00 39.78 40.33 1vkp n ASN 88 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1vkp n ASP 89 N -2.55 -1.48 -2.76 6.41 4.64 -1.26 -4.86 116.55 114.68 1vkp n ASP 89 Ca -0.21 -2.43 -0.28 0.00 -1.38 0.00 0.00 54.79 50.49 1vkp n ASP 89 Cb 0.85 2.59 -0.02 0.00 -1.04 0.00 0.00 41.12 43.50 1vkp n ASP 89 CO 0.00 0.00 0.00 -1.54 -0.82 0.00 0.00 177.20 174.84 1vkp n SER 90 N -1.58 4.78 -3.64 1.67 3.41 -1.26 -4.87 113.62 112.13 1vkp n SER 90 Ca -0.03 -3.71 -0.29 0.00 -0.26 0.00 0.00 58.87 54.58 1vkp n SER 90 Cb 0.48 -0.55 -0.08 0.00 -0.26 0.00 0.00 64.21 63.80 1vkp n SER 90 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1vkp n TRP 91 N -0.35 3.51 0.33 7.33 7.02 -1.26 -4.60 117.44 129.41 1vkp n TRP 91 Ca 0.36 -4.08 0.14 0.00 -1.02 0.00 0.00 57.50 52.89 1vkp n TRP 91 Cb 0.50 -0.67 0.61 0.00 -2.42 0.00 0.00 31.31 29.32 1vkp n TRP 91 CO 0.00 0.00 0.00 0.74 -2.02 0.00 0.00 177.69 176.41 1vkp h PHE 92 N 4.71 0.00 -0.64 -5.99 -1.00 -1.73 -0.89 116.94 111.40 1vkp h PHE 92 Ca 0.18 0.00 0.08 0.00 2.81 0.00 0.00 57.97 61.05 1vkp h PHE 92 Cb 0.69 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 40.21 1vkp h PHE 92 CO 0.73 0.00 0.43 -0.09 -1.61 0.00 0.00 178.31 177.77 1vkp h ARG 93 N 0.00 0.53 0.00 1.51 9.65 -1.12 -1.31 114.38 123.64 1vkp h ARG 93 Ca 0.00 -0.03 -0.33 0.00 -1.10 0.00 0.00 59.98 58.52 1vkp h ARG 93 Cb 0.35 -0.12 -0.06 0.00 -1.39 0.00 0.00 29.97 28.75 1vkp h ARG 93 CO 0.00 0.35 -2.25 -0.25 2.80 0.00 0.00 179.97 180.62 1vkp n ASP 94 N -4.48 1.98 0.05 -3.80 10.43 -0.40 -2.33 116.55 117.99 1vkp n ASP 94 Ca 0.10 -0.10 0.11 0.00 2.57 0.00 0.00 54.79 57.48 1vkp n ASP 94 Cb 0.31 -0.10 -0.01 0.00 1.84 0.00 0.00 41.12 43.15 1vkp n ASP 94 CO 0.00 0.00 0.00 -1.54 -1.07 0.00 0.00 177.20 174.59 1vkp n SER 95 N -3.05 0.58 -4.37 -2.24 3.41 -0.83 -4.04 113.62 103.08 1vkp n SER 95 Ca -0.37 0.01 -0.29 0.00 -0.26 0.00 0.00 58.87 57.96 1vkp n SER 95 Cb 0.95 0.87 0.16 0.00 -0.26 0.00 0.00 64.21 65.92 1vkp n SER 95 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1vkp s GLY 96 N -4.04 1.73 0.37 5.00 0.00 -0.49 -3.48 107.32 106.40 1vkp s GLY 96 Ca 0.00 -1.08 -0.18 0.00 0.00 0.00 0.00 44.72 43.46 1vkp s GLY 96 CO 0.81 -0.40 0.84 2.56 0.00 0.00 0.00 173.10 176.92 1vkp s PRO 97 N -5.76 4.14 -0.43 2.90 0.04 -1.26 -4.81 135.00 129.81 1vkp s PRO 97 Ca 0.70 0.91 -0.22 0.00 0.04 0.00 0.00 61.00 62.43 1vkp s PRO 97 Cb -0.06 -2.35 0.02 0.00 0.04 0.00 0.00 34.50 32.16 1vkp s PRO 97 CO 0.51 0.08 0.72 0.99 0.04 0.00 0.00 177.00 179.35 1vkp s THR 98 N -2.04 4.74 0.34 1.26 2.01 -0.78 -4.86 115.64 116.30 1vkp s THR 98 Ca 0.57 0.35 -0.26 0.00 0.31 0.00 0.00 61.69 62.67 1vkp s THR 98 Cb -0.10 -4.25 -0.10 0.00 0.01 0.00 0.00 72.50 68.06 1vkp s THR 98 CO 0.16 -0.62 0.96 -0.36 -0.69 0.00 0.00 174.62 174.06 1vkp s PHE 99 N 3.05 3.62 0.06 4.92 0.40 -1.26 -0.47 117.98 128.31 1vkp s PHE 99 Ca 0.27 1.76 0.03 0.00 -0.60 0.00 0.00 56.93 58.38 1vkp s PHE 99 Cb -0.13 -2.94 -0.03 0.00 0.51 0.00 0.00 43.02 40.43 1vkp s PHE 99 CO 0.20 0.10 -0.08 0.96 0.70 0.00 0.00 175.22 177.10 1vkp s ILE 100 N -1.65 0.65 0.17 0.64 -4.36 -0.05 -4.54 121.20 112.05 1vkp s ILE 100 Ca 0.52 -1.27 0.02 0.00 -0.26 0.00 0.00 60.65 59.66 1vkp s ILE 100 Cb -0.18 -0.87 -0.05 0.00 1.25 0.00 0.00 42.46 42.61 1vkp s ILE 100 CO 0.24 -0.45 -0.01 0.68 0.24 0.00 0.00 174.94 175.63 1vkp s VAL 101 N -1.77 0.75 0.15 8.37 -7.23 -0.18 -1.24 120.40 119.25 1vkp s VAL 101 Ca -0.05 -1.99 0.00 0.00 -1.81 0.00 0.00 61.98 58.14 1vkp s VAL 101 Cb -0.07 -2.07 -0.04 0.00 0.56 0.00 0.00 36.38 34.75 1vkp s VAL 101 CO -0.00 -0.52 0.03 0.00 -0.31 0.00 0.00 175.10 174.30 1vkp s ARG 102 N -3.89 1.01 -0.36 4.82 1.70 -0.41 -1.09 118.95 120.73 1vkp s ARG 102 Ca 0.23 -1.48 -0.15 0.00 -0.47 0.00 0.00 55.73 53.85 1vkp s ARG 102 Cb 0.06 0.02 -0.01 0.00 -0.57 0.00 0.00 34.95 34.45 1vkp s ARG 102 CO 0.03 -0.21 0.32 -1.59 -1.08 0.00 0.00 175.30 172.78 1vkp s LYS 103 N -3.99 3.40 0.00 3.89 0.00 -1.26 -4.52 119.74 117.26 1vkp s LYS 103 Ca 0.24 -0.61 0.00 0.00 0.00 0.00 0.00 55.97 55.60 1vkp s LYS 103 Cb 0.07 -3.85 0.00 0.00 0.00 0.00 0.00 37.83 34.05 1vkp s LYS 103 CO 0.03 -0.57 0.00 -2.13 0.00 0.00 0.00 175.35 172.68 1vkp n ARG 104 N 5.29 0.00 -1.47 1.78 0.63 -1.26 -5.10 116.66 116.53 1vkp n ARG 104 Ca -0.10 0.00 0.07 0.00 -0.92 0.00 0.00 57.85 56.90 1vkp n ARG 104 Cb 0.49 0.00 -0.04 0.00 0.45 0.00 0.00 32.46 33.36 1vkp n ARG 104 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1vkp n ASN 112 N 0.00 -7.49 -4.46 6.15 4.05 -1.26 -5.08 115.26 107.16 1vkp n ASN 112 Ca 0.00 1.55 -0.24 0.00 0.45 0.00 0.00 54.58 56.35 1vkp n ASN 112 Cb 0.00 -4.80 -0.10 0.00 1.23 0.00 0.00 39.78 36.11 1vkp n ASN 112 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 1vkp s ARG 113 N -4.92 1.66 0.00 1.20 1.81 -1.26 -5.04 118.95 112.40 1vkp s ARG 113 Ca 0.00 -1.75 0.13 0.00 -1.72 0.00 0.00 55.73 52.40 1vkp s ARG 113 Cb 0.00 -1.75 0.35 0.00 -0.45 0.00 0.00 34.95 33.10 1vkp s ARG 113 CO 0.00 0.33 1.27 0.09 -0.68 0.00 0.00 175.30 176.31 1vkp n ASN 114 N -0.55 3.03 -4.09 0.23 5.03 -1.26 -4.95 115.26 112.69 1vkp n ASN 114 Ca -0.06 -1.95 -0.14 0.00 0.87 0.00 0.00 54.58 53.30 1vkp n ASN 114 Cb 0.60 -0.25 -0.11 0.00 -1.02 0.00 0.00 39.78 38.99 1vkp n ASN 114 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.26 174.92 1vkp s ILE 115 N -1.02 0.70 0.21 2.41 2.07 -1.26 -1.28 121.20 123.02 1vkp s ILE 115 Ca 0.27 -1.17 -0.11 0.00 -1.41 0.00 0.00 60.65 58.23 1vkp s ILE 115 Cb 0.15 -0.77 -0.00 0.00 0.13 0.00 0.00 42.46 41.97 1vkp s ILE 115 CO 0.19 -0.36 0.39 0.00 -1.91 0.00 0.00 174.94 173.26 1vkp s ALA 116 N -1.43 -0.16 -0.00 1.50 0.00 -0.38 -4.33 121.76 116.96 1vkp s ALA 116 Ca -0.07 -0.84 0.07 0.00 0.00 0.00 0.00 51.96 51.12 1vkp s ALA 116 Cb -0.10 0.98 -0.02 0.00 0.00 0.00 0.00 23.12 23.99 1vkp s ALA 116 CO 0.01 -0.75 -0.21 0.20 0.00 0.00 0.00 175.76 175.01 1vkp s GLY 117 N -2.99 1.02 -0.16 0.00 0.00 -0.17 -0.87 107.32 104.16 1vkp s GLY 117 Ca 0.20 -0.92 -0.15 0.00 0.00 0.00 0.00 44.72 43.85 1vkp s GLY 117 CO 0.04 -0.78 0.34 -0.42 0.00 0.00 0.00 173.10 172.28 1vkp s ILE 118 N -0.54 5.27 -0.59 0.90 1.01 0.38 -0.84 121.20 126.79 1vkp s ILE 118 Ca 0.08 0.64 -0.07 0.00 0.00 0.00 0.00 60.65 61.30 1vkp s ILE 118 Cb -0.08 -3.68 0.15 0.00 0.01 0.00 0.00 42.46 38.87 1vkp s ILE 118 CO -0.00 0.36 0.45 -0.62 0.00 0.00 0.00 174.94 175.12 1vkp s ASP 119 N 0.57 5.65 0.69 3.58 2.15 0.20 -1.87 116.67 127.65 1vkp s ASP 119 Ca 0.18 -2.46 -0.11 0.00 0.43 0.00 0.00 52.55 50.60 1vkp s ASP 119 Cb -0.14 -1.96 0.01 0.00 -0.30 0.00 0.00 42.92 40.53 1vkp s ASP 119 CO 0.05 -0.52 1.06 0.26 -0.17 0.00 0.00 175.17 175.85 1vkp s TRP 120 N 0.53 3.14 0.63 -5.34 0.52 -1.26 -1.41 118.94 115.76 1vkp s TRP 120 Ca 0.13 1.40 -0.15 0.00 0.02 0.00 0.00 56.10 57.50 1vkp s TRP 120 Cb -0.20 -2.88 -0.02 0.00 -1.15 0.00 0.00 33.47 29.22 1vkp s TRP 120 CO -0.04 -1.21 1.08 1.21 0.02 0.00 0.00 176.95 178.01 1vkp s ASN 121 N -3.83 5.43 -0.01 2.95 3.04 -0.95 -4.85 114.94 116.72 1vkp s ASN 121 Ca 0.58 1.88 -0.04 0.00 0.04 0.00 0.00 52.86 55.32 1vkp s ASN 121 Cb -0.14 -2.54 0.00 0.00 -1.54 0.00 0.00 41.25 37.04 1vkp s ASN 121 CO 0.55 -1.41 0.08 0.12 -3.04 0.00 0.00 177.10 173.40 1vkp s PHE 122 N -2.46 0.01 -0.05 0.43 5.36 -1.26 -1.88 117.98 118.13 1vkp s PHE 122 Ca 0.65 -0.01 0.23 0.00 -0.96 0.00 0.00 56.93 56.83 1vkp s PHE 122 Cb -0.18 -0.03 0.40 0.00 -0.34 0.00 0.00 43.02 42.87 1vkp s PHE 122 CO 0.41 -0.14 1.15 0.27 -1.46 0.00 0.00 175.22 175.45 1vkp n ASN 123 N 2.32 0.85 -3.79 6.13 2.04 -1.26 -4.97 115.26 116.58 1vkp n ASN 123 Ca -0.17 -2.01 -0.25 0.00 -0.44 0.00 0.00 54.58 51.71 1vkp n ASN 123 Cb 0.57 -0.25 0.03 0.00 -2.53 0.00 0.00 39.78 37.61 1vkp n ASN 123 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1vkp n ALA 124 N 0.23 -1.71 -3.45 -2.53 0.00 -1.26 0.23 120.51 112.01 1vkp n ALA 124 Ca 0.02 -0.01 -0.19 0.00 0.00 0.00 0.00 53.44 53.26 1vkp n ALA 124 Cb 1.04 -3.01 0.08 0.00 0.00 0.00 0.00 19.45 17.56 1vkp n ALA 124 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 1vkp n TRP 125 N -4.46 -2.41 0.00 0.00 8.01 -1.26 -1.19 117.44 116.14 1vkp n TRP 125 Ca -0.16 0.93 0.00 0.00 -1.31 0.00 0.00 57.50 56.96 1vkp n TRP 125 Cb 0.62 -4.90 0.00 0.00 -2.01 0.00 0.00 31.31 25.02 1vkp n TRP 125 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1vkp n GLY 126 N -1.52 0.04 6.39 6.99 0.00 -1.17 -4.23 105.19 111.70 1vkp n GLY 126 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1vkp n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vkp n GLY 127 N 0.00 -0.98 0.31 -0.02 0.00 0.13 -3.13 105.19 101.51 1vkp n GLY 127 Ca 0.00 -1.28 -0.02 0.00 0.00 0.00 0.00 46.02 44.72 1vkp n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vkp h ALA 128 N 0.00 1.28 0.00 4.61 0.00 -1.91 0.12 119.26 123.36 1vkp h ALA 128 Ca 0.00 -0.17 -0.33 0.00 0.00 0.00 0.00 54.91 54.41 1vkp h ALA 128 Cb 0.00 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 17.50 1vkp h ALA 128 CO 0.00 0.52 -2.01 0.09 0.00 0.00 0.00 179.25 177.85 1vkp n ASN 129 N -4.31 0.56 0.00 0.00 5.03 -1.26 -4.65 115.26 110.62 1vkp n ASN 129 Ca 0.05 0.23 0.00 0.00 0.87 0.00 0.00 54.58 55.72 1vkp n ASN 129 Cb 0.19 0.36 0.00 0.00 -1.02 0.00 0.00 39.78 39.30 1vkp n ASN 129 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1vkp n ASP 130 N -2.94 0.95 -4.27 6.41 9.92 -1.18 -5.08 116.55 120.37 1vkp n ASP 130 Ca -0.24 -1.11 -0.29 0.00 -0.53 0.00 0.00 54.79 52.61 1vkp n ASP 130 Cb 1.10 0.00 0.17 0.00 -0.64 0.00 0.00 41.12 41.74 1vkp n ASP 130 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1vkp s GLY 131 N -0.11 1.76 0.20 0.44 0.00 0.43 -4.47 107.32 105.56 1vkp s GLY 131 Ca 0.00 -1.18 0.22 0.00 0.00 0.00 0.00 44.72 43.76 1vkp s GLY 131 CO 0.00 -0.46 1.04 0.00 0.00 0.00 0.00 173.10 173.68 1vkp s TYR 133 N -3.32 0.16 -0.30 0.00 1.13 -1.26 -1.78 117.35 111.98 1vkp s TYR 133 Ca -0.01 -0.53 0.21 0.00 -1.41 0.00 0.00 57.07 55.34 1vkp s TYR 133 Cb 0.09 0.25 0.14 0.00 -1.10 0.00 0.00 41.96 41.34 1vkp s TYR 133 CO 0.79 -0.93 1.31 -0.91 -2.51 0.00 0.00 175.55 173.30 1vkp h ASN 134 N 2.27 0.00 -3.26 -0.18 -0.26 -1.53 -3.45 115.58 109.18 1vkp h ASN 134 Ca -0.28 0.00 -0.50 0.00 -0.56 0.00 0.00 56.30 54.96 1vkp h ASN 134 Cb 1.25 0.00 -0.38 0.00 -1.06 0.00 0.00 38.32 38.13 1vkp h ASN 134 CO 0.38 0.12 -0.78 -0.62 -1.06 0.00 0.00 177.43 175.47 1vkp s ASP 135 N -5.90 2.30 -0.14 5.81 -1.08 -1.26 -4.99 116.67 111.41 1vkp s ASP 135 Ca 0.03 -0.43 0.15 0.00 -0.52 0.00 0.00 52.55 51.78 1vkp s ASP 135 Cb 0.07 -0.68 0.34 0.00 -1.46 0.00 0.00 42.92 41.19 1vkp s ASP 135 CO 0.74 -0.20 1.17 -2.67 0.52 0.00 0.00 175.17 174.73 1vkp n TRP 136 N 5.01 0.00 -0.12 -5.34 2.14 -1.26 -4.86 117.44 113.01 1vkp n TRP 136 Ca -0.10 -1.07 -0.05 0.00 2.07 0.00 0.00 57.50 58.35 1vkp n TRP 136 Cb 0.49 -0.19 0.13 0.00 -0.81 0.00 0.00 31.31 30.93 1vkp n TRP 136 CO 0.00 0.00 0.00 0.66 2.07 0.00 0.00 177.69 180.42 1vkp h SER 137 N 0.59 0.80 -0.20 -0.67 4.64 -1.99 -1.41 113.55 115.31 1vkp h SER 137 Ca -0.03 -0.21 -0.07 0.00 -0.47 0.00 0.00 61.79 61.00 1vkp h SER 137 Cb 1.16 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 63.03 1vkp h SER 137 CO 0.01 0.88 -0.17 0.45 -0.87 0.00 0.00 176.83 177.14 1vkp h HIS 138 N 0.77 0.55 -0.58 4.77 3.86 -1.91 -3.17 115.15 119.44 1vkp h HIS 138 Ca 0.14 -0.16 0.09 0.00 -1.16 0.00 0.00 60.37 59.28 1vkp h HIS 138 Cb 0.50 -0.12 -0.03 0.00 1.06 0.00 0.00 27.41 28.82 1vkp h HIS 138 CO 0.03 0.81 0.39 -0.44 0.86 0.00 0.00 177.93 179.57 1vkp h ASP 139 N 0.14 0.38 -0.11 2.45 3.32 -1.77 -1.17 116.42 119.66 1vkp h ASP 139 Ca 0.03 0.01 0.03 0.00 0.02 0.00 0.00 57.03 57.12 1vkp h ASP 139 Cb 0.70 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 40.17 1vkp h ASP 139 CO 0.04 0.23 0.11 -0.07 -1.72 0.00 0.00 179.24 177.83 1vkp h LEU 140 N 0.42 0.00 -0.07 1.55 3.38 -1.23 -2.59 115.31 116.77 1vkp h LEU 140 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1vkp h LEU 140 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1vkp h LEU 140 CO -0.07 0.00 -0.77 0.18 0.09 0.00 0.00 178.44 177.86 1vkp n LEU 141 N -3.97 0.88 -0.17 1.67 4.77 -0.45 -4.57 117.00 115.17 1vkp n LEU 141 Ca -0.00 -0.33 -0.04 0.00 -0.03 0.00 0.00 56.01 55.61 1vkp n LEU 141 Cb 0.21 -0.09 0.06 0.00 -2.33 0.00 0.00 43.42 41.27 1vkp n LEU 141 CO 0.29 0.21 1.01 0.58 -1.33 0.00 0.00 177.39 178.15 1vkp h VAL 142 N 0.17 0.93 -0.39 4.08 2.07 -1.34 -1.03 116.25 120.74 1vkp h VAL 142 Ca 0.00 -0.16 -0.05 0.00 0.82 0.00 0.00 66.70 67.31 1vkp h VAL 142 Cb 0.51 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 1vkp h VAL 142 CO 0.00 0.09 0.05 0.28 0.02 0.00 0.00 177.57 178.01 1vkp h SER 143 N 0.48 0.63 1.56 0.57 0.02 -1.78 -1.03 113.55 113.99 1vkp h SER 143 Ca 0.23 -0.27 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 1vkp h SER 143 Cb 0.16 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.53 1vkp h SER 143 CO -0.18 0.74 0.00 0.08 -1.14 0.00 0.00 176.83 176.33 1vkp h ARG 144 N 0.50 0.00 -0.07 3.45 0.11 -1.80 -1.89 114.38 114.69 1vkp h ARG 144 Ca 0.12 0.00 -0.17 0.00 0.10 0.00 0.00 59.98 60.03 1vkp h ARG 144 Cb 0.38 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.47 1vkp h ARG 144 CO 0.01 0.00 -0.61 0.87 0.10 0.00 0.00 179.97 180.34 1vkp h LYS 145 N 0.00 0.53 -0.18 0.08 1.57 -0.89 -2.56 116.57 115.12 1vkp h LYS 145 Ca 0.00 -0.48 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 1vkp h LYS 145 Cb 0.78 0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.20 1vkp h LYS 145 CO 0.00 1.11 0.12 0.82 -0.57 0.00 0.00 179.45 180.93 1vkp h ILE 146 N 0.12 1.05 -0.21 1.86 2.04 -1.05 -0.17 117.51 121.15 1vkp h ILE 146 Ca -0.06 -0.09 -0.10 0.00 1.00 0.00 0.00 64.86 65.61 1vkp h ILE 146 Cb 1.28 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 38.13 1vkp h ILE 146 CO 0.12 0.05 -0.28 -0.07 0.00 0.00 0.00 178.15 177.97 1vkp h LEU 147 N 0.24 0.41 -0.34 1.44 3.38 -1.45 -1.93 115.31 117.06 1vkp h LEU 147 Ca 0.07 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.80 1vkp h LEU 147 Cb -0.02 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1vkp h LEU 147 CO -0.01 0.69 -0.16 0.00 0.09 0.00 0.00 178.44 179.05 1vkp h ALA 148 N 1.34 0.48 -0.77 1.53 0.00 -1.19 -0.23 119.26 120.42 1vkp h ALA 148 Ca 0.05 -0.34 0.05 0.00 0.00 0.00 0.00 54.91 54.67 1vkp h ALA 148 Cb 0.68 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 1vkp h ALA 148 CO 0.05 0.39 0.47 1.25 0.00 0.00 0.00 179.25 181.41 1vkp h LEU 149 N 0.48 0.74 -0.99 0.00 5.85 -0.69 -2.69 115.31 118.02 1vkp h LEU 149 Ca 0.08 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.81 1vkp h LEU 149 Cb 0.69 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.58 1vkp h LEU 149 CO 0.05 0.49 -0.09 1.21 -0.34 0.00 0.00 178.44 179.77 1vkp n GLU 150 N -4.66 1.54 -3.76 1.25 4.07 -0.76 -4.95 120.64 113.37 1vkp n GLU 150 Ca 0.10 -0.99 -0.23 0.00 -0.06 0.00 0.00 57.16 55.98 1vkp n GLU 150 Cb 0.14 -1.48 0.02 0.00 -0.06 0.00 0.00 31.44 30.07 1vkp n GLU 150 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1vkp n ARG 151 N 0.14 -4.74 -4.52 5.31 1.74 -0.22 -4.99 116.66 109.36 1vkp n ARG 151 Ca 0.16 0.59 -0.34 0.00 -0.77 0.00 0.00 57.85 57.49 1vkp n ARG 151 Cb 0.39 -5.12 -0.12 0.00 -1.02 0.00 0.00 32.46 26.59 1vkp n ARG 151 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1vkp s ILE 152 N -3.67 3.70 0.56 0.55 1.01 -0.47 -5.05 121.20 117.83 1vkp s ILE 152 Ca 0.08 -0.44 -0.21 0.00 0.00 0.00 0.00 60.65 60.08 1vkp s ILE 152 Cb -0.04 -2.58 -0.05 0.00 0.01 0.00 0.00 42.46 39.80 1vkp s ILE 152 CO 0.83 0.53 1.19 -2.65 0.00 0.00 0.00 174.94 174.83 1vkp n PRO 153 N 3.19 1.35 -4.86 2.79 -0.02 -1.26 -4.63 135.00 131.57 1vkp n PRO 153 Ca -0.18 0.50 -0.33 0.00 -2.02 0.00 0.00 63.50 61.48 1vkp n PRO 153 Cb 0.53 -2.38 -0.15 0.00 -0.02 0.00 0.00 33.50 31.48 1vkp n PRO 153 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1vkp s ARG 154 N -2.78 3.32 -0.26 -0.52 3.52 -1.26 -1.00 118.95 119.96 1vkp s ARG 154 Ca 0.73 -0.72 -0.07 0.00 -0.13 0.00 0.00 55.73 55.54 1vkp s ARG 154 Cb -0.43 -2.57 -0.02 0.00 -1.56 0.00 0.00 34.95 30.37 1vkp s ARG 154 CO 0.49 0.22 0.07 -0.06 -0.81 0.00 0.00 175.30 175.20 1vkp s PHE 155 N 0.33 3.09 0.07 5.12 0.08 -0.02 -4.96 117.98 121.69 1vkp s PHE 155 Ca -0.12 -0.58 -0.15 0.00 0.12 0.00 0.00 56.93 56.20 1vkp s PHE 155 Cb -0.16 -2.24 -0.06 0.00 -0.57 0.00 0.00 43.02 39.99 1vkp s PHE 155 CO 0.06 -0.42 0.49 -1.14 -0.10 0.00 0.00 175.22 174.11 1vkp s GLN 156 N 1.58 4.00 -0.03 0.44 0.74 -1.26 -0.63 119.66 124.50 1vkp s GLN 156 Ca 0.06 0.50 0.04 0.00 0.05 0.00 0.00 55.36 56.01 1vkp s GLN 156 Cb -0.15 -3.12 -0.00 0.00 1.10 0.00 0.00 33.01 30.83 1vkp s GLN 156 CO 0.03 0.60 -0.15 -1.58 -0.55 0.00 0.00 175.29 173.64 1vkp s HIS 157 N -1.23 1.50 -0.87 1.67 5.65 -0.50 -4.92 115.29 116.59 1vkp s HIS 157 Ca 0.30 -0.40 -0.18 0.00 0.25 0.00 0.00 55.06 55.03 1vkp s HIS 157 Cb -0.17 -1.01 -0.12 0.00 -1.18 0.00 0.00 32.58 30.10 1vkp s HIS 157 CO 0.17 -0.13 2.00 -1.13 -0.65 0.00 0.00 174.74 175.00 1vkp n SER 158 N 3.11 3.12 -4.13 9.88 3.41 -1.26 -2.23 113.62 125.52 1vkp n SER 158 Ca -0.18 -2.63 -0.30 0.00 -0.26 0.00 0.00 58.87 55.51 1vkp n SER 158 Cb 0.53 -1.16 -0.17 0.00 -0.26 0.00 0.00 64.21 63.15 1vkp n SER 158 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1vkp s ILE 160 N 4.52 1.73 -0.04 -1.33 1.01 -1.26 -4.53 121.20 121.30 1vkp s ILE 160 Ca 0.53 -0.81 -0.27 0.00 0.00 0.00 0.00 60.65 60.11 1vkp s ILE 160 Cb 0.14 -1.53 0.06 0.00 0.01 0.00 0.00 42.46 41.14 1vkp s ILE 160 CO 0.07 0.49 0.60 -0.22 0.00 0.00 0.00 174.94 175.87 1vkp s LEU 161 N 0.66 -0.32 0.01 2.97 2.96 -0.79 -4.81 118.68 119.36 1vkp s LEU 161 Ca -0.13 0.58 0.08 0.00 -0.22 0.00 0.00 54.13 54.45 1vkp s LEU 161 Cb -0.16 2.25 -0.02 0.00 0.50 0.00 0.00 46.19 48.75 1vkp s LEU 161 CO 0.03 -0.57 -0.25 -1.61 -1.32 0.00 0.00 176.35 172.64 1vkp s GLU 162 N -1.21 1.85 0.46 1.98 8.01 -1.26 -4.64 118.70 123.89 1vkp s GLU 162 Ca -0.11 -0.97 0.18 0.00 0.01 0.00 0.00 54.97 54.08 1vkp s GLU 162 Cb -0.01 -1.90 1.15 0.00 -4.31 0.00 0.00 34.13 29.07 1vkp s GLU 162 CO 0.09 0.51 1.97 0.78 0.01 0.00 0.00 175.26 178.61 1vkp h GLY 163 N 5.19 0.42 2.00 -1.39 0.00 -1.60 -1.31 103.07 106.38 1vkp h GLY 163 Ca -0.44 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 46.78 1vkp h GLY 163 CO 0.46 0.06 0.00 0.61 0.00 0.00 0.00 176.54 177.66 1vkp n GLY 164 N -1.56 -0.97 0.46 4.60 0.00 -1.21 -2.93 105.19 103.59 1vkp n GLY 164 Ca 0.11 -0.02 0.13 0.00 0.00 0.00 0.00 46.02 46.24 1vkp n GLY 164 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1vkp n SER 165 N -1.63 1.60 -4.13 1.61 3.41 -0.49 -2.09 113.62 111.90 1vkp n SER 165 Ca 0.03 -1.34 -0.23 0.00 -0.26 0.00 0.00 58.87 57.07 1vkp n SER 165 Cb 0.15 0.12 -0.15 0.00 -0.26 0.00 0.00 64.21 64.07 1vkp n SER 165 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1vkp s ILE 166 N -2.26 1.19 0.02 -1.33 -4.36 -1.15 -4.34 121.20 108.98 1vkp s ILE 166 Ca 0.29 -0.70 0.03 0.00 -0.26 0.00 0.00 60.65 60.01 1vkp s ILE 166 Cb 0.20 -1.00 -0.02 0.00 1.25 0.00 0.00 42.46 42.89 1vkp s ILE 166 CO 0.43 0.30 -0.10 -1.00 0.24 0.00 0.00 174.94 174.82 1vkp s HIS 167 N -0.42 0.84 0.12 1.37 3.76 -0.59 -4.91 115.29 115.46 1vkp s HIS 167 Ca 0.05 -0.31 0.04 0.00 -0.15 0.00 0.00 55.06 54.70 1vkp s HIS 167 Cb -0.06 -0.51 -0.04 0.00 1.11 0.00 0.00 32.58 33.08 1vkp s HIS 167 CO -0.00 -0.02 -0.10 0.14 -0.85 0.00 0.00 174.74 173.91 1vkp s VAL 168 N -0.74 1.04 -2.33 -0.90 -7.23 -1.26 -0.49 120.40 108.50 1vkp s VAL 168 Ca -0.01 -1.81 0.19 0.00 -1.81 0.00 0.00 61.98 58.54 1vkp s VAL 168 Cb -0.06 -1.56 0.19 0.00 0.56 0.00 0.00 36.38 35.50 1vkp s VAL 168 CO 0.00 -0.62 1.14 -0.90 -0.31 0.00 0.00 175.10 174.41 1vkp n ASP 169 N 0.27 2.70 -0.73 4.85 3.85 -1.11 -4.58 116.55 121.80 1vkp n ASP 169 Ca -0.14 -1.82 -0.10 0.00 -0.71 0.00 0.00 54.79 52.03 1vkp n ASP 169 Cb 0.59 -0.04 -0.04 0.00 -1.35 0.00 0.00 41.12 40.28 1vkp n ASP 169 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1vkp n GLY 170 N 1.10 0.97 1.47 6.12 0.00 -1.26 -4.63 105.19 108.96 1vkp n GLY 170 Ca 0.12 -0.09 -0.00 0.00 0.00 0.00 0.00 46.02 46.04 1vkp n GLY 170 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1vkp n GLU 171 N -1.17 1.42 -0.13 1.61 1.02 -1.26 -4.83 120.64 117.30 1vkp n GLU 171 Ca -0.10 -3.05 0.00 0.00 -0.02 0.00 0.00 57.16 54.00 1vkp n GLU 171 Cb 0.51 -1.19 0.00 0.00 -0.02 0.00 0.00 31.44 30.73 1vkp n GLU 171 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1vkp n GLY 172 N -0.44 0.71 3.79 0.62 0.00 -1.26 -4.41 105.19 104.20 1vkp n GLY 172 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 1vkp n GLY 172 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vkp s THR 173 N -2.39 4.80 -0.09 2.61 2.01 -1.26 -0.22 115.64 121.11 1vkp s THR 173 Ca 0.00 -0.38 0.01 0.00 0.31 0.00 0.00 61.69 61.63 1vkp s THR 173 Cb 0.00 -3.20 0.02 0.00 0.01 0.00 0.00 72.50 69.33 1vkp s THR 173 CO 0.00 0.35 -0.10 0.00 -0.69 0.00 0.00 174.62 174.18 1vkp s LEU 175 N 1.11 3.41 0.21 0.00 2.96 0.36 -1.15 118.68 125.58 1vkp s LEU 175 Ca -0.06 -0.11 -0.06 0.00 -0.22 0.00 0.00 54.13 53.67 1vkp s LEU 175 Cb -0.14 -1.86 -0.02 0.00 0.50 0.00 0.00 46.19 44.66 1vkp s LEU 175 CO -0.02 0.11 0.27 0.68 -1.32 0.00 0.00 176.35 176.07 1vkp s VAL 176 N 0.74 0.02 0.05 1.68 -7.23 -0.50 -1.55 120.40 113.61 1vkp s VAL 176 Ca 0.01 -1.69 0.05 0.00 -1.81 0.00 0.00 61.98 58.54 1vkp s VAL 176 Cb -0.14 -2.26 -0.04 0.00 0.56 0.00 0.00 36.38 34.51 1vkp s VAL 176 CO 0.02 -0.08 -0.10 0.42 -0.31 0.00 0.00 175.10 175.05 1vkp s THR 177 N -4.07 3.37 0.21 5.32 -4.23 -1.26 -1.11 115.64 113.87 1vkp s THR 177 Ca 0.29 -1.05 -0.02 0.00 -1.18 0.00 0.00 61.69 59.73 1vkp s THR 177 Cb 0.04 -2.50 -0.03 0.00 1.34 0.00 0.00 72.50 71.34 1vkp s THR 177 CO 0.08 0.27 1.54 -0.33 -0.54 0.00 0.00 174.62 175.65 1vkp h GLU 178 N 4.17 0.54 -0.86 3.99 5.08 -1.09 -2.14 114.58 124.27 1vkp h GLU 178 Ca -0.48 -0.31 0.17 0.00 -1.00 0.00 0.00 59.36 57.73 1vkp h GLU 178 Cb 1.16 0.03 -0.10 0.00 0.50 0.00 0.00 28.75 30.34 1vkp h GLU 178 CO 0.52 0.91 0.42 1.49 -1.00 0.00 0.00 179.01 181.35 1vkp h GLU 179 N 0.42 0.53 0.00 2.33 4.81 -1.44 -1.13 114.58 120.10 1vkp h GLU 179 Ca 0.02 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1vkp h GLU 179 Cb 1.02 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.28 1vkp h GLU 179 CO 0.09 0.35 -0.18 0.00 -0.73 0.00 0.00 179.01 178.55 1vkp h LEU 181 N -0.61 0.00 -1.74 0.00 4.07 -1.35 -1.87 115.31 113.81 1vkp h LEU 181 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1vkp h LEU 181 Cb 0.18 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.92 1vkp h LEU 181 CO 0.00 0.41 0.00 0.18 -1.08 0.00 0.00 178.44 177.95 1vkp n LEU 182 N -3.95 2.60 -4.73 1.67 4.77 -0.43 -4.58 117.00 112.35 1vkp n LEU 182 Ca -0.02 -1.12 -0.40 0.00 -0.03 0.00 0.00 56.01 54.45 1vkp n LEU 182 Cb 0.45 -0.19 0.02 0.00 -2.33 0.00 0.00 43.42 41.37 1vkp n LEU 182 CO 0.39 0.56 0.98 -3.20 -1.33 0.00 0.00 177.39 174.79 1vkp n ASN 183 N 0.93 2.89 0.32 -1.43 2.85 -0.71 -4.86 115.26 115.25 1vkp n ASN 183 Ca 0.18 1.08 0.20 0.00 -0.11 0.00 0.00 54.58 55.93 1vkp n ASN 183 Cb 0.47 -1.56 1.07 0.00 1.24 0.00 0.00 39.78 41.00 1vkp n ASN 183 CO 0.00 0.00 0.00 0.07 -2.11 0.00 0.00 177.26 175.22 1vkp h LYS 184 N 2.02 0.00 -0.30 1.20 2.10 -1.91 -2.17 116.57 117.52 1vkp h LYS 184 Ca -0.50 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.15 1vkp h LYS 184 Cb 1.29 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.62 1vkp h LYS 184 CO 0.60 0.00 0.00 0.27 -2.00 0.00 0.00 179.45 178.32 1vkp n ASN 185 N -3.22 2.09 0.00 7.07 0.23 -1.26 -4.42 115.26 115.74 1vkp n ASN 185 Ca -0.02 -1.86 0.00 0.00 -0.53 0.00 0.00 54.58 52.16 1vkp n ASN 185 Cb 0.15 -0.19 0.00 0.00 -2.08 0.00 0.00 39.78 37.66 1vkp n ASN 185 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1vkp n ARG 186 N 0.61 0.00 -3.14 -3.83 5.12 -0.82 -4.29 116.66 110.32 1vkp n ARG 186 Ca 0.15 0.00 -0.24 0.00 -1.93 0.00 0.00 57.85 55.84 1vkp n ARG 186 Cb 0.37 0.00 -0.05 0.00 -1.16 0.00 0.00 32.46 31.62 1vkp n ARG 186 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1vkp n ASN 187 N -0.14 2.53 0.24 0.55 4.13 -1.25 -4.75 115.26 116.58 1vkp n ASN 187 Ca 0.00 -3.28 0.17 0.00 1.68 0.00 0.00 54.58 53.15 1vkp n ASN 187 Cb 0.00 -0.61 0.83 0.00 -1.54 0.00 0.00 39.78 38.46 1vkp n ASN 187 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 1vkp h PRO 188 N 3.33 0.00 -2.13 3.52 0.13 -1.77 -3.44 132.00 131.64 1vkp h PRO 188 Ca 0.12 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 65.03 1vkp h PRO 188 Cb 0.74 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.81 1vkp h PRO 188 CO 0.66 0.00 -0.00 -2.39 -0.23 0.00 0.00 178.00 176.04 1vkp n HIS 189 N -2.71 0.20 -4.42 1.56 1.44 -1.26 -5.09 115.22 104.94 1vkp n HIS 189 Ca -0.01 -1.57 -0.20 0.00 -2.01 0.00 0.00 57.72 53.92 1vkp n HIS 189 Cb 0.12 -1.63 -0.10 0.00 0.12 0.00 0.00 29.99 28.50 1vkp n HIS 189 CO 0.00 0.00 0.00 -1.54 -2.81 0.00 0.00 176.34 171.99 1vkp s SER 191 N 2.06 2.38 0.20 4.39 1.04 -1.26 -5.13 113.70 117.38 1vkp s SER 191 Ca 0.65 -1.28 -0.10 0.00 0.48 0.00 0.00 55.95 55.69 1vkp s SER 191 Cb 0.30 -0.09 0.25 0.00 0.10 0.00 0.00 66.02 66.58 1vkp s SER 191 CO -0.00 -0.50 1.75 0.50 0.98 0.00 0.00 173.24 175.96 1vkp h LYS 192 N 2.25 0.41 -0.51 4.02 3.64 -1.98 -0.82 116.57 123.58 1vkp h LYS 192 Ca -0.40 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 58.87 1vkp h LYS 192 Cb 1.24 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.94 1vkp h LYS 192 CO 0.68 0.27 -0.03 1.49 -2.27 0.00 0.00 179.45 179.59 1vkp h GLU 193 N 0.42 0.88 -0.52 1.90 4.81 -2.04 -1.10 114.58 118.93 1vkp h GLU 193 Ca 0.29 -0.26 -0.09 0.00 -0.13 0.00 0.00 59.36 59.17 1vkp h GLU 193 Cb 0.33 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 1vkp h GLU 193 CO -0.28 0.89 -0.02 1.96 -0.73 0.00 0.00 179.01 180.83 1vkp h GLN 194 N 0.81 0.90 -0.21 1.92 4.20 -1.85 -0.44 115.11 120.43 1vkp h GLN 194 Ca 0.15 -0.27 -0.02 0.00 0.06 0.00 0.00 58.65 58.57 1vkp h GLN 194 Cb 0.52 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.20 1vkp h GLN 194 CO 0.03 0.90 0.04 0.82 -0.67 0.00 0.00 178.83 179.95 1vkp h ILE 195 N 0.82 1.22 -0.84 2.54 2.04 -0.86 -2.18 117.51 120.25 1vkp h ILE 195 Ca 0.15 -0.71 0.07 0.00 1.00 0.00 0.00 64.86 65.37 1vkp h ILE 195 Cb 0.52 1.29 -0.07 0.00 -0.74 0.00 0.00 36.82 37.82 1vkp h ILE 195 CO 0.03 0.22 0.51 -0.33 0.00 0.00 0.00 178.15 178.57 1vkp h GLU 196 N 0.15 0.87 -0.59 2.37 5.08 -1.01 -1.26 114.58 120.19 1vkp h GLU 196 Ca 0.06 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 1vkp h GLU 196 Cb 0.30 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 1vkp h GLU 196 CO 0.00 0.57 0.30 1.49 -1.00 0.00 0.00 179.01 180.37 1vkp h GLU 197 N 0.89 0.84 -0.70 2.33 4.57 -0.82 0.20 114.58 121.89 1vkp h GLU 197 Ca 0.38 -0.11 -0.06 0.00 -1.18 0.00 0.00 59.36 58.39 1vkp h GLU 197 Cb 0.25 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.65 1vkp h GLU 197 CO -0.20 0.66 0.22 0.93 -1.18 0.00 0.00 179.01 179.44 1vkp h GLU 198 N 0.80 1.09 -0.20 1.92 4.39 -1.01 -2.25 114.58 119.32 1vkp h GLU 198 Ca 0.20 -0.23 -0.14 0.00 0.34 0.00 0.00 59.36 59.53 1vkp h GLU 198 Cb 0.09 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.57 1vkp h GLU 198 CO -0.03 0.93 -0.46 -0.07 -1.16 0.00 0.00 179.01 178.23 1vkp h LEU 199 N 1.03 0.55 -0.47 1.33 3.38 -0.67 -0.94 115.31 119.52 1vkp h LEU 199 Ca 0.23 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 57.95 1vkp h LEU 199 Cb 0.30 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 1vkp h LEU 199 CO -0.01 0.93 0.29 0.11 0.09 0.00 0.00 178.44 179.85 1vkp h LYS 200 N 0.41 0.56 -0.19 1.13 1.57 -0.43 0.16 116.57 119.77 1vkp h LYS 200 Ca 0.03 -0.03 -0.14 0.00 -1.87 0.00 0.00 60.65 58.63 1vkp h LYS 200 Cb 0.96 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.14 1vkp h LYS 200 CO 0.09 0.37 -0.48 0.87 -0.57 0.00 0.00 179.45 179.73 1vkp h LYS 201 N 0.58 0.51 0.06 3.15 1.57 -1.06 -1.31 116.57 120.06 1vkp h LYS 201 Ca 0.18 -0.29 -0.35 0.00 -1.87 0.00 0.00 60.65 58.33 1vkp h LYS 201 Cb -0.01 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.28 1vkp h LYS 201 CO -0.07 0.88 -2.00 0.66 -0.57 0.00 0.00 179.45 178.34 1vkp n TYR 202 N -3.99 0.90 1.00 -1.35 4.02 -0.39 -1.54 117.16 115.81 1vkp n TYR 202 Ca -0.02 0.24 0.10 0.00 -0.01 0.00 0.00 57.90 58.21 1vkp n TYR 202 Cb 0.56 -1.13 -0.11 0.00 -0.02 0.00 0.00 39.34 38.63 1vkp n TYR 202 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1vkp n LEU 203 N -3.24 1.06 -1.36 7.72 4.77 0.03 -4.74 117.00 121.23 1vkp n LEU 203 Ca -0.29 -0.51 -0.11 0.00 -0.03 0.00 0.00 56.01 55.07 1vkp n LEU 203 Cb 1.05 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.15 1vkp n LEU 203 CO 0.41 0.26 -0.10 0.61 -1.33 0.00 0.00 177.39 177.25 1vkp n GLY 204 N 1.50 -0.03 3.98 -0.72 0.00 -0.50 -4.43 105.19 104.98 1vkp n GLY 204 Ca 0.04 -0.40 -0.20 0.00 0.00 0.00 0.00 46.02 45.46 1vkp n GLY 204 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1vkp s VAL 205 N -2.64 4.77 -0.00 1.61 -7.23 -1.21 -4.68 120.40 111.02 1vkp s VAL 205 Ca 0.05 -0.94 0.01 0.00 -1.81 0.00 0.00 61.98 59.29 1vkp s VAL 205 Cb -0.02 -3.68 -0.02 0.00 0.56 0.00 0.00 36.38 33.22 1vkp s VAL 205 CO 0.06 -0.28 0.03 0.00 -0.31 0.00 0.00 175.10 174.60 1vkp n GLN 206 N -1.54 0.86 -3.79 4.82 3.00 0.69 -4.45 117.38 116.97 1vkp n GLN 206 Ca -0.05 -0.01 -0.09 0.00 -0.01 0.00 0.00 57.00 56.83 1vkp n GLN 206 Cb 0.57 -1.04 -0.06 0.00 0.00 0.00 0.00 30.24 29.72 1vkp n GLN 206 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 1vkp s SER 207 N -2.39 -0.03 0.06 1.08 1.04 -0.87 -5.04 113.70 107.55 1vkp s SER 207 Ca -0.01 -0.56 0.06 0.00 0.48 0.00 0.00 55.95 55.93 1vkp s SER 207 Cb 0.01 0.41 -0.03 0.00 0.10 0.00 0.00 66.02 66.51 1vkp s SER 207 CO 0.06 -0.81 -0.16 -0.36 0.98 0.00 0.00 173.24 172.95 1vkp s PHE 208 N -3.86 1.38 -0.25 5.02 0.40 -1.26 -1.33 117.98 118.08 1vkp s PHE 208 Ca 0.06 -0.41 0.02 0.00 -0.60 0.00 0.00 56.93 56.01 1vkp s PHE 208 Cb 0.03 -0.79 0.06 0.00 0.51 0.00 0.00 43.02 42.84 1vkp s PHE 208 CO -0.10 0.08 -0.09 0.42 0.70 0.00 0.00 175.22 176.23 1vkp s ILE 209 N -1.07 1.99 -0.49 0.64 1.01 -0.30 -4.94 121.20 118.05 1vkp s ILE 209 Ca 0.02 -1.53 -0.18 0.00 0.00 0.00 0.00 60.65 58.96 1vkp s ILE 209 Cb -0.09 -2.15 0.06 0.00 0.01 0.00 0.00 42.46 40.29 1vkp s ILE 209 CO 0.02 -0.06 0.52 0.26 0.00 0.00 0.00 174.94 175.68 1vkp s TRP 210 N 1.18 3.13 0.17 3.97 0.52 -1.26 -1.41 118.94 125.24 1vkp s TRP 210 Ca -0.08 -0.67 -0.30 0.00 0.02 0.00 0.00 56.10 55.07 1vkp s TRP 210 Cb -0.20 -3.35 -0.07 0.00 -1.15 0.00 0.00 33.47 28.70 1vkp s TRP 210 CO -0.05 -0.92 0.96 -0.51 0.02 0.00 0.00 176.95 176.45 1vkp s LEU 211 N 2.22 4.56 0.20 2.99 1.43 -0.27 -4.88 118.68 124.93 1vkp s LEU 211 Ca 0.11 1.88 -0.09 0.00 -1.03 0.00 0.00 54.13 55.00 1vkp s LEU 211 Cb -0.21 -3.60 0.14 0.00 0.03 0.00 0.00 46.19 42.55 1vkp s LEU 211 CO 0.10 0.01 1.77 -0.65 0.23 0.00 0.00 176.35 177.81 1vkp h PRO 212 N 4.97 1.12 -4.72 1.29 0.11 -1.93 -0.56 132.00 132.28 1vkp h PRO 212 Ca -0.44 -0.20 -0.28 0.00 0.11 0.00 0.00 66.00 65.20 1vkp h PRO 212 Cb 1.21 -0.18 -0.18 0.00 0.11 0.00 0.00 31.00 31.95 1vkp h PRO 212 CO 0.70 0.91 -0.72 1.03 -0.21 0.00 0.00 178.00 179.71 1vkp s ARG 213 N -5.56 0.71 0.00 1.05 0.52 -1.26 -1.34 118.95 113.07 1vkp s ARG 213 Ca -0.12 -1.04 0.00 0.00 -0.52 0.00 0.00 55.73 54.04 1vkp s ARG 213 Cb 0.15 -0.35 0.00 0.00 0.52 0.00 0.00 34.95 35.27 1vkp s ARG 213 CO 0.83 0.04 0.00 0.41 0.02 0.00 0.00 175.30 176.60 1vkp n GLY 214 N 0.77 0.85 3.76 -3.53 0.00 -1.25 -4.95 105.19 100.84 1vkp n GLY 214 Ca -0.18 -1.84 -0.40 0.00 0.00 0.00 0.00 46.02 43.60 1vkp n GLY 214 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1vkp s LEU 215 N 0.00 4.50 0.24 0.99 2.96 -1.26 -4.97 118.68 121.14 1vkp s LEU 215 Ca 0.00 2.35 -0.30 0.00 -0.22 0.00 0.00 54.13 55.96 1vkp s LEU 215 Cb 0.00 -3.66 -0.10 0.00 0.50 0.00 0.00 46.19 42.92 1vkp s LEU 215 CO 0.00 -0.25 1.52 -0.47 -1.32 0.00 0.00 176.35 175.83 1vkp s TYR 216 N -1.18 2.95 0.00 5.38 5.04 -1.26 -2.18 117.35 126.11 1vkp s TYR 216 Ca 0.46 0.85 0.00 0.00 -2.44 0.00 0.00 57.07 55.95 1vkp s TYR 216 Cb -0.33 -3.92 0.00 0.00 0.35 0.00 0.00 41.96 38.06 1vkp s TYR 216 CO 0.43 -3.12 0.00 0.41 -1.34 0.00 0.00 175.55 171.93 1vkp n GLY 217 N 2.58 0.22 2.30 8.97 0.00 -1.26 -4.61 105.19 113.39 1vkp n GLY 217 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 1vkp n GLY 217 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1vkp n ASP 218 N 0.00 7.10 0.26 1.61 8.00 -0.92 -4.50 116.55 128.09 1vkp n ASP 218 Ca 0.00 -3.48 0.11 0.00 0.71 0.00 0.00 54.79 52.13 1vkp n ASP 218 Cb 0.00 -1.06 0.70 0.00 -0.02 0.00 0.00 41.12 40.74 1vkp n ASP 218 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1vkp h GLU 219 N 2.13 0.00 -0.13 -1.24 4.39 -1.93 -1.57 114.58 116.22 1vkp h GLU 219 Ca 0.47 0.00 -0.21 0.00 0.34 0.00 0.00 59.36 59.96 1vkp h GLU 219 Cb 0.71 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.37 1vkp h GLU 219 CO 1.20 0.11 -0.75 -0.44 -1.16 0.00 0.00 179.01 177.97 1vkp h ASP 220 N 0.00 0.77 0.48 1.42 3.32 -1.95 -2.78 116.42 117.67 1vkp h ASP 220 Ca -0.00 -0.50 0.00 0.00 0.02 0.00 0.00 57.03 56.55 1vkp h ASP 220 Cb 0.27 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1vkp h ASP 220 CO 0.01 1.27 -0.29 0.35 -1.72 0.00 0.00 179.24 178.87 1vkp n THR 221 N -3.90 0.00 -3.52 0.35 -2.24 -1.17 -4.78 114.28 99.01 1vkp n THR 221 Ca -0.06 -0.04 -0.20 0.00 -2.27 0.00 0.00 64.05 61.47 1vkp n THR 221 Cb 0.73 0.11 0.08 0.00 -2.10 0.00 0.00 70.33 69.14 1vkp n THR 221 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1vkp n ASN 222 N -1.18 -3.50 -1.26 3.42 3.02 -0.65 -4.21 115.26 110.90 1vkp n ASN 222 Ca 0.09 -0.61 -0.03 0.00 -0.03 0.00 0.00 54.58 54.00 1vkp n ASN 222 Cb 0.33 -4.97 0.01 0.00 -0.61 0.00 0.00 39.78 34.54 1vkp n ASN 222 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1vkp n GLY 223 N -1.47 0.44 3.63 7.41 0.00 -0.83 -1.68 105.19 112.68 1vkp n GLY 223 Ca -0.18 -0.43 -0.45 0.00 0.00 0.00 0.00 46.02 44.96 1vkp n GLY 223 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1vkp n HIS 224 N -1.93 1.70 -0.23 1.61 8.25 -1.26 -3.79 115.22 119.58 1vkp n HIS 224 Ca -0.03 0.60 0.11 0.00 -0.26 0.00 0.00 57.72 58.14 1vkp n HIS 224 Cb 0.52 -2.34 0.39 0.00 1.12 0.00 0.00 29.99 29.68 1vkp n HIS 224 CO 0.00 0.00 0.00 0.97 0.64 0.00 0.00 176.34 177.95 1vkp h ILE 225 N 2.48 0.89 0.00 1.59 6.09 -1.76 -2.44 117.51 124.35 1vkp h ILE 225 Ca -0.43 -0.23 0.00 0.00 -1.37 0.00 0.00 64.86 62.83 1vkp h ILE 225 Cb 1.31 0.16 0.00 0.00 0.47 0.00 0.00 36.82 38.76 1vkp h ILE 225 CO 0.66 0.12 0.00 -0.90 -3.07 0.00 0.00 178.15 174.97 1vkp n ASP 226 N -4.52 0.00 -1.88 2.19 5.75 -0.89 -1.27 116.55 115.93 1vkp n ASP 226 Ca 0.15 0.22 -0.18 0.00 -0.01 0.00 0.00 54.79 54.97 1vkp n ASP 226 Cb 0.40 -0.36 0.18 0.00 -1.03 0.00 0.00 41.12 40.31 1vkp n ASP 226 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1vkp n ASN 227 N -1.36 3.46 -4.76 -1.12 5.15 -0.92 -3.71 115.26 112.00 1vkp n ASN 227 Ca 0.06 -3.68 -0.40 0.00 -0.60 0.00 0.00 54.58 49.96 1vkp n ASN 227 Cb 0.13 -0.77 -0.06 0.00 -0.53 0.00 0.00 39.78 38.56 1vkp n ASN 227 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1vkp s PHE 231 N -3.94 3.53 -0.14 0.00 0.40 -1.26 -1.03 117.98 115.54 1vkp s PHE 231 Ca 0.11 1.70 0.18 0.00 -0.60 0.00 0.00 56.93 58.32 1vkp s PHE 231 Cb 0.07 -3.24 -0.25 0.00 0.51 0.00 0.00 43.02 40.11 1vkp s PHE 231 CO -0.07 -0.52 0.31 0.00 0.70 0.00 0.00 175.22 175.64 1vkp n ALA 232 N 0.91 1.78 -3.61 5.36 0.00 -0.05 -4.84 120.51 120.06 1vkp n ALA 232 Ca 0.00 -1.03 -0.01 0.00 0.00 0.00 0.00 53.44 52.40 1vkp n ALA 232 Cb 0.46 -0.46 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 1vkp n ALA 232 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1vkp s ARG 233 N -2.74 0.38 0.24 0.00 1.70 -1.22 -5.00 118.95 112.32 1vkp s ARG 233 Ca -0.08 -0.19 -0.31 0.00 -0.47 0.00 0.00 55.73 54.68 1vkp s ARG 233 Cb 0.08 0.15 -0.12 0.00 -0.57 0.00 0.00 34.95 34.48 1vkp s ARG 233 CO 0.84 -0.17 1.58 -2.30 -1.08 0.00 0.00 175.30 174.17 1vkp n PRO 234 N -0.32 2.48 -0.99 3.89 -0.02 -1.26 -1.73 135.00 137.04 1vkp n PRO 234 Ca -0.05 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 1vkp n PRO 234 Cb 0.61 -2.65 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 1vkp n PRO 234 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1vkp n GLY 235 N 2.76 0.60 2.81 -1.23 0.00 -1.26 -5.02 105.19 103.85 1vkp n GLY 235 Ca 0.12 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.97 1vkp n GLY 235 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vkp s VAL 236 N -2.48 0.15 0.16 1.61 1.01 -0.71 -1.03 120.40 119.11 1vkp s VAL 236 Ca 0.00 0.11 0.09 0.00 0.00 0.00 0.00 61.98 62.18 1vkp s VAL 236 Cb 0.00 -0.25 -0.04 0.00 0.00 0.00 0.00 36.38 36.09 1vkp s VAL 236 CO 0.00 0.14 -0.19 0.68 0.00 0.00 0.00 175.10 175.73 1vkp s VAL 237 N 1.07 1.86 -0.21 2.92 -7.23 -0.34 -0.88 120.40 117.59 1vkp s VAL 237 Ca -0.09 -1.85 -0.10 0.00 -1.81 0.00 0.00 61.98 58.12 1vkp s VAL 237 Cb -0.13 -1.82 -0.05 0.00 0.56 0.00 0.00 36.38 34.94 1vkp s VAL 237 CO -0.02 -0.24 0.14 -0.76 -0.31 0.00 0.00 175.10 173.91 1vkp s LEU 238 N -2.51 4.15 -0.12 1.32 1.43 -0.19 -0.55 118.68 122.21 1vkp s LEU 238 Ca 0.14 0.18 0.03 0.00 -1.03 0.00 0.00 54.13 53.45 1vkp s LEU 238 Cb -0.07 -2.09 0.01 0.00 0.03 0.00 0.00 46.19 44.07 1vkp s LEU 238 CO 0.06 0.14 -0.22 -0.22 0.23 0.00 0.00 176.35 176.34 1vkp s LEU 239 N 0.61 2.07 0.20 1.79 2.96 -0.38 -1.97 118.68 123.95 1vkp s LEU 239 Ca 0.08 -0.57 -0.33 0.00 -0.22 0.00 0.00 54.13 53.09 1vkp s LEU 239 Cb -0.12 -1.39 -0.13 0.00 0.50 0.00 0.00 46.19 45.05 1vkp s LEU 239 CO 0.00 0.10 1.60 -1.20 -1.32 0.00 0.00 176.35 175.54 1vkp n SER 240 N 3.87 3.39 -3.94 3.68 7.64 -1.26 -1.13 113.62 125.87 1vkp n SER 240 Ca -0.20 1.09 -0.10 0.00 1.01 0.00 0.00 58.87 60.68 1vkp n SER 240 Cb 0.52 -1.49 -0.11 0.00 -1.01 0.00 0.00 64.21 62.12 1vkp n SER 240 CO 0.00 0.00 0.00 0.86 -3.01 0.00 0.00 175.04 172.89 1vkp s TRP 241 N 0.76 0.16 -0.03 1.43 -0.11 -0.63 -4.72 118.94 115.79 1vkp s TRP 241 Ca 0.75 -0.33 -0.10 0.00 1.22 0.00 0.00 56.10 57.63 1vkp s TRP 241 Cb -0.61 -0.12 0.02 0.00 -1.50 0.00 0.00 33.47 31.26 1vkp s TRP 241 CO 0.39 -0.18 0.23 -0.08 -4.62 0.00 0.00 176.95 172.69 1vkp s THR 242 N -1.16 0.05 -2.56 5.86 -1.32 -1.26 -1.43 115.64 113.82 1vkp s THR 242 Ca -0.13 -0.40 0.27 0.00 -1.21 0.00 0.00 61.69 60.22 1vkp s THR 242 Cb -0.08 -0.47 0.43 0.00 -1.51 0.00 0.00 72.50 70.88 1vkp s THR 242 CO -0.00 -0.22 1.60 0.47 -2.21 0.00 0.00 174.62 174.26 1vkp n ASP 243 N 1.87 1.84 -4.53 8.08 8.00 -1.26 -4.79 116.55 125.76 1vkp n ASP 243 Ca -0.19 -1.58 -0.42 0.00 0.71 0.00 0.00 54.79 53.31 1vkp n ASP 243 Cb 0.57 0.02 -0.03 0.00 -0.02 0.00 0.00 41.12 41.65 1vkp n ASP 243 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1vkp s ASP 244 N -2.05 6.32 0.07 -2.24 -1.08 -1.26 -4.90 116.67 111.53 1vkp s ASP 244 Ca 0.34 -0.33 0.17 0.00 -0.52 0.00 0.00 52.55 52.22 1vkp s ASP 244 Cb 0.21 -2.49 0.73 0.00 -1.46 0.00 0.00 42.92 39.91 1vkp s ASP 244 CO 0.35 -1.43 1.54 -0.62 0.52 0.00 0.00 175.17 175.53 1vkp n GLU 245 N 8.08 0.06 0.00 4.34 1.02 -1.26 -1.54 120.64 131.33 1vkp n GLU 245 Ca 0.03 0.29 0.13 0.00 -0.02 0.00 0.00 57.16 57.59 1vkp n GLU 245 Cb 0.48 -1.60 0.43 0.00 -0.02 0.00 0.00 31.44 30.72 1vkp n GLU 245 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1vkp n THR 246 N -1.71 0.00 -2.84 2.62 -2.24 -1.26 -4.83 114.28 104.03 1vkp n THR 246 Ca 0.03 -0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.40 1vkp n THR 246 Cb 0.19 -0.09 -0.04 0.00 -2.10 0.00 0.00 70.33 68.29 1vkp n THR 246 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1vkp s ASP 247 N -2.97 7.16 0.66 3.42 3.68 -0.59 -4.94 116.67 123.09 1vkp s ASP 247 Ca 0.13 1.41 0.36 0.00 2.13 0.00 0.00 52.55 56.58 1vkp s ASP 247 Cb 0.18 -2.50 1.98 0.00 -1.45 0.00 0.00 42.92 41.13 1vkp s ASP 247 CO 0.61 -0.28 2.12 -0.65 0.13 0.00 0.00 175.17 177.11 1vkp h PRO 248 N 6.95 0.00 -0.21 4.34 0.11 -1.88 -0.54 132.00 140.77 1vkp h PRO 248 Ca -0.37 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.72 1vkp h PRO 248 Cb 1.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 1vkp h PRO 248 CO 0.79 0.00 0.01 0.37 -0.21 0.00 0.00 178.00 178.96 1vkp h GLN 249 N 0.00 0.30 -0.15 1.05 5.75 -1.92 -3.31 115.11 116.84 1vkp h GLN 249 Ca 0.01 -0.05 0.04 0.00 -0.15 0.00 0.00 58.65 58.50 1vkp h GLN 249 Cb 0.38 -0.05 -0.04 0.00 1.07 0.00 0.00 27.48 28.83 1vkp h GLN 249 CO -0.00 0.32 -0.09 -0.92 -2.65 0.00 0.00 178.83 175.49 1vkp h TYR 250 N 0.30 -0.22 -0.32 3.99 3.20 -1.32 -0.70 116.97 121.91 1vkp h TYR 250 Ca 0.07 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.93 1vkp h TYR 250 Cb 0.19 0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.57 1vkp h TYR 250 CO 0.00 -0.14 0.09 1.05 -1.64 0.00 0.00 178.16 177.52 1vkp h GLU 251 N -0.09 0.46 -0.14 1.82 4.11 -1.75 -0.06 114.58 118.94 1vkp h GLU 251 Ca 0.09 -0.06 -0.03 0.00 0.07 0.00 0.00 59.36 59.42 1vkp h GLU 251 Cb 0.22 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 1vkp h GLU 251 CO -0.21 0.42 -0.05 0.00 0.07 0.00 0.00 179.01 179.24 1vkp h ARG 252 N 0.46 0.28 -0.58 1.06 3.08 -1.50 -1.73 114.38 115.44 1vkp h ARG 252 Ca 0.11 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 60.02 1vkp h ARG 252 Cb 0.16 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.17 1vkp h ARG 252 CO -0.01 0.59 0.28 0.77 -1.07 0.00 0.00 179.97 180.53 1vkp h SER 253 N -0.05 0.76 -0.59 7.04 0.02 -0.66 -0.83 113.55 119.24 1vkp h SER 253 Ca 0.03 -0.13 -0.06 0.00 -0.84 0.00 0.00 61.79 60.79 1vkp h SER 253 Cb 0.50 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.82 1vkp h SER 253 CO 0.02 0.68 0.12 0.58 -1.14 0.00 0.00 176.83 177.09 1vkp h VAL 254 N 0.78 1.25 -0.28 2.27 2.07 -1.02 -0.50 116.25 120.82 1vkp h VAL 254 Ca 0.20 -0.94 -0.02 0.00 0.82 0.00 0.00 66.70 66.76 1vkp h VAL 254 Cb 0.12 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1vkp h VAL 254 CO -0.02 0.35 0.11 -0.08 0.02 0.00 0.00 177.57 177.94 1vkp h GLU 255 N 0.87 0.41 -0.55 1.57 4.81 -1.14 -1.52 114.58 119.02 1vkp h GLU 255 Ca 0.18 -0.07 0.02 0.00 -0.13 0.00 0.00 59.36 59.36 1vkp h GLU 255 Cb 0.38 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.66 1vkp h GLU 255 CO 0.01 0.44 0.34 0.00 -0.73 0.00 0.00 179.01 179.06 1vkp h ALA 256 N 0.95 0.70 -0.87 2.92 0.00 -0.96 -1.31 119.26 120.70 1vkp h ALA 256 Ca 0.09 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.03 1vkp h ALA 256 Cb 0.18 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 17.73 1vkp h ALA 256 CO -0.01 0.07 0.55 1.25 0.00 0.00 0.00 179.25 181.12 1vkp h LEU 257 N 0.68 0.89 -0.26 0.00 5.85 -0.87 0.18 115.31 121.78 1vkp h LEU 257 Ca 0.22 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.94 1vkp h LEU 257 Cb -0.01 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.82 1vkp h LEU 257 CO -0.08 0.59 0.16 -1.28 -0.34 0.00 0.00 178.44 177.49 1vkp h SER 258 N 1.04 0.31 -0.38 1.25 0.87 -0.87 0.24 113.55 116.01 1vkp h SER 258 Ca 0.36 -0.05 -0.01 0.00 -1.23 0.00 0.00 61.79 60.86 1vkp h SER 258 Cb 0.09 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 61.95 1vkp h SER 258 CO -0.14 0.27 0.21 0.58 -0.53 0.00 0.00 176.83 177.22 1vkp h VAL 259 N 0.33 1.15 -0.88 2.23 2.07 -0.93 -2.42 116.25 117.79 1vkp h VAL 259 Ca 0.09 -0.39 0.01 0.00 0.82 0.00 0.00 66.70 67.23 1vkp h VAL 259 Cb 0.02 0.71 -0.04 0.00 -1.52 0.00 0.00 31.29 30.46 1vkp h VAL 259 CO -0.02 0.15 0.58 -0.07 0.02 0.00 0.00 177.57 178.24 1vkp h LEU 260 N 0.49 1.01 -0.81 2.57 3.38 -0.75 -1.54 115.31 119.65 1vkp h LEU 260 Ca 0.13 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1vkp h LEU 260 Cb 0.06 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.56 1vkp h LEU 260 CO -0.02 0.73 0.00 -1.54 0.09 0.00 0.00 178.44 177.69 1vkp n SER 261 N -4.40 0.66 -0.84 -0.43 3.41 0.05 -1.97 113.62 110.10 1vkp n SER 261 Ca 0.10 0.68 0.07 0.00 -0.26 0.00 0.00 58.87 59.46 1vkp n SER 261 Cb 0.03 -0.81 0.22 0.00 -0.26 0.00 0.00 64.21 63.39 1vkp n SER 261 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1vkp n ASN 262 N -2.24 3.54 -4.68 4.04 3.02 -0.62 -5.00 115.26 113.32 1vkp n ASN 262 Ca 0.02 -2.52 -0.31 0.00 -0.03 0.00 0.00 54.58 51.74 1vkp n ASN 262 Cb 0.20 -0.41 -0.08 0.00 -0.61 0.00 0.00 39.78 38.88 1vkp n ASN 262 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1vkp s SER 263 N -1.42 5.04 -0.02 6.41 0.01 -0.83 -5.06 113.70 117.83 1vkp s SER 263 Ca 0.34 -0.13 0.04 0.00 1.31 0.00 0.00 55.95 57.52 1vkp s SER 263 Cb 0.24 -1.23 -0.01 0.00 0.21 0.00 0.00 66.02 65.23 1vkp s SER 263 CO 0.13 0.21 -0.15 -0.63 0.41 0.00 0.00 173.24 173.21 1vkp s ILE 264 N -1.24 1.23 0.93 1.44 -1.09 -1.26 -4.02 121.20 117.19 1vkp s ILE 264 Ca 0.24 -0.64 -0.12 0.00 -2.23 0.00 0.00 60.65 57.89 1vkp s ILE 264 Cb -0.12 -1.04 0.21 0.00 -1.58 0.00 0.00 42.46 39.93 1vkp s ILE 264 CO 0.16 0.35 1.27 1.51 -1.23 0.00 0.00 174.94 177.00 1vkp s ASP 265 N -0.21 3.16 0.31 3.58 3.84 -0.18 -4.89 116.67 122.27 1vkp s ASP 265 Ca 0.03 -0.03 0.25 0.00 -0.00 0.00 0.00 52.55 52.80 1vkp s ASP 265 Cb -0.08 0.01 1.07 0.00 -1.38 0.00 0.00 42.92 42.54 1vkp s ASP 265 CO 0.00 -2.68 1.75 0.00 -0.00 0.00 0.00 175.17 174.24 1vkp h ALA 266 N -1.47 1.00 -0.54 2.11 0.00 -1.84 -1.86 119.26 116.67 1vkp h ALA 266 Ca -0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1vkp h ALA 266 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1vkp h ALA 266 CO 0.33 0.00 0.00 0.54 0.00 0.00 0.00 179.25 180.12 1vkp n ARG 267 N -2.36 2.74 -1.00 0.00 5.12 -1.26 -4.97 116.66 114.93 1vkp n ARG 267 Ca 0.01 -2.35 0.00 0.00 -1.93 0.00 0.00 57.85 53.58 1vkp n ARG 267 Cb 0.22 -1.43 0.00 0.00 -1.16 0.00 0.00 32.46 30.09 1vkp n ARG 267 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1vkp n GLY 268 N 1.13 0.61 3.89 -0.13 0.00 -0.70 -5.06 105.19 104.93 1vkp n GLY 268 Ca 0.18 -0.78 -0.35 0.00 0.00 0.00 0.00 46.02 45.08 1vkp n GLY 268 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vkp s ARG 269 N -2.08 3.49 0.72 1.61 0.52 -1.26 -4.85 118.95 117.09 1vkp s ARG 269 Ca 0.00 -0.18 -0.13 0.00 -0.52 0.00 0.00 55.73 54.90 1vkp s ARG 269 Cb 0.00 -3.13 0.03 0.00 0.52 0.00 0.00 34.95 32.37 1vkp s ARG 269 CO 0.00 0.71 1.11 0.15 0.02 0.00 0.00 175.30 177.29 1vkp s LYS 270 N -1.56 2.47 -0.24 3.54 1.02 -1.26 -1.01 119.74 122.70 1vkp s LYS 270 Ca 0.23 1.34 -0.09 0.00 0.02 0.00 0.00 55.97 57.47 1vkp s LYS 270 Cb -0.13 -1.91 -0.04 0.00 -0.52 0.00 0.00 37.83 35.23 1vkp s LYS 270 CO 0.13 -1.50 0.13 0.42 -0.92 0.00 0.00 175.35 173.61 1vkp s ILE 271 N -2.53 5.05 -0.04 2.17 -1.09 -1.26 -4.80 121.20 118.70 1vkp s ILE 271 Ca 0.65 0.07 -0.23 0.00 -2.23 0.00 0.00 60.65 58.91 1vkp s ILE 271 Cb -0.20 -3.35 -0.04 0.00 -1.58 0.00 0.00 42.46 37.29 1vkp s ILE 271 CO 0.48 0.35 0.69 -1.58 -1.23 0.00 0.00 174.94 173.65 1vkp s GLN 272 N 1.12 4.43 -0.17 2.79 0.74 -0.19 -4.82 119.66 123.55 1vkp s GLN 272 Ca 0.06 0.88 -0.02 0.00 0.05 0.00 0.00 55.36 56.33 1vkp s GLN 272 Cb -0.14 -3.42 -0.01 0.00 1.10 0.00 0.00 33.01 30.54 1vkp s GLN 272 CO 0.05 0.15 -0.08 0.08 -0.55 0.00 0.00 175.29 174.93 1vkp s VAL 273 N 0.49 3.27 -0.23 1.34 1.01 -1.26 -1.20 120.40 123.82 1vkp s VAL 273 Ca 0.36 -0.56 -0.07 0.00 0.00 0.00 0.00 61.98 61.72 1vkp s VAL 273 Cb -0.18 -2.43 -0.03 0.00 0.00 0.00 0.00 36.38 33.74 1vkp s VAL 273 CO 0.19 0.48 0.05 -0.63 0.00 0.00 0.00 175.10 175.19 1vkp s ILE 274 N 0.86 4.31 -0.03 2.22 1.01 0.29 -4.99 121.20 124.88 1vkp s ILE 274 Ca -0.02 -0.18 -0.29 0.00 0.00 0.00 0.00 60.65 60.16 1vkp s ILE 274 Cb -0.15 -2.99 -0.03 0.00 0.01 0.00 0.00 42.46 39.30 1vkp s ILE 274 CO 0.01 0.38 0.95 -0.54 0.00 0.00 0.00 174.94 175.73 1vkp s LYS 275 N 1.29 4.52 -0.31 2.79 1.02 -1.26 -1.25 119.74 126.53 1vkp s LYS 275 Ca 0.05 1.34 0.02 0.00 0.02 0.00 0.00 55.97 57.40 1vkp s LYS 275 Cb -0.15 -3.47 0.08 0.00 -0.52 0.00 0.00 37.83 33.77 1vkp s LYS 275 CO 0.03 -0.08 -0.00 -1.17 -0.92 0.00 0.00 175.35 173.21 1vkp s LEU 276 N 1.15 4.18 0.03 3.17 2.96 -0.29 -4.89 118.68 125.00 1vkp s LEU 276 Ca 0.49 -1.72 -0.30 0.00 -0.22 0.00 0.00 54.13 52.38 1vkp s LEU 276 Cb -0.20 -1.63 -0.05 0.00 0.50 0.00 0.00 46.19 44.81 1vkp s LEU 276 CO 0.25 -0.31 1.20 -0.31 -1.32 0.00 0.00 176.35 175.87 1vkp s TYR 277 N 1.05 3.37 0.80 5.38 2.02 -1.26 -1.61 117.35 127.11 1vkp s TYR 277 Ca 0.01 1.28 -0.12 0.00 -0.37 0.00 0.00 57.07 57.86 1vkp s TYR 277 Cb -0.20 -3.42 0.08 0.00 -0.40 0.00 0.00 41.96 38.02 1vkp s TYR 277 CO -0.05 -1.29 1.16 0.96 -1.57 0.00 0.00 175.55 174.75 1vkp s ILE 278 N 1.36 2.45 0.86 2.71 -4.36 -0.51 -4.77 121.20 118.94 1vkp s ILE 278 Ca 0.58 0.18 -0.10 0.00 -0.26 0.00 0.00 60.65 61.04 1vkp s ILE 278 Cb -0.28 -2.52 0.11 0.00 1.25 0.00 0.00 42.46 41.02 1vkp s ILE 278 CO 0.27 -0.16 1.13 -2.16 0.24 0.00 0.00 174.94 174.26 1vkp s PRO 279 N -4.38 1.52 0.63 0.37 0.04 -1.26 -4.97 135.00 126.95 1vkp s PRO 279 Ca 0.69 1.40 -0.18 0.00 0.04 0.00 0.00 61.00 62.95 1vkp s PRO 279 Cb -0.24 -1.80 -0.04 0.00 0.04 0.00 0.00 34.50 32.47 1vkp s PRO 279 CO 0.52 -2.23 0.93 0.39 0.04 0.00 0.00 177.00 176.64 1vkp n GLU 280 N -3.93 0.76 -1.61 4.56 1.02 -1.26 -4.81 120.64 115.37 1vkp n GLU 280 Ca 0.11 0.31 -0.51 0.00 -0.02 0.00 0.00 57.16 57.05 1vkp n GLU 280 Cb 0.52 -2.15 -0.06 0.00 -0.02 0.00 0.00 31.44 29.74 1vkp n GLU 280 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1vkp n PRO 281 N -1.16 1.35 -4.43 3.49 -0.02 -1.26 -4.97 135.00 128.00 1vkp n PRO 281 Ca 0.14 0.49 -0.34 0.00 -2.02 0.00 0.00 63.50 61.76 1vkp n PRO 281 Cb 0.48 -2.15 -0.11 0.00 -0.02 0.00 0.00 33.50 31.70 1vkp n PRO 281 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1vkp s LEU 282 N 0.57 3.34 0.00 2.45 1.02 -1.26 -5.06 118.68 119.74 1vkp s LEU 282 Ca 0.83 -0.02 0.00 0.00 0.02 0.00 0.00 54.13 54.96 1vkp s LEU 282 Cb -0.90 -1.78 0.00 0.00 0.02 0.00 0.00 46.19 43.53 1vkp s LEU 282 CO 0.45 0.27 0.00 -1.22 0.02 0.00 0.00 176.35 175.87 1vkp n TYR 283 N 2.86 0.00 -4.20 0.29 4.02 -1.26 -0.64 117.16 118.23 1vkp n TYR 283 Ca -0.18 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.55 1vkp n TYR 283 Cb 0.53 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.78 1vkp n TYR 283 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 1vkp s THR 285 N 3.90 0.00 0.00 -0.72 -4.23 -1.26 -4.83 115.64 108.50 1vkp s THR 285 Ca 0.00 -1.85 -0.19 0.00 -1.18 0.00 0.00 61.69 58.47 1vkp s THR 285 Cb 0.00 -2.53 -0.25 0.00 1.34 0.00 0.00 72.50 71.06 1vkp s THR 285 CO 0.00 0.00 1.07 -0.33 -0.54 0.00 0.00 174.62 174.82 1vkp h GLU 286 N 2.22 0.43 -0.87 3.99 4.39 -1.98 -2.19 114.58 120.57 1vkp h GLU 286 Ca -0.28 -0.51 0.10 0.00 0.34 0.00 0.00 59.36 59.01 1vkp h GLU 286 Cb 1.24 0.16 -0.06 0.00 -0.10 0.00 0.00 28.75 29.98 1vkp h GLU 286 CO 0.40 1.17 0.56 1.49 -1.16 0.00 0.00 179.01 181.47 1vkp h GLU 287 N -0.09 0.79 0.02 2.33 4.57 -2.03 -1.24 114.58 118.93 1vkp h GLU 287 Ca -0.10 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 58.03 1vkp h GLU 287 Cb 1.45 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 29.87 1vkp h GLU 287 CO 0.14 0.53 -0.01 0.93 -1.18 0.00 0.00 179.01 179.42 1vkp h GLU 288 N 0.82 -0.02 0.00 1.92 5.08 -2.00 -3.16 114.58 117.21 1vkp h GLU 288 Ca 0.41 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.73 1vkp h GLU 288 Cb 0.46 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 1vkp h GLU 288 CO -0.17 0.53 -0.18 1.03 -1.00 0.00 0.00 179.01 179.22 1vkp h SER 289 N -0.60 0.00 1.88 1.42 0.87 -1.22 -2.84 113.55 113.06 1vkp h SER 289 Ca -0.00 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.54 1vkp h SER 289 Cb 0.57 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.53 1vkp h SER 289 CO 0.00 0.18 -0.09 0.77 -0.53 0.00 0.00 176.83 177.17 1vkp h SER 290 N 0.00 0.00 0.29 6.23 4.64 -1.27 -3.14 113.55 120.30 1vkp h SER 290 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1vkp h SER 290 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 1vkp h SER 290 CO 0.02 0.09 0.00 0.61 -0.87 0.00 0.00 176.83 176.68 1vkp n GLY 291 N 1.09 -1.03 3.53 -0.77 0.00 -1.07 -4.78 105.19 102.15 1vkp n GLY 291 Ca 0.04 -0.14 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 1vkp n GLY 291 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vkp s ILE 292 N -2.34 3.97 0.21 -0.61 1.01 -1.19 -2.22 121.20 120.04 1vkp s ILE 292 Ca 0.32 -0.34 -0.30 0.00 0.00 0.00 0.00 60.65 60.33 1vkp s ILE 292 Cb 0.18 -2.73 -0.09 0.00 0.01 0.00 0.00 42.46 39.83 1vkp s ILE 292 CO 0.37 0.51 1.40 -0.89 0.00 0.00 0.00 174.94 176.32 1vkp s THR 293 N 0.17 2.91 -0.19 2.92 2.01 -0.64 -4.98 115.64 117.83 1vkp s THR 293 Ca -0.01 0.74 -0.06 0.00 0.31 0.00 0.00 61.69 62.67 1vkp s THR 293 Cb -0.14 -3.47 -0.03 0.00 0.01 0.00 0.00 72.50 68.87 1vkp s THR 293 CO 0.03 0.11 0.02 -1.10 -0.69 0.00 0.00 174.62 172.98 1vkp s GLN 294 N -0.04 3.74 0.00 4.92 -1.52 -1.26 -4.40 119.66 121.10 1vkp s GLN 294 Ca 0.60 -0.46 0.00 0.00 -1.95 0.00 0.00 55.36 53.55 1vkp s GLN 294 Cb -0.40 -3.12 0.00 0.00 -0.22 0.00 0.00 33.01 29.27 1vkp s GLN 294 CO 0.39 0.11 0.00 -0.40 -0.25 0.00 0.00 175.29 175.15 1vkp n ASP 295 N 3.97 0.00 -2.49 5.90 5.75 -1.26 -5.09 116.55 123.33 1vkp n ASP 295 Ca -0.17 0.00 -0.02 0.00 -0.01 0.00 0.00 54.79 54.59 1vkp n ASP 295 Cb 0.52 0.00 0.10 0.00 -1.03 0.00 0.00 41.12 40.71 1vkp n ASP 295 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1vkp n GLY 296 N 0.00 1.40 0.08 6.12 0.00 -1.26 -4.95 105.19 106.58 1vkp n GLY 296 Ca 0.00 -0.13 -0.05 0.00 0.00 0.00 0.00 46.02 45.84 1vkp n GLY 296 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1vkp n GLU 297 N -1.17 0.68 -4.42 1.61 -0.58 -1.26 -4.91 120.64 110.59 1vkp n GLU 297 Ca -0.14 -0.03 -0.21 0.00 -0.42 0.00 0.00 57.16 56.36 1vkp n GLU 297 Cb 0.81 -1.55 -0.09 0.00 -0.57 0.00 0.00 31.44 30.04 1vkp n GLU 297 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1vkp s ALA 298 N -2.75 2.34 0.30 0.62 0.00 -1.26 -1.24 121.76 119.77 1vkp s ALA 298 Ca -0.09 -1.64 -0.29 0.00 0.00 0.00 0.00 51.96 49.94 1vkp s ALA 298 Cb 0.08 0.93 -0.10 0.00 0.00 0.00 0.00 23.12 24.02 1vkp s ALA 298 CO 0.85 -0.41 1.42 0.96 0.00 0.00 0.00 175.76 178.57 1vkp s ILE 299 N -3.42 2.51 0.31 0.00 -4.36 -0.74 -4.96 121.20 110.54 1vkp s ILE 299 Ca 0.32 0.47 -0.29 0.00 -0.26 0.00 0.00 60.65 60.88 1vkp s ILE 299 Cb 0.05 -3.30 -0.12 0.00 1.25 0.00 0.00 42.46 40.34 1vkp s ILE 299 CO 0.16 0.09 1.48 -2.65 0.24 0.00 0.00 174.94 174.26 1vkp n PRO 300 N 1.45 2.45 -3.55 0.37 -0.02 -1.26 -4.99 135.00 129.45 1vkp n PRO 300 Ca 0.04 0.87 -0.41 0.00 -2.02 0.00 0.00 63.50 61.97 1vkp n PRO 300 Cb 0.40 -2.57 -0.11 0.00 -0.02 0.00 0.00 33.50 31.20 1vkp n PRO 300 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1vkp s ARG 301 N -1.09 2.86 -0.03 -0.52 1.81 -1.26 -5.09 118.95 115.64 1vkp s ARG 301 Ca 0.61 -1.07 0.00 0.00 -1.72 0.00 0.00 55.73 53.55 1vkp s ARG 301 Cb -0.54 -3.82 -0.03 0.00 -0.45 0.00 0.00 34.95 30.11 1vkp s ARG 301 CO 0.55 -0.72 0.00 -0.51 -0.68 0.00 0.00 175.30 173.93 1vkp s LEU 302 N 1.59 3.54 0.40 2.53 1.43 -1.26 -4.87 118.68 122.04 1vkp s LEU 302 Ca 0.03 0.04 -0.27 0.00 -1.03 0.00 0.00 54.13 52.90 1vkp s LEU 302 Cb -0.19 -1.96 -0.09 0.00 0.03 0.00 0.00 46.19 43.97 1vkp s LEU 302 CO 0.08 0.31 1.41 0.00 0.23 0.00 0.00 176.35 178.38 1vkp s ALA 303 N -1.02 3.39 0.00 4.21 0.00 -1.26 -2.88 121.76 124.19 1vkp s ALA 303 Ca 0.18 1.44 0.00 0.00 0.00 0.00 0.00 51.96 53.57 1vkp s ALA 303 Cb -0.11 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.44 1vkp s ALA 303 CO 0.08 -1.02 0.00 0.41 0.00 0.00 0.00 175.76 175.23 1vkp n GLY 304 N 0.58 1.28 3.76 0.00 0.00 -1.26 -5.04 105.19 104.51 1vkp n GLY 304 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 1vkp n GLY 304 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1vkp s THR 305 N -2.93 3.10 0.08 2.61 -4.23 -1.14 -4.92 115.64 108.21 1vkp s THR 305 Ca 0.00 1.11 -0.31 0.00 -1.18 0.00 0.00 61.69 61.31 1vkp s THR 305 Cb 0.00 -3.70 -0.08 0.00 1.34 0.00 0.00 72.50 70.06 1vkp s THR 305 CO 0.00 0.26 1.54 -0.60 -0.54 0.00 0.00 174.62 175.28 1vkp s ARG 306 N -1.58 4.24 0.13 3.99 6.06 -1.26 -4.37 118.95 126.15 1vkp s ARG 306 Ca 0.47 2.22 -0.30 0.00 -2.50 0.00 0.00 55.73 55.62 1vkp s ARG 306 Cb -0.36 -3.46 -0.06 0.00 0.06 0.00 0.00 34.95 31.13 1vkp s ARG 306 CO 0.47 -0.63 1.00 -0.51 -2.50 0.00 0.00 175.30 173.12 1vkp s LEU 307 N 2.09 4.50 -1.30 -0.88 1.02 0.19 -4.86 118.68 119.43 1vkp s LEU 307 Ca 0.70 1.87 -0.15 0.00 0.02 0.00 0.00 54.13 56.57 1vkp s LEU 307 Cb -0.38 -3.59 0.11 0.00 0.02 0.00 0.00 46.19 42.35 1vkp s LEU 307 CO 0.30 -0.11 1.77 0.00 0.02 0.00 0.00 176.35 178.34 1vkp n ALA 308 N 2.70 4.34 -2.97 4.21 0.00 -1.26 -4.71 120.51 122.81 1vkp n ALA 308 Ca 0.02 -4.05 -0.34 0.00 0.00 0.00 0.00 53.44 49.08 1vkp n ALA 308 Cb 0.48 -3.33 -0.12 0.00 0.00 0.00 0.00 19.45 16.48 1vkp n ALA 308 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vkp s ALA 309 N 2.62 3.06 -0.09 0.00 0.00 -1.26 -4.93 121.76 121.16 1vkp s ALA 309 Ca 0.47 -0.85 -0.10 0.00 0.00 0.00 0.00 51.96 51.48 1vkp s ALA 309 Cb 0.05 -1.66 0.02 0.00 0.00 0.00 0.00 23.12 21.53 1vkp s ALA 309 CO 0.01 0.12 0.26 0.45 0.00 0.00 0.00 175.76 176.60 1vkp s SER 310 N 0.53 -0.25 0.16 0.00 0.15 -1.26 -4.50 113.70 108.53 1vkp s SER 310 Ca -0.02 0.46 0.19 0.00 0.70 0.00 0.00 55.95 57.28 1vkp s SER 310 Cb -0.14 0.51 0.81 0.00 -1.71 0.00 0.00 66.02 65.49 1vkp s SER 310 CO 0.02 -0.14 1.57 -1.22 1.20 0.00 0.00 173.24 174.68 1vkp n TYR 311 N 2.71 0.49 0.28 3.44 4.01 -1.26 -2.63 117.16 124.19 1vkp n TYR 311 Ca -0.14 0.20 0.15 0.00 -0.16 0.00 0.00 57.90 57.95 1vkp n TYR 311 Cb 0.58 -0.82 0.78 0.00 -0.31 0.00 0.00 39.34 39.56 1vkp n TYR 311 CO 0.00 0.00 0.00 -0.24 -0.46 0.00 0.00 176.86 176.16 1vkp h VAL 312 N 0.00 0.35 -0.05 -0.72 3.04 -1.88 -3.28 116.25 113.70 1vkp h VAL 312 Ca 0.00 -0.49 -0.45 0.00 -1.01 0.00 0.00 66.70 64.74 1vkp h VAL 312 Cb 0.26 1.36 -0.02 0.00 -2.01 0.00 0.00 31.29 30.88 1vkp h VAL 312 CO 0.00 0.08 1.84 -3.20 -1.01 0.00 0.00 177.57 175.28 1vkp n ASN 313 N -3.40 7.12 -4.97 3.17 2.85 -1.08 -4.86 115.26 114.09 1vkp n ASN 313 Ca -0.01 -2.56 -0.21 0.00 -0.11 0.00 0.00 54.58 51.69 1vkp n ASN 313 Cb 0.24 -1.48 -0.02 0.00 1.24 0.00 0.00 39.78 39.76 1vkp n ASN 313 CO 0.00 0.00 0.00 0.72 -2.11 0.00 0.00 177.26 175.87 1vkp s PHE 314 N 1.47 3.34 -0.07 1.20 -0.12 -1.24 -2.40 117.98 120.17 1vkp s PHE 314 Ca 0.68 -0.08 0.02 0.00 -0.05 0.00 0.00 56.93 57.51 1vkp s PHE 314 Cb 0.25 -1.67 -0.02 0.00 -0.63 0.00 0.00 43.02 40.94 1vkp s PHE 314 CO -0.04 0.33 -0.13 -0.47 -0.05 0.00 0.00 175.22 174.86 1vkp s TYR 315 N -2.04 2.76 -0.25 3.49 6.04 -0.67 -4.37 117.35 122.31 1vkp s TYR 315 Ca 0.37 -0.21 -0.14 0.00 0.04 0.00 0.00 57.07 57.13 1vkp s TYR 315 Cb -0.09 -1.68 -0.04 0.00 -1.04 0.00 0.00 41.96 39.11 1vkp s TYR 315 CO 0.29 0.14 0.33 0.42 -1.54 0.00 0.00 175.55 175.20 1vkp s ILE 316 N -0.55 5.22 0.52 3.14 1.01 -1.26 -0.78 121.20 128.49 1vkp s ILE 316 Ca 0.08 0.51 0.05 0.00 0.00 0.00 0.00 60.65 61.29 1vkp s ILE 316 Cb -0.12 -3.66 0.02 0.00 0.01 0.00 0.00 42.46 38.71 1vkp s ILE 316 CO 0.01 0.22 0.28 0.00 0.00 0.00 0.00 174.94 175.46 1vkp s ALA 317 N 1.66 4.27 -0.53 9.38 0.00 -0.22 -4.79 121.76 131.53 1vkp s ALA 317 Ca 0.14 -1.11 -0.27 0.00 0.00 0.00 0.00 51.96 50.72 1vkp s ALA 317 Cb -0.15 -0.51 -0.03 0.00 0.00 0.00 0.00 23.12 22.43 1vkp s ALA 317 CO 0.09 -0.31 1.99 -0.80 0.00 0.00 0.00 175.76 176.73 1vkp s ASN 318 N -4.14 5.17 0.00 0.00 0.02 -1.26 -1.91 114.94 112.82 1vkp s ASN 318 Ca 0.27 0.70 0.00 0.00 -1.02 0.00 0.00 52.86 52.82 1vkp s ASN 318 Cb -0.01 -2.52 0.00 0.00 0.02 0.00 0.00 41.25 38.74 1vkp s ASN 318 CO 0.17 -2.39 0.00 0.61 0.02 0.00 0.00 177.10 175.51 1vkp n GLY 319 N 5.73 0.48 3.12 0.66 0.00 -1.26 -4.77 105.19 109.14 1vkp n GLY 319 Ca 0.25 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.12 1vkp n GLY 319 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1vkp s GLY 320 N -2.00 0.68 -0.15 -0.02 0.00 -0.80 -1.18 107.32 103.86 1vkp s GLY 320 Ca 0.00 -0.90 0.01 0.00 0.00 0.00 0.00 44.72 43.83 1vkp s GLY 320 CO 0.00 -0.95 -0.17 -0.42 0.00 0.00 0.00 173.10 171.57 1vkp s ILE 321 N -1.46 1.74 -0.41 0.90 -1.09 -0.13 -1.05 121.20 119.69 1vkp s ILE 321 Ca -0.05 -0.75 -0.11 0.00 -2.23 0.00 0.00 60.65 57.50 1vkp s ILE 321 Cb -0.09 -1.59 0.06 0.00 -1.58 0.00 0.00 42.46 39.26 1vkp s ILE 321 CO 0.01 0.49 0.27 -0.63 -1.23 0.00 0.00 174.94 173.85 1vkp s ILE 322 N 1.24 4.60 0.08 2.92 -1.09 0.04 -0.37 121.20 128.62 1vkp s ILE 322 Ca 0.01 -1.10 0.10 0.00 -2.23 0.00 0.00 60.65 57.42 1vkp s ILE 322 Cb -0.14 -3.70 -0.03 0.00 -1.58 0.00 0.00 42.46 37.01 1vkp s ILE 322 CO -0.08 -0.41 -0.27 0.00 -1.23 0.00 0.00 174.94 172.95 1vkp s ALA 323 N 1.53 2.31 0.54 9.38 0.00 -0.24 -1.68 121.76 133.61 1vkp s ALA 323 Ca 0.03 -1.36 -0.17 0.00 0.00 0.00 0.00 51.96 50.46 1vkp s ALA 323 Cb -0.22 -0.44 -0.06 0.00 0.00 0.00 0.00 23.12 22.40 1vkp s ALA 323 CO 0.05 0.54 1.02 -1.25 0.00 0.00 0.00 175.76 176.12 1vkp s PRO 324 N -1.60 3.68 -0.07 0.00 0.04 -1.26 -0.51 135.00 135.28 1vkp s PRO 324 Ca 0.13 1.11 0.02 0.00 0.04 0.00 0.00 61.00 62.30 1vkp s PRO 324 Cb -0.10 -2.09 0.01 0.00 0.04 0.00 0.00 34.50 32.36 1vkp s PRO 324 CO 0.04 -0.51 -0.13 -0.65 0.04 0.00 0.00 177.00 175.79 1vkp s GLN 325 N -3.96 1.76 0.00 4.56 -1.52 -0.78 -4.72 119.66 115.01 1vkp s GLN 325 Ca 0.62 -0.43 0.17 0.00 -1.95 0.00 0.00 55.36 53.77 1vkp s GLN 325 Cb -0.13 -1.45 0.04 0.00 -0.22 0.00 0.00 33.01 31.24 1vkp s GLN 325 CO 0.32 0.02 0.94 1.19 -0.25 0.00 0.00 175.29 177.51 1vkp n PHE 326 N 3.84 0.00 -0.81 0.91 3.01 -1.26 -2.59 117.46 120.55 1vkp n PHE 326 Ca -0.22 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.24 1vkp n PHE 326 Cb 0.52 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.99 1vkp n PHE 326 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1vkp n GLY 327 N 1.14 0.50 3.28 1.37 0.00 -1.26 -4.72 105.19 105.50 1vkp n GLY 327 Ca 0.08 -0.87 -0.43 0.00 0.00 0.00 0.00 46.02 44.80 1vkp n GLY 327 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1vkp s ASP 328 N -2.79 5.92 0.16 1.61 -1.08 -1.26 -5.01 116.67 114.22 1vkp s ASP 328 Ca 0.00 -1.74 -0.17 0.00 -0.52 0.00 0.00 52.55 50.12 1vkp s ASP 328 Cb 0.00 -2.10 0.07 0.00 -1.46 0.00 0.00 42.92 39.43 1vkp s ASP 328 CO 0.00 -0.72 1.69 1.55 0.52 0.00 0.00 175.17 178.21 1vkp h PRO 329 N 8.64 0.05 -0.14 4.34 0.13 -1.99 0.19 132.00 143.22 1vkp h PRO 329 Ca -0.25 -0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.79 1vkp h PRO 329 Cb 1.09 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 1vkp h PRO 329 CO 0.91 0.03 -0.23 0.82 -0.23 0.00 0.00 178.00 179.31 1vkp h ILE 330 N 0.05 1.36 -0.03 -3.56 2.04 -2.00 -2.72 117.51 112.66 1vkp h ILE 330 Ca 0.17 -1.46 -0.14 0.00 1.00 0.00 0.00 64.86 64.42 1vkp h ILE 330 Cb 0.24 1.97 -0.02 0.00 -0.74 0.00 0.00 36.82 38.27 1vkp h ILE 330 CO -0.31 0.43 -0.64 0.03 0.00 0.00 0.00 178.15 177.66 1vkp h ARG 331 N 0.02 0.11 -0.27 2.37 2.47 -1.89 -1.70 114.38 115.48 1vkp h ARG 331 Ca 0.01 -0.08 -0.01 0.00 -1.26 0.00 0.00 59.98 58.64 1vkp h ARG 331 Cb 0.80 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.12 1vkp h ARG 331 CO 0.05 0.71 0.13 -0.44 0.56 0.00 0.00 179.97 180.98 1vkp h ASP 332 N 0.08 0.35 0.23 7.04 3.45 -0.64 -0.12 116.42 126.82 1vkp h ASP 332 Ca -0.01 -0.12 -0.16 0.00 0.43 0.00 0.00 57.03 57.17 1vkp h ASP 332 Cb 1.14 -0.09 -0.01 0.00 -0.56 0.00 0.00 39.33 39.81 1vkp h ASP 332 CO 0.09 0.37 -0.63 0.07 -1.57 0.00 0.00 179.24 177.57 1vkp h LYS 333 N 0.30 0.38 -0.28 3.56 2.10 -1.39 -2.61 116.57 118.63 1vkp h LYS 333 Ca 0.09 -0.27 -0.12 0.00 -2.00 0.00 0.00 60.65 58.35 1vkp h LYS 333 Cb 0.12 0.04 -0.01 0.00 -0.90 0.00 0.00 32.23 31.48 1vkp h LYS 333 CO -0.01 0.89 -0.31 1.49 -2.00 0.00 0.00 179.45 179.51 1vkp h GLU 334 N 0.28 0.58 -0.54 0.07 4.57 -1.16 -1.54 114.58 116.84 1vkp h GLU 334 Ca -0.01 -0.25 -0.02 0.00 -1.18 0.00 0.00 59.36 57.89 1vkp h GLU 334 Cb 1.17 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.72 1vkp h GLU 334 CO 0.11 0.82 0.24 0.00 -1.18 0.00 0.00 179.01 179.00 1vkp h ALA 335 N 1.17 0.70 -0.72 2.92 0.00 -0.90 0.76 119.26 123.18 1vkp h ALA 335 Ca 0.06 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1vkp h ALA 335 Cb 0.78 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 1vkp h ALA 335 CO 0.06 0.28 0.45 0.82 0.00 0.00 0.00 179.25 180.86 1vkp h ILE 336 N 0.73 1.20 -0.32 0.00 1.08 -1.26 -0.17 117.51 118.77 1vkp h ILE 336 Ca 0.18 -0.41 -0.02 0.00 -0.39 0.00 0.00 64.86 64.22 1vkp h ILE 336 Cb 0.15 0.17 -0.01 0.00 -3.07 0.00 0.00 36.82 34.06 1vkp h ILE 336 CO -0.02 0.20 0.12 -0.09 -0.69 0.00 0.00 178.15 177.67 1vkp h ARG 337 N 0.98 0.48 -0.42 2.37 2.43 -0.74 -0.03 114.38 119.45 1vkp h ARG 337 Ca 0.26 -0.09 -0.02 0.00 -0.81 0.00 0.00 59.98 59.32 1vkp h ARG 337 Cb -0.06 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.39 1vkp h ARG 337 CO -0.05 0.49 0.20 0.28 -1.51 0.00 0.00 179.97 179.38 1vkp h VAL 338 N 0.37 1.18 -0.46 0.20 2.07 -0.65 -1.50 116.25 117.46 1vkp h VAL 338 Ca 0.11 -0.52 -0.07 0.00 0.82 0.00 0.00 66.70 67.03 1vkp h VAL 338 Cb 0.19 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 1vkp h VAL 338 CO -0.01 0.20 -0.01 -0.07 0.02 0.00 0.00 177.57 177.70 1vkp h LEU 339 N 0.54 0.73 -0.68 2.57 3.38 -0.92 -0.67 115.31 120.25 1vkp h LEU 339 Ca 0.15 -0.17 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 1vkp h LEU 339 Cb 0.13 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1vkp h LEU 339 CO -0.02 0.80 -0.15 0.28 0.09 0.00 0.00 178.44 179.44 1vkp h SER 340 N 0.71 0.86 0.07 -0.43 0.02 -0.72 -1.01 113.55 113.05 1vkp h SER 340 Ca 0.14 -0.29 -0.14 0.00 -0.84 0.00 0.00 61.79 60.66 1vkp h SER 340 Cb 0.44 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.74 1vkp h SER 340 CO 0.02 1.01 -0.47 -0.78 -1.14 0.00 0.00 176.83 175.47 1vkp h ASP 341 N 0.76 0.51 0.95 3.07 1.82 -1.03 -3.16 116.42 119.34 1vkp h ASP 341 Ca 0.12 -0.25 -0.18 0.00 -0.39 0.00 0.00 57.03 56.33 1vkp h ASP 341 Cb 0.67 -0.14 -0.03 0.00 0.68 0.00 0.00 39.33 40.52 1vkp h ASP 341 CO 0.05 0.91 -0.85 0.74 -1.61 0.00 0.00 179.24 178.48 1vkp h THR 342 N 0.38 1.56 -2.20 2.25 2.02 -0.82 -3.35 112.91 112.75 1vkp h THR 342 Ca 0.02 -2.96 -0.60 0.00 0.77 0.00 0.00 66.41 63.65 1vkp h THR 342 Cb 0.97 2.62 -0.42 0.00 -1.74 0.00 0.00 68.15 69.58 1vkp h THR 342 CO 0.09 0.83 -0.63 0.49 0.37 0.00 0.00 175.52 176.66 1vkp n PHE 343 N -3.45 3.32 0.31 3.16 3.01 -0.41 -4.95 117.46 118.45 1vkp n PHE 343 Ca -0.00 -4.11 0.15 0.00 1.01 0.00 0.00 57.45 54.49 1vkp n PHE 343 Cb 0.83 -0.54 0.66 0.00 -0.01 0.00 0.00 39.48 40.42 1vkp n PHE 343 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 1vkp h PRO 344 N 4.19 0.00 -0.67 -1.08 0.13 -1.69 -1.87 132.00 131.01 1vkp h PRO 344 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 1vkp h PRO 344 Cb 0.68 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.81 1vkp h PRO 344 CO 0.80 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 179.29 1vkp n HIS 345 N -2.57 0.90 -4.37 1.56 8.25 -1.26 -4.93 115.22 112.79 1vkp n HIS 345 Ca 0.00 -0.45 -0.26 0.00 -0.26 0.00 0.00 57.72 56.75 1vkp n HIS 345 Cb 0.19 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.19 1vkp n HIS 345 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 1vkp s HIS 346 N -1.10 2.45 -0.25 4.41 3.76 -0.71 -4.82 115.29 119.04 1vkp s HIS 346 Ca 0.47 -0.29 -0.15 0.00 -0.15 0.00 0.00 55.06 54.93 1vkp s HIS 346 Cb 0.25 -1.18 -0.04 0.00 1.11 0.00 0.00 32.58 32.72 1vkp s HIS 346 CO 0.32 0.54 0.39 0.45 -0.85 0.00 0.00 174.74 175.60 1vkp s SER 347 N -2.91 6.32 -0.13 1.40 0.15 -0.32 -4.90 113.70 113.31 1vkp s SER 347 Ca 0.24 0.37 -0.21 0.00 0.70 0.00 0.00 55.95 57.05 1vkp s SER 347 Cb -0.08 -2.22 -0.03 0.00 -1.71 0.00 0.00 66.02 61.98 1vkp s SER 347 CO 0.13 -0.16 0.62 -0.69 1.20 0.00 0.00 173.24 174.35 1vkp s VAL 348 N 1.86 5.07 -0.18 4.45 1.01 -1.26 -0.95 120.40 130.40 1vkp s VAL 348 Ca 0.17 1.23 0.01 0.00 0.00 0.00 0.00 61.98 63.39 1vkp s VAL 348 Cb -0.15 -3.95 0.02 0.00 0.00 0.00 0.00 36.38 32.29 1vkp s VAL 348 CO 0.09 0.22 -0.19 -0.69 0.00 0.00 0.00 175.10 174.52 1vkp s VAL 349 N 1.18 2.15 -0.03 2.92 1.01 0.51 -4.94 120.40 123.19 1vkp s VAL 349 Ca 0.31 -0.92 -0.23 0.00 0.00 0.00 0.00 61.98 61.15 1vkp s VAL 349 Cb -0.16 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.27 1vkp s VAL 349 CO 0.13 0.53 0.70 -0.83 0.00 0.00 0.00 175.10 175.63 1vkp s GLY 350 N 1.24 2.65 -0.44 4.51 0.00 -1.26 -1.07 107.32 112.95 1vkp s GLY 350 Ca 0.04 0.15 -0.14 0.00 0.00 0.00 0.00 44.72 44.76 1vkp s GLY 350 CO -0.11 1.09 0.34 -0.42 0.00 0.00 0.00 173.10 174.01 1vkp s ILE 351 N 0.47 5.11 0.67 0.90 -1.09 0.34 -4.93 121.20 122.67 1vkp s ILE 351 Ca 0.37 -0.96 -0.14 0.00 -2.23 0.00 0.00 60.65 57.68 1vkp s ILE 351 Cb -0.18 -3.99 0.01 0.00 -1.58 0.00 0.00 42.46 36.72 1vkp s ILE 351 CO 0.19 -0.47 1.10 -1.61 -1.23 0.00 0.00 174.94 172.92 1vkp s GLU 352 N 1.63 2.76 -1.46 2.79 0.41 -1.26 -1.86 118.70 121.70 1vkp s GLU 352 Ca 0.04 1.34 0.00 0.00 -0.41 0.00 0.00 54.97 55.94 1vkp s GLU 352 Cb -0.22 -1.95 0.00 0.00 -1.78 0.00 0.00 34.13 30.18 1vkp s GLU 352 CO 0.07 -1.28 0.00 0.09 -0.49 0.00 0.00 175.26 173.66 1vkp n ASN 353 N -2.55 -4.71 0.29 -0.19 5.03 -1.25 -4.89 115.26 106.99 1vkp n ASN 353 Ca 0.10 0.19 0.18 0.00 0.87 0.00 0.00 54.58 55.92 1vkp n ASN 353 Cb 0.52 -3.69 0.98 0.00 -1.02 0.00 0.00 39.78 36.57 1vkp n ASN 353 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1vkp h ALA 354 N 0.34 1.42 -1.07 5.41 0.00 -1.51 -0.55 119.26 123.31 1vkp h ALA 354 Ca -0.33 -0.00 0.28 0.00 0.00 0.00 0.00 54.91 54.86 1vkp h ALA 354 Cb 1.12 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.83 1vkp h ALA 354 CO 0.44 -0.07 0.70 -0.09 0.00 0.00 0.00 179.25 180.24 1vkp h ARG 355 N 0.00 0.29 0.00 0.00 2.43 -1.85 -0.64 114.38 114.61 1vkp h ARG 355 Ca 0.02 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1vkp h ARG 355 Cb 0.12 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.60 1vkp h ARG 355 CO -0.00 0.19 -0.08 0.93 -1.51 0.00 0.00 179.97 179.50 1vkp h GLU 356 N 0.30 0.00 0.20 0.20 4.39 -1.48 -1.39 114.58 116.80 1vkp h GLU 356 Ca 0.59 0.00 -0.30 0.00 0.34 0.00 0.00 59.36 60.00 1vkp h GLU 356 Cb 1.67 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 30.36 1vkp h GLU 356 CO -0.24 0.08 -1.28 0.82 -1.16 0.00 0.00 179.01 177.23 1vkp h ILE 357 N 0.00 1.33 0.00 3.13 1.08 -1.29 -3.33 117.51 118.42 1vkp h ILE 357 Ca -0.00 -2.59 -0.04 0.00 -0.39 0.00 0.00 64.86 61.83 1vkp h ILE 357 Cb 0.14 2.99 -0.01 0.00 -3.07 0.00 0.00 36.82 36.88 1vkp h ILE 357 CO 0.01 0.77 -0.21 0.58 -0.69 0.00 0.00 178.15 178.62 1vkp h VAL 358 N 0.07 1.09 -0.26 1.67 2.07 -0.82 -1.05 116.25 119.01 1vkp h VAL 358 Ca -0.22 -0.72 0.07 0.00 0.82 0.00 0.00 66.70 66.65 1vkp h VAL 358 Cb 1.99 1.40 -0.01 0.00 -1.52 0.00 0.00 31.29 33.15 1vkp h VAL 358 CO 0.24 0.20 0.19 -0.07 0.02 0.00 0.00 177.57 178.15 1vkp h LEU 359 N 0.00 0.04 -1.50 2.57 3.38 -1.38 -0.95 115.31 117.47 1vkp h LEU 359 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1vkp h LEU 359 Cb 0.38 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1vkp h LEU 359 CO 0.03 0.03 0.00 0.00 0.09 0.00 0.00 178.44 178.58 1vkp n ALA 360 N -2.58 2.49 -0.01 1.53 0.00 -0.42 -4.94 120.51 116.59 1vkp n ALA 360 Ca 0.03 -0.66 0.00 0.00 0.00 0.00 0.00 53.44 52.81 1vkp n ALA 360 Cb 0.31 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.75 1vkp n ALA 360 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vkp n GLY 361 N 1.26 1.00 0.00 0.00 0.00 -0.36 -5.07 105.19 102.02 1vkp n GLY 361 Ca 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1vkp n GLY 361 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vkp n GLY 362 N -2.01 3.53 0.00 -0.02 0.00 -1.10 -4.94 105.19 100.65 1vkp n GLY 362 Ca 0.00 -1.33 0.00 0.00 0.00 0.00 0.00 46.02 44.69 1vkp n GLY 362 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1vkp n ASN 363 N -1.55 0.00 -0.12 1.61 4.05 -1.26 -1.66 115.26 116.33 1vkp n ASN 363 Ca 0.00 -0.67 -0.05 0.00 0.45 0.00 0.00 54.58 54.31 1vkp n ASN 363 Cb 0.00 0.00 0.03 0.00 1.23 0.00 0.00 39.78 41.04 1vkp n ASN 363 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 177.26 174.61 1vkp h ILE 364 N 0.67 0.84 -0.46 -1.44 2.04 -1.93 -1.61 117.51 115.62 1vkp h ILE 364 Ca 0.00 -0.09 -0.00 0.00 1.00 0.00 0.00 64.86 65.77 1vkp h ILE 364 Cb 0.00 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 36.62 1vkp h ILE 364 CO 0.00 0.05 0.28 -0.74 0.00 0.00 0.00 178.15 177.73 1vkp h HIS 365 N 0.26 0.60 0.00 1.37 2.76 -1.67 -2.38 115.15 116.08 1vkp h HIS 365 Ca 0.19 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.35 1vkp h HIS 365 Cb 0.20 -0.20 -0.00 0.00 1.55 0.00 0.00 27.41 28.96 1vkp h HIS 365 CO -0.17 0.40 -0.09 0.00 -1.30 0.00 0.00 177.93 176.77 1vkp n ILE 367 N -3.31 0.02 -4.34 0.00 -5.35 -0.90 -2.28 119.36 103.20 1vkp n ILE 367 Ca -0.01 -0.50 -0.26 0.00 -0.27 0.00 0.00 62.75 61.72 1vkp n ILE 367 Cb 0.29 1.43 -0.09 0.00 -1.74 0.00 0.00 39.64 39.53 1vkp n ILE 367 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 1vkp s THR 368 N -1.98 3.02 -0.10 7.28 -4.23 -1.17 -4.00 115.64 114.46 1vkp s THR 368 Ca 0.29 -1.88 -0.04 0.00 -1.18 0.00 0.00 61.69 58.88 1vkp s THR 368 Cb 0.20 -2.53 0.05 0.00 1.34 0.00 0.00 72.50 71.57 1vkp s THR 368 CO 0.30 -0.21 0.20 -1.58 -0.54 0.00 0.00 174.62 172.79 1vkp s GLN 369 N -3.09 0.08 0.30 3.99 2.00 -0.34 -2.45 119.66 120.15 1vkp s GLN 369 Ca 0.26 0.63 -0.28 0.00 -2.00 0.00 0.00 55.36 53.98 1vkp s GLN 369 Cb -0.08 -0.17 -0.09 0.00 0.80 0.00 0.00 33.01 33.47 1vkp s GLN 369 CO 0.15 -0.29 1.00 1.14 -0.50 0.00 0.00 175.29 176.79 1vkp s GLN 370 N 2.29 4.60 -0.36 1.67 0.00 -1.26 -1.21 119.66 125.40 1vkp s GLN 370 Ca 0.02 1.52 -0.07 0.00 -0.00 0.00 0.00 55.36 56.83 1vkp s GLN 370 Cb -0.12 -2.98 0.05 0.00 0.00 0.00 0.00 33.01 29.96 1vkp s GLN 370 CO -0.07 0.26 0.14 -1.14 0.00 0.00 0.00 175.29 174.48 1vkp s GLN 371 N -1.74 2.58 0.80 9.60 0.74 0.34 -4.64 119.66 127.34 1vkp s GLN 371 Ca 0.48 -1.27 -0.14 0.00 0.05 0.00 0.00 55.36 54.48 1vkp s GLN 371 Cb -0.24 -3.53 0.07 0.00 1.10 0.00 0.00 33.01 30.40 1vkp s GLN 371 CO 0.31 -0.74 1.11 -2.30 -0.55 0.00 0.00 175.29 173.11 1vkp n PRO 372 N 4.82 0.20 -2.09 1.67 -0.02 -1.26 -0.09 135.00 138.24 1vkp n PRO 372 Ca -0.11 0.14 -0.41 0.00 -2.02 0.00 0.00 63.50 61.10 1vkp n PRO 372 Cb 0.44 -2.36 -0.02 0.00 -0.02 0.00 0.00 33.50 31.54 1vkp n PRO 372 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1vkp s ALA 373 N -2.09 3.51 -0.20 3.55 0.00 -0.44 -4.02 121.76 122.08 1vkp s ALA 373 Ca 0.72 1.29 -0.28 0.00 0.00 0.00 0.00 51.96 53.69 1vkp s ALA 373 Cb -0.30 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.33 1vkp s ALA 373 CO 0.52 -0.68 0.99 -2.00 0.00 0.00 0.00 175.76 174.59 1vkp s GLU 374 N -1.74 4.29 0.63 0.00 2.12 -1.26 -4.91 118.70 117.84 1vkp s GLU 374 Ca 0.50 1.29 -0.18 0.00 0.36 0.00 0.00 54.97 56.93 1vkp s GLU 374 Cb -0.40 -3.61 -0.02 0.00 0.26 0.00 0.00 34.13 30.35 1vkp s GLU 374 CO 0.53 -0.52 1.23 -2.30 -0.54 0.00 0.00 175.26 173.66 1vkp n PRO 375 N 5.89 1.12 0.00 4.30 -0.02 -1.26 -5.05 135.00 139.98 1vkp n PRO 375 Ca 0.10 0.43 0.07 0.00 -2.02 0.00 0.00 63.50 62.08 1vkp n PRO 375 Cb 0.47 -2.46 0.06 0.00 -0.02 0.00 0.00 33.50 31.55 1vkp n PRO 375 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73