#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vkp s GLU 6 N 0.00 4.61 0.38 -0.14 2.02 -1.26 -5.04 118.70 119.27 1vkp s GLU 6 Ca 0.00 1.83 -0.12 0.00 0.02 0.00 0.00 54.97 56.70 1vkp s GLU 6 Cb 0.00 -3.19 -0.07 0.00 0.10 0.00 0.00 34.13 30.97 1vkp s GLU 6 CO 0.00 0.16 0.76 -1.54 0.02 0.00 0.00 175.26 174.65 1vkp s SER 7 N -0.73 6.59 0.44 -0.19 1.04 -1.26 -4.98 113.70 114.61 1vkp s SER 7 Ca 0.46 1.17 0.15 0.00 0.48 0.00 0.00 55.95 58.21 1vkp s SER 7 Cb -0.32 -2.34 1.05 0.00 0.10 0.00 0.00 66.02 64.51 1vkp s SER 7 CO 0.41 -0.34 1.96 -0.65 0.98 0.00 0.00 173.24 175.60 1vkp h PRO 8 N 1.55 0.38 -0.94 4.02 0.11 -1.87 -2.31 132.00 132.95 1vkp h PRO 8 Ca -0.47 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.66 1vkp h PRO 8 Cb 1.18 -0.09 -0.06 0.00 0.11 0.00 0.00 31.00 32.15 1vkp h PRO 8 CO 0.64 0.25 0.62 0.00 -0.21 0.00 0.00 178.00 179.30 1vkp h ALA 9 N 1.68 1.42 -0.56 -0.75 0.00 -1.43 -1.38 119.26 118.24 1vkp h ALA 9 Ca 0.31 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.23 1vkp h ALA 9 Cb 0.68 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1vkp h ALA 9 CO -0.09 0.47 0.37 0.93 0.00 0.00 0.00 179.25 180.94 1vkp h GLU 10 N 1.16 0.58 -0.27 0.00 5.08 -1.71 -2.68 114.58 116.74 1vkp h GLU 10 Ca 0.38 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.71 1vkp h GLU 10 Cb 0.07 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.18 1vkp h GLU 10 CO -0.13 0.39 0.00 0.72 -1.00 0.00 0.00 179.01 178.99 1vkp n HIS 11 N -4.47 0.34 -0.37 4.33 8.25 -0.59 -4.97 115.22 117.74 1vkp n HIS 11 Ca 0.07 -0.17 0.00 0.00 -0.26 0.00 0.00 57.72 57.36 1vkp n HIS 11 Cb 0.18 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.29 1vkp n HIS 11 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1vkp n GLY 12 N 1.39 0.76 3.84 -1.41 0.00 -0.83 -4.97 105.19 103.96 1vkp n GLY 12 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.33 3.37 0.00 1.61 2.02 -0.80 -4.52 117.35 116.70 1vkp s TYR 13 Ca 0.00 1.36 0.00 0.00 -0.37 0.00 0.00 57.07 58.06 1vkp s TYR 13 Cb 0.00 -2.66 0.00 0.00 -0.40 0.00 0.00 41.96 38.90 1vkp s TYR 13 CO 0.00 -0.04 0.00 2.48 -1.57 0.00 0.00 175.55 176.42 1vkp n TYR 14 N -0.67 0.00 -3.98 2.71 0.18 -0.27 -4.36 117.16 110.77 1vkp n TYR 14 Ca 0.05 0.00 -0.09 0.00 1.88 0.00 0.00 57.90 59.74 1vkp n TYR 14 Cb 0.54 0.00 -0.08 0.00 -0.38 0.00 0.00 39.34 39.41 1vkp n TYR 14 CO 0.00 0.00 0.00 -1.25 -2.08 0.00 0.00 176.86 173.53 1vkp s PRO 16 N 2.84 0.85 0.67 -3.48 0.04 -1.26 -1.02 135.00 133.63 1vkp s PRO 16 Ca 0.00 -1.14 -0.15 0.00 0.04 0.00 0.00 61.00 59.75 1vkp s PRO 16 Cb 0.00 0.30 0.00 0.00 0.04 0.00 0.00 34.50 34.84 1vkp s PRO 16 CO 0.00 -0.25 1.11 0.00 0.04 0.00 0.00 177.00 177.90 1vkp s ALA 17 N -3.92 2.46 0.53 8.56 0.00 -1.26 -4.74 121.76 123.38 1vkp s ALA 17 Ca 0.11 0.52 0.37 0.00 0.00 0.00 0.00 51.96 52.96 1vkp s ALA 17 Cb 0.06 -3.31 1.97 0.00 0.00 0.00 0.00 23.12 21.84 1vkp s ALA 17 CO -0.07 -1.30 2.24 1.49 0.00 0.00 0.00 175.76 178.12 1vkp h GLU 18 N -0.05 0.00 -0.00 0.00 4.81 -1.94 -1.81 114.58 115.58 1vkp h GLU 18 Ca -0.47 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 1vkp h GLU 18 Cb 1.24 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.62 1vkp h GLU 18 CO 0.54 0.02 -0.13 -2.67 -0.73 0.00 0.00 179.01 176.05 1vkp n TRP 19 N -3.36 0.00 -1.33 0.92 2.14 -1.26 -4.75 117.44 109.81 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 0.14 -0.29 0.11 0.00 -0.81 0.00 0.00 31.31 30.46 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 -2.70 3.98 0.28 -0.67 1.11 -0.68 -4.95 116.67 113.04 1vkp s ASP 20 Ca 0.22 1.48 -0.30 0.00 0.18 0.00 0.00 52.55 54.13 1vkp s ASP 20 Cb 0.19 -2.19 -0.11 0.00 1.07 0.00 0.00 42.92 41.89 1vkp s ASP 20 CO 0.52 -2.32 1.52 -0.55 1.18 0.00 0.00 175.17 175.53 1vkp s SER 21 N -3.58 6.49 -0.01 0.27 0.15 -1.26 -4.88 113.70 110.89 1vkp s SER 21 Ca 0.62 2.84 -0.01 0.00 0.70 0.00 0.00 55.95 60.10 1vkp s SER 21 Cb -0.17 -2.63 -0.04 0.00 -1.71 0.00 0.00 66.02 61.47 1vkp s SER 21 CO 0.56 -0.82 0.09 -1.00 1.20 0.00 0.00 173.24 173.27 1vkp s HIS 22 N -0.08 3.33 0.08 3.44 3.76 -1.26 -0.93 115.29 123.62 1vkp s HIS 22 Ca 0.61 0.23 -0.14 0.00 -0.15 0.00 0.00 55.06 55.61 1vkp s HIS 22 Cb -0.45 -1.75 -0.17 0.00 1.11 0.00 0.00 32.58 31.32 1vkp s HIS 22 CO 0.47 0.57 1.28 0.00 -0.85 0.00 0.00 174.74 176.20 1vkp h ALA 23 N 4.09 0.27 -2.27 -1.40 0.00 -0.73 -3.40 119.26 115.82 1vkp h ALA 23 Ca -0.49 -0.58 0.19 0.00 0.00 0.00 0.00 54.91 54.03 1vkp h ALA 23 Cb 1.18 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.89 1vkp h ALA 23 CO 0.63 0.59 0.54 1.14 0.00 0.00 0.00 179.25 182.15 1vkp s GLN 24 N -3.71 1.13 -0.03 0.00 -2.07 -1.18 -4.25 119.66 109.54 1vkp s GLN 24 Ca -0.11 -0.64 0.06 0.00 -1.82 0.00 0.00 55.36 52.84 1vkp s GLN 24 Cb 0.08 0.37 -0.02 0.00 -1.09 0.00 0.00 33.01 32.35 1vkp s GLN 24 CO 0.88 -0.52 -0.19 0.99 -1.32 0.00 0.00 175.29 175.13 1vkp s THR 25 N -3.03 2.63 -0.15 3.63 2.01 -0.11 -0.81 115.64 119.82 1vkp s THR 25 Ca 0.14 -0.90 -0.06 0.00 0.31 0.00 0.00 61.69 61.19 1vkp s THR 25 Cb -0.01 -1.99 -0.04 0.00 0.01 0.00 0.00 72.50 70.47 1vkp s THR 25 CO 0.02 0.58 0.05 0.26 -0.69 0.00 0.00 174.62 174.84 1vkp s TRP 26 N -0.69 3.25 0.00 4.92 0.52 -0.39 -1.15 118.94 125.41 1vkp s TRP 26 Ca 0.11 0.13 0.01 0.00 0.02 0.00 0.00 56.10 56.37 1vkp s TRP 26 Cb -0.10 -1.98 -0.00 0.00 -1.15 0.00 0.00 33.47 30.23 1vkp s TRP 26 CO -0.00 0.29 -0.04 0.42 0.02 0.00 0.00 176.95 177.64 1vkp s ILE 27 N -0.11 0.29 0.00 2.03 1.01 -0.56 -1.25 121.20 122.60 1vkp s ILE 27 Ca 0.06 -0.22 0.00 0.00 0.00 0.00 0.00 60.65 60.49 1vkp s ILE 27 Cb -0.12 -0.26 0.00 0.00 0.01 0.00 0.00 42.46 42.09 1vkp s ILE 27 CO 0.01 0.04 0.00 0.61 0.00 0.00 0.00 174.94 175.60 1vkp n GLY 28 N 2.88 0.00 2.88 6.18 0.00 -1.26 -0.62 105.19 115.25 1vkp n GLY 28 Ca -0.13 -1.81 -0.16 0.00 0.00 0.00 0.00 46.02 43.92 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 -0.02 -0.21 0.46 1.61 -0.11 -1.00 -4.54 118.94 115.13 1vkp s TRP 29 Ca 0.00 0.64 -0.20 0.00 1.22 0.00 0.00 56.10 57.75 1vkp s TRP 29 Cb 0.00 -0.19 -0.10 0.00 -1.50 0.00 0.00 33.47 31.68 1vkp s TRP 29 CO 0.00 -0.26 0.99 -1.25 -4.62 0.00 0.00 176.95 171.81 1vkp s PRO 30 N 2.06 4.01 0.00 5.86 0.04 -1.26 -4.67 135.00 141.04 1vkp s PRO 30 Ca 0.00 1.21 0.00 0.00 0.04 0.00 0.00 61.00 62.25 1vkp s PRO 30 Cb -0.12 -2.14 0.00 0.00 0.04 0.00 0.00 34.50 32.28 1vkp s PRO 30 CO -0.06 -0.23 0.00 -1.91 0.04 0.00 0.00 177.00 174.84 1vkp n GLU 31 N -0.88 0.00 -2.35 4.56 2.13 -1.26 -4.80 120.64 118.03 1vkp n GLU 31 Ca 0.08 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.48 1vkp n GLU 31 Cb 0.53 -0.12 -0.03 0.00 0.27 0.00 0.00 31.44 32.09 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 -1.19 4.43 0.33 5.31 1.70 -1.26 -4.51 118.95 123.76 1vkp s ARG 32 Ca 0.00 1.87 0.26 0.00 -0.47 0.00 0.00 55.73 57.39 1vkp s ARG 32 Cb 0.00 -3.28 0.77 0.00 -0.57 0.00 0.00 34.95 31.86 1vkp s ARG 32 CO 0.00 -0.23 1.74 1.96 -1.08 0.00 0.00 175.30 177.70 1vkp h GLN 33 N 6.18 0.00 -0.06 3.89 4.20 -1.95 -1.98 115.11 125.39 1vkp h GLN 33 Ca -0.43 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.28 1vkp h GLN 33 Cb 1.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.99 1vkp h GLN 33 CO 0.80 0.00 0.00 -0.40 -0.67 0.00 0.00 178.83 178.56 1vkp n ASP 34 N -2.62 1.09 0.00 1.46 5.68 -1.26 -1.49 116.55 119.41 1vkp n ASP 34 Ca 0.04 -1.47 0.00 0.00 -0.50 0.00 0.00 54.79 52.86 1vkp n ASP 34 Cb 0.41 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.36 1vkp n ASP 34 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1vkp n ASN 35 N -0.11 3.00 -4.02 -1.12 4.05 -1.10 -4.80 115.26 111.16 1vkp n ASN 35 Ca 0.18 0.00 -0.30 0.00 0.45 0.00 0.00 54.58 54.91 1vkp n ASN 35 Cb 0.26 0.53 -0.16 0.00 1.23 0.00 0.00 39.78 41.64 1vkp n ASN 35 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 177.26 174.47 1vkp s TRP 36 N -1.29 2.25 0.73 1.20 0.52 -0.76 -4.56 118.94 117.03 1vkp s TRP 36 Ca 0.00 -1.31 -0.13 0.00 0.02 0.00 0.00 56.10 54.68 1vkp s TRP 36 Cb 0.00 -1.62 0.04 0.00 -1.15 0.00 0.00 33.47 30.74 1vkp s TRP 36 CO 0.00 -0.69 1.13 -0.98 0.02 0.00 0.00 176.95 176.42 1vkp s ARG 37 N 1.46 2.32 -1.35 4.98 1.70 -1.26 -3.00 118.95 123.80 1vkp s ARG 37 Ca 0.04 1.41 -0.02 0.00 -0.47 0.00 0.00 55.73 56.69 1vkp s ARG 37 Cb -0.13 -1.89 0.01 0.00 -0.57 0.00 0.00 34.95 32.37 1vkp s ARG 37 CO -0.10 -1.63 0.72 0.72 -1.08 0.00 0.00 175.30 173.93 1vkp n HIS 38 N -3.00 -1.95 -2.63 5.89 8.25 -0.32 -1.93 115.22 119.53 1vkp n HIS 38 Ca 0.11 0.84 -0.20 0.00 -0.26 0.00 0.00 57.72 58.21 1vkp n HIS 38 Cb 0.52 -4.29 0.00 0.00 1.12 0.00 0.00 29.99 27.35 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 -3.02 -5.59 0.00 0.41 5.03 -1.25 -1.88 115.26 108.95 1vkp n ASN 39 Ca -0.25 -0.08 0.00 0.00 0.87 0.00 0.00 54.58 55.12 1vkp n ASN 39 Cb 0.66 -4.62 0.00 0.00 -1.02 0.00 0.00 39.78 34.79 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 -2.55 0.00 -0.11 5.41 0.00 -0.81 -4.91 120.51 117.54 1vkp n ALA 40 Ca -0.19 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.16 1vkp n ALA 40 Cb 0.65 -1.07 -0.02 0.00 0.00 0.00 0.00 19.45 19.01 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 0.46 -0.70 0.00 4.07 -1.49 0.48 115.31 118.13 1vkp h LEU 41 Ca 0.00 -0.20 0.06 0.00 0.08 0.00 0.00 57.88 57.82 1vkp h LEU 41 Cb 0.63 -0.12 -0.05 0.00 1.08 0.00 0.00 40.66 42.19 1vkp h LEU 41 CO 0.00 0.54 0.41 -0.65 -1.08 0.00 0.00 178.44 177.65 1vkp h PRO 42 N 0.36 0.73 -0.35 1.13 0.11 -1.80 -2.46 132.00 129.72 1vkp h PRO 42 Ca 0.10 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 66.05 1vkp h PRO 42 Cb 0.23 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.17 1vkp h PRO 42 CO -0.00 0.48 -0.26 0.00 -0.21 0.00 0.00 178.00 178.01 1vkp h ALA 43 N 1.35 0.89 -0.82 -0.75 0.00 -1.80 -2.57 119.26 115.57 1vkp h ALA 43 Ca 0.31 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1vkp h ALA 43 Cb 0.17 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 1vkp h ALA 43 CO -0.17 0.63 0.41 1.96 0.00 0.00 0.00 179.25 182.07 1vkp h GLN 44 N 0.62 1.16 -0.44 0.00 4.20 -0.55 0.73 115.11 120.83 1vkp h GLN 44 Ca 0.08 -0.16 -0.07 0.00 0.06 0.00 0.00 58.65 58.56 1vkp h GLN 44 Cb 0.76 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 28.30 1vkp h GLN 44 CO 0.06 0.88 -0.03 0.00 -0.67 0.00 0.00 178.83 179.07 1vkp h ARG 45 N 1.16 0.73 -0.10 1.46 3.08 -1.13 0.67 114.38 120.24 1vkp h ARG 45 Ca 0.28 -0.20 -0.23 0.00 0.07 0.00 0.00 59.98 59.91 1vkp h ARG 45 Cb 0.09 -0.08 0.01 0.00 0.08 0.00 0.00 29.97 30.07 1vkp h ARG 45 CO -0.04 0.76 -0.82 0.28 -1.07 0.00 0.00 179.97 179.08 1vkp h VAL 46 N 0.68 1.29 -0.37 2.04 2.07 -0.98 -0.65 116.25 120.32 1vkp h VAL 46 Ca 0.13 -2.03 0.05 0.00 0.82 0.00 0.00 66.70 65.66 1vkp h VAL 46 Cb 0.46 2.13 -0.04 0.00 -1.52 0.00 0.00 31.29 32.32 1vkp h VAL 46 CO 0.02 0.64 0.13 -0.26 0.02 0.00 0.00 177.57 178.11 1vkp h PHE 47 N 0.44 0.22 -0.99 1.57 -1.00 -0.76 -0.17 116.94 116.25 1vkp h PHE 47 Ca -0.07 0.02 0.02 0.00 2.81 0.00 0.00 57.97 60.75 1vkp h PHE 47 Cb 1.46 -0.04 -0.05 0.00 3.61 0.00 0.00 35.95 40.93 1vkp h PHE 47 CO 0.10 0.09 0.65 0.00 -1.61 0.00 0.00 178.31 177.54 1vkp h ALA 48 N 1.25 1.32 -0.67 2.45 0.00 -0.81 -0.10 119.26 122.69 1vkp h ALA 48 Ca 0.17 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.06 1vkp h ALA 48 Cb 0.16 -0.38 -0.05 0.00 0.00 0.00 0.00 17.79 17.52 1vkp h ALA 48 CO -0.18 0.61 0.41 0.78 0.00 0.00 0.00 179.25 180.86 1vkp h GLY 49 N 1.30 0.97 0.87 0.00 0.00 -0.38 0.06 103.07 105.89 1vkp h GLY 49 Ca 0.38 -0.30 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 1vkp h GLY 49 CO -0.10 0.24 0.06 -2.08 0.00 0.00 0.00 176.54 174.67 1vkp h VAL 50 N 0.79 1.18 -0.59 4.60 2.07 -0.60 -0.86 116.25 122.84 1vkp h VAL 50 Ca 0.28 -0.54 0.02 0.00 0.82 0.00 0.00 66.70 67.28 1vkp h VAL 50 Cb 0.06 1.20 -0.04 0.00 -1.52 0.00 0.00 31.29 30.99 1vkp h VAL 50 CO -0.12 0.17 0.36 0.00 0.02 0.00 0.00 177.57 178.00 1vkp h ALA 51 N 0.89 0.76 -0.53 1.67 0.00 -0.74 -0.92 119.26 120.38 1vkp h ALA 51 Ca 0.06 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1vkp h ALA 51 Cb 0.21 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1vkp h ALA 51 CO -0.00 0.10 0.15 0.87 0.00 0.00 0.00 179.25 180.36 1vkp h LYS 52 N 0.72 0.84 -0.38 0.00 1.57 -0.92 -0.46 116.57 117.95 1vkp h LYS 52 Ca 0.23 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1vkp h LYS 52 Cb 0.01 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.18 1vkp h LYS 52 CO -0.09 0.79 0.24 0.00 -0.57 0.00 0.00 179.45 179.82 1vkp h ALA 53 N 1.02 0.48 -0.32 3.86 0.00 -0.78 -2.52 119.26 120.99 1vkp h ALA 53 Ca 0.17 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1vkp h ALA 53 Cb 0.31 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1vkp h ALA 53 CO -0.00 -0.05 -0.00 0.82 0.00 0.00 0.00 179.25 180.02 1vkp h ILE 54 N 0.51 1.19 0.00 0.00 2.04 -1.00 -2.71 117.51 117.54 1vkp h ILE 54 Ca 0.14 -0.75 0.00 0.00 1.00 0.00 0.00 64.86 65.25 1vkp h ILE 54 Cb -0.04 0.95 0.00 0.00 -0.74 0.00 0.00 36.82 37.00 1vkp h ILE 54 CO -0.03 0.26 0.00 0.77 0.00 0.00 0.00 178.15 179.15 1vkp h SER 55 N 0.47 0.00 1.02 1.72 4.64 -0.64 0.10 113.55 120.87 1vkp h SER 55 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1vkp h SER 55 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1vkp h SER 55 CO 0.01 0.00 0.00 0.11 -0.87 0.00 0.00 176.83 176.08 1vkp h LYS 56 N 0.00 0.00 0.00 4.77 1.79 -1.34 -3.32 116.57 118.47 1vkp h LYS 56 Ca 0.00 0.00 -0.30 0.00 -2.18 0.00 0.00 60.65 58.17 1vkp h LYS 56 Cb 0.19 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 30.78 1vkp h LYS 56 CO 0.00 0.00 -2.14 1.19 -1.08 0.00 0.00 179.45 177.42 1vkp n PHE 57 N -3.04 0.00 -3.61 -1.35 3.72 0.26 -5.09 117.46 108.36 1vkp n PHE 57 Ca 0.01 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.32 1vkp n PHE 57 Cb 0.30 -0.79 -0.02 0.00 -0.94 0.00 0.00 39.48 38.04 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 -2.40 1.32 0.57 -1.08 -1.05 -0.64 -4.63 118.70 110.79 1vkp s GLU 58 Ca -0.20 -0.61 -0.21 0.00 -0.15 0.00 0.00 54.97 53.80 1vkp s GLU 58 Cb 0.06 0.52 -0.04 0.00 -0.44 0.00 0.00 34.13 34.24 1vkp s GLU 58 CO 0.55 -0.59 1.32 -2.14 0.95 0.00 0.00 175.26 175.34 1vkp s PRO 59 N -3.60 3.00 -0.03 -4.83 0.02 -1.26 -3.79 135.00 124.51 1vkp s PRO 59 Ca 0.06 2.13 0.04 0.00 0.02 0.00 0.00 61.00 63.25 1vkp s PRO 59 Cb -0.02 -2.13 -0.00 0.00 0.02 0.00 0.00 34.50 32.37 1vkp s PRO 59 CO -0.04 -1.27 -0.14 0.08 -0.33 0.00 0.00 177.00 175.30 1vkp s VAL 60 N -1.36 1.15 -0.17 3.83 1.01 -1.26 -0.94 120.40 122.66 1vkp s VAL 60 Ca 0.75 -0.57 0.00 0.00 0.00 0.00 0.00 61.98 62.16 1vkp s VAL 60 Cb -0.38 -0.99 0.00 0.00 0.00 0.00 0.00 36.38 35.01 1vkp s VAL 60 CO 0.44 0.34 -0.15 -0.89 0.00 0.00 0.00 175.10 174.83 1vkp s THR 61 N 0.05 2.60 -0.17 3.92 2.01 -0.30 -1.73 115.64 122.01 1vkp s THR 61 Ca -0.02 -0.78 -0.11 0.00 0.31 0.00 0.00 61.69 61.08 1vkp s THR 61 Cb -0.10 -2.10 -0.05 0.00 0.01 0.00 0.00 72.50 70.26 1vkp s THR 61 CO 0.01 0.51 0.19 -0.69 -0.69 0.00 0.00 174.62 173.95 1vkp s VAL 62 N 0.97 5.38 -0.14 3.82 1.01 -0.02 -1.50 120.40 129.91 1vkp s VAL 62 Ca -0.02 0.33 -0.04 0.00 0.00 0.00 0.00 61.98 62.24 1vkp s VAL 62 Cb -0.15 -3.52 -0.03 0.00 0.00 0.00 0.00 36.38 32.68 1vkp s VAL 62 CO -0.03 0.45 -0.00 0.00 0.00 0.00 0.00 175.10 175.52 1vkp s ALA 64 N 0.06 0.81 0.87 0.00 0.00 -0.35 -2.39 121.76 120.76 1vkp s ALA 64 Ca 0.02 -0.78 -0.11 0.00 0.00 0.00 0.00 51.96 51.09 1vkp s ALA 64 Cb -0.13 -0.05 0.12 0.00 0.00 0.00 0.00 23.12 23.06 1vkp s ALA 64 CO 0.02 0.08 1.15 -1.54 0.00 0.00 0.00 175.76 175.47 1vkp s SER 65 N -1.40 3.33 0.31 0.00 1.04 -1.26 -4.16 113.70 111.56 1vkp s SER 65 Ca -0.05 2.15 0.07 0.00 0.48 0.00 0.00 55.95 58.60 1vkp s SER 65 Cb -0.09 -2.56 0.81 0.00 0.10 0.00 0.00 66.02 64.28 1vkp s SER 65 CO 0.01 -2.83 1.72 -0.65 0.98 0.00 0.00 173.24 172.47 1vkp h PRO 66 N -1.56 0.52 0.00 4.02 0.11 -1.96 -0.78 132.00 132.35 1vkp h PRO 66 Ca -0.44 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.57 1vkp h PRO 66 Cb 1.27 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1vkp h PRO 66 CO 0.44 0.35 -0.35 0.00 -0.21 0.00 0.00 178.00 178.23 1vkp h ALA 67 N 1.71 0.99 -0.01 -0.75 0.00 -2.05 -3.23 119.26 115.91 1vkp h ALA 67 Ca 0.60 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1vkp h ALA 67 Cb 1.12 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1vkp h ALA 67 CO -0.48 0.43 -0.48 1.04 0.00 0.00 0.00 179.25 179.77 1vkp n GLN 68 N -3.49 1.10 -0.12 0.00 1.13 -0.53 -4.67 117.38 110.79 1vkp n GLN 68 Ca -0.00 -0.89 -0.07 0.00 -1.94 0.00 0.00 57.00 54.11 1vkp n GLN 68 Cb 0.50 -1.48 0.02 0.00 0.11 0.00 0.00 30.24 29.38 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 2.16 0.40 -0.59 1.08 7.01 -1.21 -0.59 115.95 124.21 1vkp h TRP 69 Ca 0.00 0.02 -0.04 0.00 2.11 0.00 0.00 58.89 60.97 1vkp h TRP 69 Cb 0.71 -0.12 -0.03 0.00 -2.10 0.00 0.00 29.16 27.63 1vkp h TRP 69 CO 0.00 0.22 0.20 0.93 -2.79 0.00 0.00 178.44 177.01 1vkp h GLU 70 N 0.44 0.91 -0.27 2.65 5.08 -1.83 0.04 114.58 121.59 1vkp h GLU 70 Ca 0.17 -0.19 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1vkp h GLU 70 Cb 0.05 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 1vkp h GLU 70 CO -0.10 0.80 0.15 -0.97 -1.00 0.00 0.00 179.01 177.90 1vkp h ASN 71 N 0.84 0.34 -0.42 1.42 -1.24 -1.76 -0.05 115.58 114.71 1vkp h ASN 71 Ca 0.19 -0.08 -0.01 0.00 0.71 0.00 0.00 56.30 57.12 1vkp h ASN 71 Cb 0.26 -0.09 -0.02 0.00 0.73 0.00 0.00 38.32 39.20 1vkp h ASN 71 CO -0.01 0.32 0.23 0.00 -1.29 0.00 0.00 177.43 176.68 1vkp h ALA 72 N 1.04 0.53 -0.80 1.57 0.00 -0.94 -0.72 119.26 119.93 1vkp h ALA 72 Ca 0.10 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1vkp h ALA 72 Cb 0.05 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 1vkp h ALA 72 CO -0.02 0.05 0.52 -0.09 0.00 0.00 0.00 179.25 179.71 1vkp h ARG 73 N 0.54 1.07 -0.16 0.00 9.65 -0.65 -1.64 114.38 123.18 1vkp h ARG 73 Ca 0.15 -0.07 -0.18 0.00 -1.10 0.00 0.00 59.98 58.77 1vkp h ARG 73 Cb 0.04 -0.24 -0.00 0.00 -1.39 0.00 0.00 29.97 28.38 1vkp h ARG 73 CO -0.02 0.72 -0.65 0.87 2.80 0.00 0.00 179.97 183.68 1vkp h LYS 74 N 1.09 0.61 -0.28 0.20 1.57 -0.72 -3.24 116.57 115.80 1vkp h LYS 74 Ca 0.29 -0.44 -0.15 0.00 -1.87 0.00 0.00 60.65 58.48 1vkp h LYS 74 Cb -0.11 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 1vkp h LYS 74 CO -0.06 1.06 -0.43 1.96 -0.57 0.00 0.00 179.45 181.41 1vkp h GLN 75 N 0.45 0.69 -5.80 3.15 4.20 -0.83 -3.45 115.11 113.51 1vkp h GLN 75 Ca -0.02 -0.37 -0.61 0.00 0.06 0.00 0.00 58.65 57.71 1vkp h GLN 75 Cb 1.23 0.02 -0.07 0.00 0.30 0.00 0.00 27.48 28.96 1vkp h GLN 75 CO 0.12 0.99 -0.26 -0.51 -0.67 0.00 0.00 178.83 178.50 1vkp s LEU 76 N -8.61 4.39 0.57 1.46 1.43 -0.64 -5.06 118.68 112.22 1vkp s LEU 76 Ca -0.09 0.77 -0.19 0.00 -1.03 0.00 0.00 54.13 53.59 1vkp s LEU 76 Cb 0.12 -2.48 -0.06 0.00 0.03 0.00 0.00 46.19 43.80 1vkp s LEU 76 CO 0.85 0.24 0.94 -2.65 0.23 0.00 0.00 176.35 175.96 1vkp n PRO 77 N 2.48 0.95 0.18 1.29 -0.02 -1.26 -4.87 135.00 133.74 1vkp n PRO 77 Ca -0.13 0.36 0.13 0.00 -2.02 0.00 0.00 63.50 61.84 1vkp n PRO 77 Cb 0.52 -2.12 0.61 0.00 -0.02 0.00 0.00 33.50 32.50 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 0.63 0.00 0.00 -0.52 4.39 -1.97 -1.52 114.58 115.60 1vkp h GLU 78 Ca -0.48 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.22 1vkp h GLU 78 Cb 1.36 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.01 1vkp h GLU 78 CO 0.51 0.00 0.00 -0.40 -1.16 0.00 0.00 179.01 177.96 1vkp n ASP 79 N -2.43 0.00 -4.68 1.42 3.85 -1.26 -4.56 116.55 108.90 1vkp n ASP 79 Ca 0.00 0.40 -0.39 0.00 -0.71 0.00 0.00 54.79 54.09 1vkp n ASP 79 Cb 0.16 -0.46 -0.07 0.00 -1.35 0.00 0.00 41.12 39.40 1vkp n ASP 79 CO 0.00 0.00 0.00 -0.63 -1.01 0.00 0.00 177.20 175.56 1vkp s ILE 80 N -2.92 5.15 0.12 2.12 1.01 -0.57 -4.70 121.20 121.40 1vkp s ILE 80 Ca 0.13 0.88 -0.30 0.00 0.00 0.00 0.00 60.65 61.36 1vkp s ILE 80 Cb 0.15 -3.80 -0.06 0.00 0.01 0.00 0.00 42.46 38.75 1vkp s ILE 80 CO 0.39 0.23 1.08 -0.60 0.00 0.00 0.00 174.94 176.04 1vkp s ARG 81 N 1.35 4.58 -0.16 2.79 3.52 -0.71 -4.90 118.95 125.41 1vkp s ARG 81 Ca 0.23 1.64 0.01 0.00 -0.13 0.00 0.00 55.73 57.48 1vkp s ARG 81 Cb -0.15 -3.34 0.01 0.00 -1.56 0.00 0.00 34.95 29.92 1vkp s ARG 81 CO 0.09 0.02 -0.20 0.08 -0.81 0.00 0.00 175.30 174.48 1vkp s VAL 82 N 0.25 2.13 0.11 7.11 1.01 -1.26 -0.84 120.40 128.91 1vkp s VAL 82 Ca 0.51 -0.93 0.10 0.00 0.00 0.00 0.00 61.98 61.66 1vkp s VAL 82 Cb -0.27 -1.88 -0.04 0.00 0.00 0.00 0.00 36.38 34.20 1vkp s VAL 82 CO 0.32 0.54 -0.26 0.68 0.00 0.00 0.00 175.10 176.38 1vkp s VAL 83 N 1.10 2.12 0.59 2.92 -7.23 -0.32 -5.00 120.40 114.57 1vkp s VAL 83 Ca 0.00 -1.65 -0.11 0.00 -1.81 0.00 0.00 61.98 58.41 1vkp s VAL 83 Cb -0.14 -1.87 -0.04 0.00 0.56 0.00 0.00 36.38 34.88 1vkp s VAL 83 CO -0.08 0.10 0.99 -0.70 -0.31 0.00 0.00 175.10 175.11 1vkp s GLU 84 N -1.88 3.63 0.33 4.82 2.12 -1.26 -1.22 118.70 125.25 1vkp s GLU 84 Ca 0.12 0.70 0.10 0.00 0.36 0.00 0.00 54.97 56.25 1vkp s GLU 84 Cb -0.10 -2.12 -0.06 0.00 0.26 0.00 0.00 34.13 32.11 1vkp s GLU 84 CO 0.05 -0.49 -0.06 -1.12 -0.54 0.00 0.00 175.26 173.10 1vkp s SER 86 N -4.04 3.93 -0.10 -1.70 0.01 -1.26 -4.86 113.70 105.67 1vkp s SER 86 Ca 0.54 -1.08 0.13 0.00 1.31 0.00 0.00 55.95 56.85 1vkp s SER 86 Cb -0.11 -0.44 -0.18 0.00 0.21 0.00 0.00 66.02 65.51 1vkp s SER 86 CO 0.50 -0.19 0.11 0.59 0.41 0.00 0.00 173.24 174.67 1vkp n ASN 88 N -0.85 1.70 -2.99 2.44 4.13 -1.26 -4.73 115.26 113.70 1vkp n ASN 88 Ca -0.05 0.00 -0.10 0.00 1.68 0.00 0.00 54.58 56.11 1vkp n ASN 88 Cb 0.63 1.03 0.01 0.00 -1.54 0.00 0.00 39.78 39.91 1vkp n ASN 88 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1vkp s ASP 89 N -4.41 0.27 -0.62 6.41 3.68 -1.26 -4.86 116.67 115.88 1vkp s ASP 89 Ca -0.06 -1.25 0.04 0.00 2.13 0.00 0.00 52.55 53.40 1vkp s ASP 89 Cb 0.05 0.81 0.36 0.00 -1.45 0.00 0.00 42.92 42.69 1vkp s ASP 89 CO 0.56 -1.59 1.20 -1.54 0.13 0.00 0.00 175.17 173.93 1vkp n SER 90 N -1.44 5.19 -3.61 -0.34 3.41 -1.26 -4.89 113.62 110.68 1vkp n SER 90 Ca -0.06 -3.71 -0.27 0.00 -0.26 0.00 0.00 58.87 54.57 1vkp n SER 90 Cb 0.60 -0.66 -0.10 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 -0.31 3.16 0.34 7.33 7.02 -1.26 -4.62 117.44 129.10 1vkp n TRP 91 Ca 0.37 -4.17 0.14 0.00 -1.02 0.00 0.00 57.50 52.83 1vkp n TRP 91 Cb 0.44 -0.55 0.59 0.00 -2.42 0.00 0.00 31.31 29.36 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 -0.78 -5.99 0.05 -1.73 -0.97 116.94 112.23 1vkp h PHE 92 Ca 0.18 0.00 0.08 0.00 3.82 0.00 0.00 57.97 62.05 1vkp h PHE 92 Cb 0.72 0.00 -0.05 0.00 2.00 0.00 0.00 35.95 38.61 1vkp h PHE 92 CO 0.68 0.00 0.51 -0.09 -0.18 0.00 0.00 178.31 179.23 1vkp h ARG 93 N 0.00 0.75 0.00 1.51 9.65 -1.24 -1.09 114.38 123.96 1vkp h ARG 93 Ca 0.00 -0.04 -0.37 0.00 -1.10 0.00 0.00 59.98 58.47 1vkp h ARG 93 Cb 0.40 -0.17 -0.07 0.00 -1.39 0.00 0.00 29.97 28.75 1vkp h ARG 93 CO 0.00 0.49 -2.39 -0.25 2.80 0.00 0.00 179.97 180.63 1vkp n ASP 94 N -4.49 1.40 0.05 -3.80 8.00 -0.42 -2.51 116.55 114.78 1vkp n ASP 94 Ca 0.12 -0.09 0.11 0.00 0.71 0.00 0.00 54.79 55.65 1vkp n ASP 94 Cb 0.28 0.09 -0.04 0.00 -0.02 0.00 0.00 41.12 41.43 1vkp n ASP 94 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1vkp n SER 95 N -3.05 0.54 -4.47 -2.24 3.41 -0.87 -4.04 113.62 102.90 1vkp n SER 95 Ca -0.40 0.10 -0.29 0.00 -0.26 0.00 0.00 58.87 58.02 1vkp n SER 95 Cb 1.03 0.99 0.15 0.00 -0.26 0.00 0.00 64.21 66.11 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 -4.24 1.68 0.46 5.00 0.00 -0.41 -3.49 107.32 106.32 1vkp s GLY 96 Ca -0.02 -0.92 -0.19 0.00 0.00 0.00 0.00 44.72 43.60 1vkp s GLY 96 CO 0.83 -0.27 0.95 2.56 0.00 0.00 0.00 173.10 177.17 1vkp s PRO 97 N -5.70 4.09 -0.44 2.90 0.04 -1.26 -4.81 135.00 129.82 1vkp s PRO 97 Ca 0.68 1.02 -0.19 0.00 0.04 0.00 0.00 61.00 62.55 1vkp s PRO 97 Cb -0.08 -2.18 0.03 0.00 0.04 0.00 0.00 34.50 32.31 1vkp s PRO 97 CO 0.52 -0.12 0.53 0.99 0.04 0.00 0.00 177.00 178.96 1vkp s THR 98 N -2.36 4.97 0.37 1.26 2.01 -0.66 -4.87 115.64 116.36 1vkp s THR 98 Ca 0.60 -0.21 -0.24 0.00 0.31 0.00 0.00 61.69 62.15 1vkp s THR 98 Cb -0.09 -4.13 -0.10 0.00 0.01 0.00 0.00 72.50 68.18 1vkp s THR 98 CO 0.21 -0.54 0.98 -0.36 -0.69 0.00 0.00 174.62 174.22 1vkp s PHE 99 N 2.44 3.46 0.07 4.92 0.40 -1.26 -0.72 117.98 127.29 1vkp s PHE 99 Ca 0.16 1.70 0.02 0.00 -0.60 0.00 0.00 56.93 58.20 1vkp s PHE 99 Cb -0.16 -2.98 -0.03 0.00 0.51 0.00 0.00 43.02 40.36 1vkp s PHE 99 CO 0.15 -0.15 -0.07 0.96 0.70 0.00 0.00 175.22 176.81 1vkp s ILE 100 N -1.76 0.58 0.11 0.64 -4.36 -0.19 -4.54 121.20 111.68 1vkp s ILE 100 Ca 0.56 -1.56 0.03 0.00 -0.26 0.00 0.00 60.65 59.42 1vkp s ILE 100 Cb -0.18 -1.20 -0.04 0.00 1.25 0.00 0.00 42.46 42.29 1vkp s ILE 100 CO 0.23 -0.68 -0.08 0.68 0.24 0.00 0.00 174.94 175.33 1vkp s VAL 101 N -2.69 0.87 0.20 8.37 -7.23 -0.19 -1.11 120.40 118.61 1vkp s VAL 101 Ca 0.02 -1.89 0.01 0.00 -1.81 0.00 0.00 61.98 58.30 1vkp s VAL 101 Cb -0.01 -1.64 -0.05 0.00 0.56 0.00 0.00 36.38 35.25 1vkp s VAL 101 CO -0.03 -0.77 0.06 0.00 -0.31 0.00 0.00 175.10 174.06 1vkp s ARG 102 N -3.55 1.18 0.11 4.82 1.70 -0.29 -1.12 118.95 121.80 1vkp s ARG 102 Ca 0.11 -1.60 -0.12 0.00 -0.47 0.00 0.00 55.73 53.65 1vkp s ARG 102 Cb 0.03 -0.07 -0.12 0.00 -0.57 0.00 0.00 34.95 34.21 1vkp s ARG 102 CO -0.02 -0.25 1.36 1.57 -1.08 0.00 0.00 175.30 176.87 1vkp h LYS 103 N 2.62 0.84 -0.25 3.89 -0.00 -1.87 -3.41 116.57 118.38 1vkp h LYS 103 Ca -0.37 -0.60 0.25 0.00 -0.00 0.00 0.00 60.65 59.93 1vkp h LYS 103 Cb 1.22 0.10 -0.26 0.00 -0.00 0.00 0.00 32.23 33.29 1vkp h LYS 103 CO 0.60 1.22 0.45 -0.98 -0.00 0.00 0.00 179.45 180.74 1vkp s ARG 104 N -3.96 0.08 0.28 0.07 1.70 -1.26 -4.76 118.95 111.10 1vkp s ARG 104 Ca -0.11 0.19 0.00 0.00 -0.47 0.00 0.00 55.73 55.34 1vkp s ARG 104 Cb 0.09 0.11 0.00 0.00 -0.57 0.00 0.00 34.95 34.59 1vkp s ARG 104 CO 0.90 -0.03 0.00 0.09 -1.08 0.00 0.00 175.30 175.17 1vkp n ASN 112 N 4.74 -7.23 -4.93 -2.89 5.03 -1.26 -4.97 115.26 103.74 1vkp n ASN 112 Ca -0.07 1.31 -0.25 0.00 0.87 0.00 0.00 54.58 56.43 1vkp n ASN 112 Cb 0.55 -4.33 0.06 0.00 -1.02 0.00 0.00 39.78 35.03 1vkp n ASN 112 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1vkp s ARG 113 N -1.61 2.40 -0.14 3.52 0.52 -1.26 -5.00 118.95 117.38 1vkp s ARG 113 Ca 0.00 -0.28 0.15 0.00 -0.52 0.00 0.00 55.73 55.08 1vkp s ARG 113 Cb 0.00 -2.24 0.67 0.00 0.52 0.00 0.00 34.95 33.90 1vkp s ARG 113 CO 0.00 -1.05 1.55 0.09 0.02 0.00 0.00 175.30 175.91 1vkp n ASN 114 N -2.77 4.56 -3.96 0.23 3.02 -1.26 -4.84 115.26 110.24 1vkp n ASN 114 Ca 0.07 -2.53 -0.14 0.00 -0.03 0.00 0.00 54.58 51.96 1vkp n ASN 114 Cb 0.60 -0.58 -0.13 0.00 -0.61 0.00 0.00 39.78 39.05 1vkp n ASN 114 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 1vkp s ILE 115 N -2.05 0.31 0.23 2.41 2.07 -1.26 -1.14 121.20 121.77 1vkp s ILE 115 Ca 0.46 -0.42 -0.03 0.00 -1.41 0.00 0.00 60.65 59.25 1vkp s ILE 115 Cb 0.31 -0.31 -0.03 0.00 0.13 0.00 0.00 42.46 42.57 1vkp s ILE 115 CO 0.19 -0.08 0.25 0.00 -1.91 0.00 0.00 174.94 173.39 1vkp s ALA 116 N -0.50 0.85 0.02 1.50 0.00 -0.27 -4.25 121.76 119.11 1vkp s ALA 116 Ca -0.03 -1.52 0.04 0.00 0.00 0.00 0.00 51.96 50.46 1vkp s ALA 116 Cb -0.04 1.30 -0.02 0.00 0.00 0.00 0.00 23.12 24.37 1vkp s ALA 116 CO -0.00 -0.68 -0.13 0.20 0.00 0.00 0.00 175.76 175.15 1vkp s GLY 117 N -3.15 0.69 -0.14 0.00 0.00 -0.11 -1.02 107.32 103.59 1vkp s GLY 117 Ca 0.34 -0.68 -0.15 0.00 0.00 0.00 0.00 44.72 44.23 1vkp s GLY 117 CO 0.13 -0.63 0.36 -0.42 0.00 0.00 0.00 173.10 172.54 1vkp s ILE 118 N -0.61 5.25 -0.61 0.90 1.01 0.10 -0.64 121.20 126.60 1vkp s ILE 118 Ca 0.03 0.69 -0.05 0.00 0.00 0.00 0.00 60.65 61.32 1vkp s ILE 118 Cb -0.06 -3.69 0.16 0.00 0.01 0.00 0.00 42.46 38.87 1vkp s ILE 118 CO 0.00 0.39 0.45 -0.62 0.00 0.00 0.00 174.94 175.16 1vkp s ASP 119 N 0.38 5.48 0.65 3.58 2.15 -0.03 -1.65 116.67 127.22 1vkp s ASP 119 Ca 0.20 -2.66 -0.13 0.00 0.43 0.00 0.00 52.55 50.39 1vkp s ASP 119 Cb -0.14 -1.91 -0.01 0.00 -0.30 0.00 0.00 42.92 40.56 1vkp s ASP 119 CO 0.07 -0.44 1.06 0.26 -0.17 0.00 0.00 175.17 175.94 1vkp s TRP 120 N 0.23 3.09 0.71 -5.34 0.52 -1.26 -1.33 118.94 115.55 1vkp s TRP 120 Ca 0.15 1.46 -0.13 0.00 0.02 0.00 0.00 56.10 57.60 1vkp s TRP 120 Cb -0.20 -2.92 0.02 0.00 -1.15 0.00 0.00 33.47 29.22 1vkp s TRP 120 CO -0.04 -1.14 1.09 1.21 0.02 0.00 0.00 176.95 178.09 1vkp s ASN 121 N -3.38 4.92 -0.01 2.95 3.04 -0.93 -4.85 114.94 116.67 1vkp s ASN 121 Ca 0.60 1.88 -0.03 0.00 0.04 0.00 0.00 52.86 55.35 1vkp s ASN 121 Cb -0.15 -2.53 -0.00 0.00 -1.54 0.00 0.00 41.25 37.03 1vkp s ASN 121 CO 0.47 -1.76 0.07 0.12 -3.04 0.00 0.00 177.10 172.96 1vkp s PHE 122 N -2.64 0.03 -0.07 0.43 5.36 -1.26 -1.71 117.98 118.12 1vkp s PHE 122 Ca 0.64 -0.05 0.22 0.00 -0.96 0.00 0.00 56.93 56.77 1vkp s PHE 122 Cb -0.18 -0.04 0.39 0.00 -0.34 0.00 0.00 43.02 42.84 1vkp s PHE 122 CO 0.48 -0.15 1.15 0.27 -1.46 0.00 0.00 175.22 175.52 1vkp n ASN 123 N 2.26 0.76 -3.80 6.13 2.04 -1.26 -4.98 115.26 116.41 1vkp n ASN 123 Ca -0.18 -2.01 -0.24 0.00 -0.44 0.00 0.00 54.58 51.71 1vkp n ASN 123 Cb 0.57 -0.22 0.02 0.00 -2.53 0.00 0.00 39.78 37.62 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 0.13 -1.89 -3.61 -2.53 0.00 -1.26 -0.23 120.51 111.12 1vkp n ALA 124 Ca 0.01 -0.13 -0.22 0.00 0.00 0.00 0.00 53.44 53.10 1vkp n ALA 124 Cb 1.01 -2.27 0.07 0.00 0.00 0.00 0.00 19.45 18.26 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 -4.37 -2.43 0.00 0.00 8.01 -1.26 -0.95 117.44 116.44 1vkp n TRP 125 Ca -0.24 0.95 0.00 0.00 -1.31 0.00 0.00 57.50 56.90 1vkp n TRP 125 Cb 0.65 -4.80 0.00 0.00 -2.01 0.00 0.00 31.31 25.16 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 -1.62 -0.30 5.12 6.99 0.00 -1.19 -4.14 105.19 110.05 1vkp n GLY 126 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.65 0.36 -0.02 0.00 0.68 -2.71 105.19 101.85 1vkp n GLY 127 Ca 0.00 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.51 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 1.42 0.00 4.61 0.00 -1.92 -0.35 119.26 123.02 1vkp h ALA 128 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1vkp h ALA 128 Cb 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.46 1vkp h ALA 128 CO 0.00 0.53 -1.48 0.09 0.00 0.00 0.00 179.25 178.40 1vkp n ASN 129 N -4.41 0.51 -0.22 0.00 3.02 -1.26 -4.63 115.26 108.27 1vkp n ASN 129 Ca 0.09 -0.49 0.00 0.00 -0.03 0.00 0.00 54.58 54.15 1vkp n ASN 129 Cb 0.03 1.47 0.00 0.00 -0.61 0.00 0.00 39.78 40.67 1vkp n ASN 129 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1vkp n ASP 130 N -1.88 0.00 -4.84 6.41 2.03 -1.10 -5.11 116.55 112.05 1vkp n ASP 130 Ca 0.00 -1.42 -0.22 0.00 0.52 0.00 0.00 54.79 53.67 1vkp n ASP 130 Cb 0.45 -0.08 0.08 0.00 -0.72 0.00 0.00 41.12 40.84 1vkp n ASP 130 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1vkp s GLY 131 N -0.42 1.78 0.13 0.27 0.00 -0.15 -4.30 107.32 104.62 1vkp s GLY 131 Ca 0.00 -1.76 0.23 0.00 0.00 0.00 0.00 44.72 43.19 1vkp s GLY 131 CO 0.00 -1.29 0.95 0.00 0.00 0.00 0.00 173.10 172.75 1vkp s TYR 133 N -3.35 0.19 -0.67 0.00 -0.85 -1.26 -2.18 117.35 109.23 1vkp s TYR 133 Ca -0.01 -0.57 0.23 0.00 -0.52 0.00 0.00 57.07 56.20 1vkp s TYR 133 Cb 0.11 0.31 0.10 0.00 0.38 0.00 0.00 41.96 42.87 1vkp s TYR 133 CO 0.81 -1.03 1.08 0.09 -1.52 0.00 0.00 175.55 174.99 1vkp n ASN 134 N -0.39 0.63 -3.78 -0.18 3.02 -0.32 -4.79 115.26 109.44 1vkp n ASN 134 Ca -0.03 -0.23 -0.25 0.00 -0.03 0.00 0.00 54.58 54.04 1vkp n ASN 134 Cb 0.61 0.70 -0.17 0.00 -0.61 0.00 0.00 39.78 40.31 1vkp n ASN 134 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1vkp s ASP 135 N -3.82 2.19 -0.19 6.41 -1.08 -1.26 -5.00 116.67 113.93 1vkp s ASP 135 Ca 0.05 -0.40 0.13 0.00 -0.52 0.00 0.00 52.55 51.81 1vkp s ASP 135 Cb 0.15 -0.57 0.38 0.00 -1.46 0.00 0.00 42.92 41.42 1vkp s ASP 135 CO 0.79 -0.22 1.20 -2.67 0.52 0.00 0.00 175.17 174.78 1vkp n TRP 136 N 5.07 0.00 -0.21 -5.34 2.14 -1.26 -4.84 117.44 113.00 1vkp n TRP 136 Ca -0.09 -1.35 -0.06 0.00 2.07 0.00 0.00 57.50 58.08 1vkp n TRP 136 Cb 0.49 -0.22 0.04 0.00 -0.81 0.00 0.00 31.31 30.81 1vkp n TRP 136 CO 0.00 0.00 0.00 0.77 2.07 0.00 0.00 177.69 180.53 1vkp h SER 137 N 0.69 0.67 -0.28 -0.67 0.02 -1.99 -1.75 113.55 110.25 1vkp h SER 137 Ca -0.00 -0.01 -0.19 0.00 -0.84 0.00 0.00 61.79 60.75 1vkp h SER 137 Cb 1.00 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.38 1vkp h SER 137 CO 0.00 0.48 -0.55 0.45 -1.14 0.00 0.00 176.83 176.07 1vkp h HIS 138 N 0.80 1.10 -0.43 3.45 3.86 -1.91 -3.18 115.15 118.83 1vkp h HIS 138 Ca 0.23 -0.39 0.03 0.00 -1.16 0.00 0.00 60.37 59.08 1vkp h HIS 138 Cb -0.07 -0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.17 1vkp h HIS 138 CO -0.04 1.22 0.29 -0.44 0.86 0.00 0.00 177.93 179.82 1vkp h ASP 139 N 0.67 0.39 0.04 2.45 3.45 -1.74 -0.80 116.42 120.87 1vkp h ASP 139 Ca 0.01 -0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.47 1vkp h ASP 139 Cb 1.16 -0.09 -0.00 0.00 -0.56 0.00 0.00 39.33 39.84 1vkp h ASP 139 CO 0.12 0.27 -0.01 -0.07 -1.57 0.00 0.00 179.24 177.98 1vkp h LEU 140 N 0.45 0.00 -1.02 1.55 3.38 -1.31 -2.47 115.31 115.89 1vkp h LEU 140 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1vkp h LEU 140 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1vkp h LEU 140 CO -0.04 0.01 -0.47 0.18 0.09 0.00 0.00 178.44 178.21 1vkp n LEU 141 N -3.67 2.05 -0.08 1.67 4.77 -0.31 -4.60 117.00 116.84 1vkp n LEU 141 Ca -0.03 -0.77 -0.09 0.00 -0.03 0.00 0.00 56.01 55.09 1vkp n LEU 141 Cb 0.09 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.16 1vkp n LEU 141 CO 0.26 0.38 0.98 0.58 -1.33 0.00 0.00 177.39 178.26 1vkp h VAL 142 N 2.49 1.08 -0.38 4.08 2.07 -1.34 -1.37 116.25 122.87 1vkp h VAL 142 Ca 0.00 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 1vkp h VAL 142 Cb 0.76 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 1vkp h VAL 142 CO 0.00 0.08 0.17 0.28 0.02 0.00 0.00 177.57 178.12 1vkp h SER 143 N 0.37 0.51 -0.50 0.57 0.02 -1.77 -1.06 113.55 111.68 1vkp h SER 143 Ca 0.10 -0.14 -0.04 0.00 -0.84 0.00 0.00 61.79 60.87 1vkp h SER 143 Cb -0.03 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.35 1vkp h SER 143 CO -0.02 0.51 0.17 -0.09 -1.14 0.00 0.00 176.83 176.26 1vkp h ARG 144 N 0.48 0.83 -0.30 3.45 2.43 -1.79 -1.82 114.38 117.65 1vkp h ARG 144 Ca 0.13 -0.15 -0.09 0.00 -0.81 0.00 0.00 59.98 59.06 1vkp h ARG 144 Cb 0.15 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 1vkp h ARG 144 CO -0.01 0.72 -0.15 0.87 -1.51 0.00 0.00 179.97 179.88 1vkp h LYS 145 N 0.81 0.64 -0.14 0.20 1.57 -0.92 -0.53 116.57 118.20 1vkp h LYS 145 Ca 0.18 -0.28 0.01 0.00 -1.87 0.00 0.00 60.65 58.69 1vkp h LYS 145 Cb 0.24 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 1vkp h LYS 145 CO -0.01 0.87 0.05 0.82 -0.57 0.00 0.00 179.45 180.61 1vkp h ILE 146 N 0.40 0.98 -0.37 1.86 2.04 -1.02 -0.42 117.51 120.97 1vkp h ILE 146 Ca 0.07 -0.04 -0.08 0.00 1.00 0.00 0.00 64.86 65.80 1vkp h ILE 146 Cb 0.68 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 37.58 1vkp h ILE 146 CO 0.05 0.02 -0.11 -0.07 0.00 0.00 0.00 178.15 178.04 1vkp h LEU 147 N 0.13 0.63 -0.63 1.44 3.38 -1.27 -2.33 115.31 116.66 1vkp h LEU 147 Ca 0.06 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 1vkp h LEU 147 Cb 0.03 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 1vkp h LEU 147 CO -0.05 0.77 0.25 0.00 0.09 0.00 0.00 178.44 179.50 1vkp h ALA 148 N 1.29 0.82 -0.81 1.53 0.00 -0.86 -0.44 119.26 120.79 1vkp h ALA 148 Ca 0.11 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 54.87 1vkp h ALA 148 Cb 0.53 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 1vkp h ALA 148 CO 0.03 0.43 0.52 -0.07 0.00 0.00 0.00 179.25 180.16 1vkp h LEU 149 N 0.88 0.87 -0.45 0.00 3.38 -0.71 -2.39 115.31 116.90 1vkp h LEU 149 Ca 0.21 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1vkp h LEU 149 Cb 0.20 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1vkp h LEU 149 CO -0.02 0.61 -0.15 -0.62 0.09 0.00 0.00 178.44 178.35 1vkp n GLU 150 N -4.57 0.91 -3.81 1.13 -0.58 -0.91 -4.95 120.64 107.87 1vkp n GLU 150 Ca 0.09 -0.45 -0.26 0.00 -0.42 0.00 0.00 57.16 56.12 1vkp n GLU 150 Cb 0.07 -1.49 0.03 0.00 -0.57 0.00 0.00 31.44 29.48 1vkp n GLU 150 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1vkp n ARG 151 N -0.65 -5.19 -4.21 3.49 1.74 -0.30 -5.00 116.66 106.55 1vkp n ARG 151 Ca 0.14 0.60 -0.35 0.00 -0.77 0.00 0.00 57.85 57.48 1vkp n ARG 151 Cb 0.31 -5.31 -0.10 0.00 -1.02 0.00 0.00 32.46 26.35 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 -3.51 4.50 0.59 0.55 1.01 -0.47 -5.03 121.20 118.84 1vkp s ILE 152 Ca 0.32 -0.16 -0.20 0.00 0.00 0.00 0.00 60.65 60.61 1vkp s ILE 152 Cb -0.16 -2.96 -0.03 0.00 0.01 0.00 0.00 42.46 39.32 1vkp s ILE 152 CO 0.82 0.54 1.34 -2.84 0.00 0.00 0.00 174.94 174.80 1vkp s PRO 153 N -0.23 2.87 -0.11 2.79 0.02 -1.26 -4.59 135.00 134.49 1vkp s PRO 153 Ca 0.06 2.19 0.01 0.00 0.02 0.00 0.00 61.00 63.29 1vkp s PRO 153 Cb -0.12 -2.09 -0.02 0.00 0.02 0.00 0.00 34.50 32.30 1vkp s PRO 153 CO 0.02 -1.39 -0.15 0.50 -0.33 0.00 0.00 177.00 175.66 1vkp s ARG 154 N -3.10 3.19 -0.31 5.54 3.52 -1.26 -0.93 118.95 125.60 1vkp s ARG 154 Ca 0.76 -0.71 -0.08 0.00 -0.13 0.00 0.00 55.73 55.58 1vkp s ARG 154 Cb -0.40 -2.55 0.01 0.00 -1.56 0.00 0.00 34.95 30.45 1vkp s ARG 154 CO 0.45 0.28 0.11 -0.06 -0.81 0.00 0.00 175.30 175.27 1vkp s PHE 155 N 0.16 3.18 0.13 5.12 0.40 0.19 -4.96 117.98 122.19 1vkp s PHE 155 Ca -0.08 -0.99 -0.22 0.00 -0.60 0.00 0.00 56.93 55.04 1vkp s PHE 155 Cb -0.15 -2.29 -0.07 0.00 0.51 0.00 0.00 43.02 41.01 1vkp s PHE 155 CO 0.05 -0.59 0.68 -1.14 0.70 0.00 0.00 175.22 174.93 1vkp s GLN 156 N 1.51 4.39 -0.03 0.44 0.74 -1.26 -0.85 119.66 124.59 1vkp s GLN 156 Ca 0.02 0.96 0.06 0.00 0.05 0.00 0.00 55.36 56.45 1vkp s GLN 156 Cb -0.18 -3.23 -0.01 0.00 1.10 0.00 0.00 33.01 30.69 1vkp s GLN 156 CO 0.03 0.59 -0.22 -1.58 -0.55 0.00 0.00 175.29 173.57 1vkp s HIS 157 N -1.16 2.04 -1.43 1.67 5.65 -0.44 -4.92 115.29 116.71 1vkp s HIS 157 Ca 0.33 -0.48 -0.14 0.00 0.25 0.00 0.00 55.06 55.02 1vkp s HIS 157 Cb -0.21 -1.33 0.05 0.00 -1.18 0.00 0.00 32.58 29.91 1vkp s HIS 157 CO 0.23 -0.10 2.14 -1.13 -0.65 0.00 0.00 174.74 175.22 1vkp n SER 158 N 2.76 4.10 -4.20 9.88 3.41 -1.26 -2.19 113.62 126.12 1vkp n SER 158 Ca -0.16 -2.87 -0.32 0.00 -0.26 0.00 0.00 58.87 55.26 1vkp n SER 158 Cb 0.52 -1.66 -0.17 0.00 -0.26 0.00 0.00 64.21 62.64 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 3.16 1.99 -0.18 -1.33 1.01 -1.26 -4.57 121.20 120.02 1vkp s ILE 160 Ca 0.47 -0.98 -0.27 0.00 0.00 0.00 0.00 60.65 59.88 1vkp s ILE 160 Cb 0.12 -1.73 0.07 0.00 0.01 0.00 0.00 42.46 40.93 1vkp s ILE 160 CO -0.06 0.54 0.69 -0.22 0.00 0.00 0.00 174.94 175.89 1vkp s LEU 161 N 0.41 -0.64 -0.04 2.97 2.96 -0.69 -4.82 118.68 118.82 1vkp s LEU 161 Ca -0.18 1.13 0.03 0.00 -0.22 0.00 0.00 54.13 54.89 1vkp s LEU 161 Cb -0.18 2.43 -0.03 0.00 0.50 0.00 0.00 46.19 48.92 1vkp s LEU 161 CO 0.08 -0.38 -0.12 -1.61 -1.32 0.00 0.00 176.35 172.99 1vkp s GLU 162 N -0.24 2.53 0.58 1.98 8.01 -1.26 -4.65 118.70 125.64 1vkp s GLU 162 Ca -0.04 -0.69 0.28 0.00 0.01 0.00 0.00 54.97 54.53 1vkp s GLU 162 Cb -0.03 -2.43 1.66 0.00 -4.31 0.00 0.00 34.13 29.02 1vkp s GLU 162 CO 0.04 0.62 2.15 0.78 0.01 0.00 0.00 175.26 178.87 1vkp h GLY 163 N 5.15 0.00 1.68 -1.39 0.00 -1.63 -0.32 103.07 106.57 1vkp h GLY 163 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1vkp h GLY 163 CO 0.51 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.66 1vkp n GLY 164 N -1.40 -1.01 0.31 4.60 0.00 -1.21 -3.07 105.19 103.40 1vkp n GLY 164 Ca 0.00 -0.09 0.12 0.00 0.00 0.00 0.00 46.02 46.06 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 -1.34 1.30 -4.10 1.61 3.41 -0.13 -2.15 113.62 112.22 1vkp n SER 165 Ca 0.08 -1.06 -0.21 0.00 -0.26 0.00 0.00 58.87 57.42 1vkp n SER 165 Cb 0.18 0.25 -0.15 0.00 -0.26 0.00 0.00 64.21 64.23 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 -2.51 1.03 0.01 -1.33 -4.36 -1.18 -4.38 121.20 108.49 1vkp s ILE 166 Ca 0.22 -0.65 0.03 0.00 -0.26 0.00 0.00 60.65 59.99 1vkp s ILE 166 Cb 0.19 -0.88 -0.01 0.00 1.25 0.00 0.00 42.46 43.01 1vkp s ILE 166 CO 0.54 0.22 -0.09 -1.00 0.24 0.00 0.00 174.94 174.85 1vkp s HIS 167 N -0.42 0.82 0.12 1.37 3.76 -0.54 -4.91 115.29 115.49 1vkp s HIS 167 Ca 0.04 -0.25 0.06 0.00 -0.15 0.00 0.00 55.06 54.75 1vkp s HIS 167 Cb -0.06 -0.51 -0.04 0.00 1.11 0.00 0.00 32.58 33.09 1vkp s HIS 167 CO -0.00 -0.01 -0.13 0.14 -0.85 0.00 0.00 174.74 173.88 1vkp s VAL 168 N -0.57 1.28 -2.76 -0.90 -7.23 -1.26 -0.23 120.40 108.73 1vkp s VAL 168 Ca 0.00 -1.72 0.25 0.00 -1.81 0.00 0.00 61.98 58.71 1vkp s VAL 168 Cb -0.05 -1.52 0.34 0.00 0.56 0.00 0.00 36.38 35.70 1vkp s VAL 168 CO 0.00 -0.44 1.44 -0.90 -0.31 0.00 0.00 175.10 174.89 1vkp n ASP 169 N 0.52 2.49 0.00 4.85 5.75 -1.03 -4.62 116.55 124.51 1vkp n ASP 169 Ca -0.15 -1.82 0.00 0.00 -0.01 0.00 0.00 54.79 52.80 1vkp n ASP 169 Cb 0.57 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.64 1vkp n ASP 169 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1vkp n GLY 170 N 1.30 0.42 0.73 6.12 0.00 -1.26 -4.56 105.19 107.93 1vkp n GLY 170 Ca 0.16 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.23 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 -1.61 0.68 0.00 1.61 1.02 -1.26 -4.81 120.64 116.27 1vkp n GLU 171 Ca 0.00 -2.22 0.00 0.00 -0.02 0.00 0.00 57.16 54.92 1vkp n GLU 171 Cb 0.11 -0.85 0.00 0.00 -0.02 0.00 0.00 31.44 30.68 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 0.38 3.71 0.62 0.00 -1.26 -4.45 105.19 103.74 1vkp n GLY 172 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.00 4.41 -0.08 2.61 2.01 -1.26 -0.47 115.64 120.87 1vkp s THR 173 Ca 0.00 -0.34 0.02 0.00 0.31 0.00 0.00 61.69 61.68 1vkp s THR 173 Cb 0.00 -2.92 0.01 0.00 0.01 0.00 0.00 72.50 69.60 1vkp s THR 173 CO 0.00 0.50 -0.14 0.00 -0.69 0.00 0.00 174.62 174.29 1vkp s LEU 175 N 0.67 3.15 0.18 0.00 2.96 0.68 -0.69 118.68 125.63 1vkp s LEU 175 Ca -0.14 -0.18 -0.09 0.00 -0.22 0.00 0.00 54.13 53.50 1vkp s LEU 175 Cb -0.16 -1.75 -0.01 0.00 0.50 0.00 0.00 46.19 44.77 1vkp s LEU 175 CO 0.04 0.16 0.31 0.68 -1.32 0.00 0.00 176.35 176.21 1vkp s VAL 176 N 0.44 0.05 0.06 1.68 -7.23 -0.74 -1.46 120.40 113.19 1vkp s VAL 176 Ca -0.05 -1.42 0.05 0.00 -1.81 0.00 0.00 61.98 58.75 1vkp s VAL 176 Cb -0.14 -1.94 -0.04 0.00 0.56 0.00 0.00 36.38 34.82 1vkp s VAL 176 CO 0.03 -0.23 -0.08 0.42 -0.31 0.00 0.00 175.10 174.94 1vkp s THR 177 N -3.99 3.53 0.15 5.32 -4.23 -1.26 -1.29 115.64 113.87 1vkp s THR 177 Ca 0.19 -1.04 -0.08 0.00 -1.18 0.00 0.00 61.69 59.58 1vkp s THR 177 Cb 0.03 -2.60 -0.08 0.00 1.34 0.00 0.00 72.50 71.19 1vkp s THR 177 CO 0.02 0.23 1.43 -0.33 -0.54 0.00 0.00 174.62 175.44 1vkp h GLU 178 N 3.99 0.75 -1.00 3.99 5.08 -1.02 -2.55 114.58 123.82 1vkp h GLU 178 Ca -0.48 -0.49 0.20 0.00 -1.00 0.00 0.00 59.36 57.59 1vkp h GLU 178 Cb 1.17 0.06 -0.11 0.00 0.50 0.00 0.00 28.75 30.37 1vkp h GLU 178 CO 0.54 1.11 0.61 1.49 -1.00 0.00 0.00 179.01 181.76 1vkp h GLU 179 N 0.57 0.67 0.00 2.33 4.81 -1.57 -1.42 114.58 119.97 1vkp h GLU 179 Ca 0.01 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1vkp h GLU 179 Cb 1.16 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.39 1vkp h GLU 179 CO 0.12 0.45 -0.25 0.00 -0.73 0.00 0.00 179.01 178.60 1vkp h LEU 181 N -0.63 0.00 -2.65 0.00 -0.00 -1.40 -2.20 115.31 108.44 1vkp h LEU 181 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1vkp h LEU 181 Cb 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.91 1vkp h LEU 181 CO 0.00 0.34 0.00 0.18 -0.00 0.00 0.00 178.44 178.96 1vkp n LEU 182 N -3.47 3.85 -4.77 1.67 4.77 -0.54 -4.65 117.00 113.86 1vkp n LEU 182 Ca 0.00 -1.91 -0.41 0.00 -0.03 0.00 0.00 56.01 53.67 1vkp n LEU 182 Cb 0.50 -0.47 -0.02 0.00 -2.33 0.00 0.00 43.42 41.11 1vkp n LEU 182 CO 0.36 0.95 0.99 0.21 -1.33 0.00 0.00 177.39 178.58 1vkp s ASN 183 N -1.04 6.66 0.34 -1.43 3.84 -0.83 -4.90 114.94 117.59 1vkp s ASN 183 Ca 0.48 2.73 0.25 0.00 0.21 0.00 0.00 52.86 56.52 1vkp s ASN 183 Cb 0.25 -2.65 1.23 0.00 -0.55 0.00 0.00 41.25 39.53 1vkp s ASN 183 CO 0.33 -0.62 1.75 0.07 -2.79 0.00 0.00 177.10 175.85 1vkp h LYS 184 N 3.24 0.00 -0.02 0.43 2.10 -1.92 -2.08 116.57 118.31 1vkp h LYS 184 Ca -0.49 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.16 1vkp h LYS 184 Cb 1.23 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 1vkp h LYS 184 CO 0.65 0.00 0.00 0.27 -2.00 0.00 0.00 179.45 178.37 1vkp n ASN 185 N -2.37 0.75 0.00 7.07 0.23 -1.26 -4.16 115.26 115.52 1vkp n ASN 185 Ca -0.00 -1.30 0.00 0.00 -0.53 0.00 0.00 54.58 52.74 1vkp n ASN 185 Cb 0.12 -0.01 0.00 0.00 -2.08 0.00 0.00 39.78 37.81 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 -0.39 0.00 -3.22 -3.83 5.12 -0.78 -4.31 116.66 109.25 1vkp n ARG 186 Ca 0.20 0.00 -0.25 0.00 -1.93 0.00 0.00 57.85 55.88 1vkp n ARG 186 Cb 0.22 0.00 -0.06 0.00 -1.16 0.00 0.00 32.46 31.46 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 -1.09 2.55 0.31 0.55 4.13 -1.25 -4.70 115.26 115.77 1vkp n ASN 187 Ca 0.00 -3.24 0.21 0.00 1.68 0.00 0.00 54.58 53.23 1vkp n ASN 187 Cb 0.00 -0.63 1.09 0.00 -1.54 0.00 0.00 39.78 38.70 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 3.67 0.00 -2.65 3.52 0.13 -1.78 -3.44 132.00 131.46 1vkp h PRO 188 Ca 0.13 0.00 -0.79 0.00 -0.87 0.00 0.00 66.00 64.48 1vkp h PRO 188 Cb 0.73 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 31.64 1vkp h PRO 188 CO 0.68 0.00 1.47 0.72 -0.23 0.00 0.00 178.00 180.64 1vkp n HIS 189 N -2.98 2.62 -4.28 1.56 8.25 -1.26 -5.04 115.22 114.09 1vkp n HIS 189 Ca -0.02 -2.66 -0.15 0.00 -0.26 0.00 0.00 57.72 54.63 1vkp n HIS 189 Cb 0.09 -1.47 -0.10 0.00 1.12 0.00 0.00 29.99 29.63 1vkp n HIS 189 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1vkp s SER 191 N -0.72 1.00 0.24 0.41 1.04 -1.26 -5.14 113.70 109.26 1vkp s SER 191 Ca 0.41 -1.34 -0.05 0.00 0.48 0.00 0.00 55.95 55.45 1vkp s SER 191 Cb 0.15 0.19 0.41 0.00 0.10 0.00 0.00 66.02 66.87 1vkp s SER 191 CO -0.05 -0.72 1.76 0.50 0.98 0.00 0.00 173.24 175.71 1vkp h LYS 192 N 2.49 0.53 -0.59 4.02 3.64 -1.97 -0.70 116.57 124.00 1vkp h LYS 192 Ca -0.37 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 58.89 1vkp h LYS 192 Cb 1.24 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.91 1vkp h LYS 192 CO 0.60 0.35 0.04 0.93 -2.27 0.00 0.00 179.45 179.10 1vkp h GLU 193 N 0.55 1.00 -0.55 1.90 3.07 -2.04 -0.21 114.58 118.29 1vkp h GLU 193 Ca 0.39 -0.28 -0.11 0.00 -0.50 0.00 0.00 59.36 58.86 1vkp h GLU 193 Cb 0.51 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.29 1vkp h GLU 193 CO -0.33 0.96 -0.09 1.96 -1.40 0.00 0.00 179.01 180.10 1vkp h GLN 194 N 0.93 1.04 -0.10 2.33 4.20 -1.78 -1.40 115.11 120.33 1vkp h GLN 194 Ca 0.18 -0.38 -0.00 0.00 0.06 0.00 0.00 58.65 58.51 1vkp h GLN 194 Cb 0.49 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.19 1vkp h GLN 194 CO 0.02 1.07 0.05 0.82 -0.67 0.00 0.00 178.83 180.12 1vkp h ILE 195 N 0.92 1.10 -0.52 2.54 2.04 -0.89 -2.16 117.51 120.54 1vkp h ILE 195 Ca 0.15 -0.29 0.07 0.00 1.00 0.00 0.00 64.86 65.79 1vkp h ILE 195 Cb 0.66 1.10 -0.06 0.00 -0.74 0.00 0.00 36.82 37.79 1vkp h ILE 195 CO 0.05 0.09 0.20 -0.33 0.00 0.00 0.00 178.15 178.16 1vkp h GLU 196 N 0.06 0.38 -0.68 2.37 5.08 -0.94 -1.46 114.58 119.39 1vkp h GLU 196 Ca 0.04 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 1vkp h GLU 196 Cb 0.10 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 1vkp h GLU 196 CO -0.01 0.25 0.34 1.49 -1.00 0.00 0.00 179.01 180.09 1vkp h GLU 197 N 0.39 0.96 -0.41 2.33 4.57 -1.09 0.11 114.58 121.44 1vkp h GLU 197 Ca 0.25 -0.12 -0.06 0.00 -1.18 0.00 0.00 59.36 58.25 1vkp h GLU 197 Cb 0.26 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.65 1vkp h GLU 197 CO -0.24 0.73 0.01 0.93 -1.18 0.00 0.00 179.01 179.26 1vkp h GLU 198 N 0.96 0.72 -0.28 1.92 4.39 -0.93 -2.56 114.58 118.79 1vkp h GLU 198 Ca 0.24 -0.22 -0.07 0.00 0.34 0.00 0.00 59.36 59.65 1vkp h GLU 198 Cb 0.07 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.64 1vkp h GLU 198 CO -0.03 0.79 -0.11 -0.07 -1.16 0.00 0.00 179.01 178.43 1vkp h LEU 199 N 0.55 0.45 -0.26 1.33 3.38 -0.73 -0.69 115.31 119.34 1vkp h LEU 199 Ca 0.12 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1vkp h LEU 199 Cb 0.46 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1vkp h LEU 199 CO 0.02 0.60 0.16 0.11 0.09 0.00 0.00 178.44 179.41 1vkp h LYS 200 N 0.44 0.36 -0.41 1.13 1.57 -0.68 -0.36 116.57 118.61 1vkp h LYS 200 Ca 0.08 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.75 1vkp h LYS 200 Cb 0.46 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.67 1vkp h LYS 200 CO 0.03 0.28 -0.08 0.87 -0.57 0.00 0.00 179.45 179.97 1vkp h LYS 201 N 0.33 0.70 0.04 3.15 1.57 -1.14 -1.50 116.57 119.72 1vkp h LYS 201 Ca 0.09 -0.21 -0.36 0.00 -1.87 0.00 0.00 60.65 58.31 1vkp h LYS 201 Cb 0.02 -0.07 -0.05 0.00 0.08 0.00 0.00 32.23 32.21 1vkp h LYS 201 CO -0.02 0.77 -2.16 0.66 -0.57 0.00 0.00 179.45 178.13 1vkp n TYR 202 N -4.19 0.58 1.00 -1.35 4.01 -0.29 -1.33 117.16 115.58 1vkp n TYR 202 Ca 0.01 0.15 0.10 0.00 -0.16 0.00 0.00 57.90 58.01 1vkp n TYR 202 Cb 0.33 -1.09 -0.04 0.00 -0.31 0.00 0.00 39.34 38.24 1vkp n TYR 202 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1vkp n LEU 203 N -3.18 0.91 -1.70 7.72 4.77 -0.15 -4.76 117.00 120.61 1vkp n LEU 203 Ca -0.33 -0.40 -0.13 0.00 -0.03 0.00 0.00 56.01 55.13 1vkp n LEU 203 Cb 1.05 -0.05 0.01 0.00 -2.33 0.00 0.00 43.42 42.11 1vkp n LEU 203 CO 0.38 0.22 -0.04 0.61 -1.33 0.00 0.00 177.39 177.24 1vkp n GLY 204 N 1.50 -0.03 3.93 -0.72 0.00 -0.57 -4.53 105.19 104.77 1vkp n GLY 204 Ca 0.04 -0.29 -0.21 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.82 4.68 0.00 1.61 -7.23 -1.21 -4.61 120.40 110.81 1vkp s VAL 205 Ca 0.13 -1.12 0.00 0.00 -1.81 0.00 0.00 61.98 59.18 1vkp s VAL 205 Cb -0.06 -3.61 0.00 0.00 0.56 0.00 0.00 36.38 33.28 1vkp s VAL 205 CO 0.16 -0.28 0.00 0.00 -0.31 0.00 0.00 175.10 174.67 1vkp n GLN 206 N -1.40 2.30 -4.06 4.82 3.00 0.38 -4.42 117.38 118.01 1vkp n GLN 206 Ca -0.06 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 56.85 1vkp n GLN 206 Cb 0.58 -0.96 -0.10 0.00 0.00 0.00 0.00 30.24 29.76 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 0.42 -0.03 1.08 1.04 -0.84 -5.05 113.70 107.93 1vkp s SER 207 Ca 0.00 -0.88 0.04 0.00 0.48 0.00 0.00 55.95 55.58 1vkp s SER 207 Cb 0.00 0.19 -0.00 0.00 0.10 0.00 0.00 66.02 66.31 1vkp s SER 207 CO 0.00 -0.55 -0.14 -0.36 0.98 0.00 0.00 173.24 173.17 1vkp s PHE 208 N -3.47 1.34 -0.30 5.02 0.40 -1.26 -1.26 117.98 118.46 1vkp s PHE 208 Ca 0.03 -0.35 -0.04 0.00 -0.60 0.00 0.00 56.93 55.97 1vkp s PHE 208 Cb 0.05 -0.91 0.03 0.00 0.51 0.00 0.00 43.02 42.70 1vkp s PHE 208 CO -0.08 -0.11 0.03 0.42 0.70 0.00 0.00 175.22 176.17 1vkp s ILE 209 N 0.03 3.38 -0.42 0.64 1.01 0.13 -4.97 121.20 121.00 1vkp s ILE 209 Ca -0.02 -1.11 -0.16 0.00 0.00 0.00 0.00 60.65 59.37 1vkp s ILE 209 Cb -0.09 -2.85 0.03 0.00 0.01 0.00 0.00 42.46 39.56 1vkp s ILE 209 CO 0.01 -0.03 0.36 0.26 0.00 0.00 0.00 174.94 175.54 1vkp s TRP 210 N 1.36 3.21 0.07 3.97 0.52 -1.26 -1.80 118.94 125.01 1vkp s TRP 210 Ca -0.02 -0.57 -0.24 0.00 0.02 0.00 0.00 56.10 55.30 1vkp s TRP 210 Cb -0.19 -2.78 -0.06 0.00 -1.15 0.00 0.00 33.47 29.29 1vkp s TRP 210 CO 0.00 -0.66 0.72 -0.51 0.02 0.00 0.00 176.95 176.52 1vkp s LEU 211 N 1.84 4.49 0.23 2.99 1.43 -0.41 -4.90 118.68 124.34 1vkp s LEU 211 Ca 0.07 1.43 -0.09 0.00 -1.03 0.00 0.00 54.13 54.52 1vkp s LEU 211 Cb -0.19 -3.16 0.20 0.00 0.03 0.00 0.00 46.19 43.07 1vkp s LEU 211 CO 0.11 0.11 1.90 -0.65 0.23 0.00 0.00 176.35 178.04 1vkp h PRO 212 N 5.20 1.13 -4.64 1.29 0.11 -1.92 -0.03 132.00 133.14 1vkp h PRO 212 Ca -0.46 -0.07 -0.28 0.00 0.11 0.00 0.00 66.00 65.30 1vkp h PRO 212 Cb 1.21 -0.25 -0.21 0.00 0.11 0.00 0.00 31.00 31.85 1vkp h PRO 212 CO 0.69 0.75 -0.74 1.03 -0.21 0.00 0.00 178.00 179.52 1vkp s ARG 213 N -6.11 0.56 0.00 1.05 0.52 -1.26 -1.76 118.95 111.95 1vkp s ARG 213 Ca -0.13 -0.80 0.00 0.00 -0.52 0.00 0.00 55.73 54.28 1vkp s ARG 213 Cb 0.16 -0.34 0.00 0.00 0.52 0.00 0.00 34.95 35.29 1vkp s ARG 213 CO 0.80 0.06 0.00 0.41 0.02 0.00 0.00 175.30 176.59 1vkp n GLY 214 N 1.39 0.68 3.77 -3.53 0.00 -1.25 -4.96 105.19 101.30 1vkp n GLY 214 Ca -0.22 -1.84 -0.40 0.00 0.00 0.00 0.00 46.02 43.55 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 4.38 0.22 0.99 2.96 -1.26 -4.97 118.68 121.00 1vkp s LEU 215 Ca 0.00 2.49 -0.31 0.00 -0.22 0.00 0.00 54.13 56.09 1vkp s LEU 215 Cb 0.00 -3.76 -0.11 0.00 0.50 0.00 0.00 46.19 42.82 1vkp s LEU 215 CO 0.00 -0.50 1.55 -0.47 -1.32 0.00 0.00 176.35 175.61 1vkp s TYR 216 N -1.23 2.97 0.00 5.38 6.14 -1.26 -2.28 117.35 127.07 1vkp s TYR 216 Ca 0.51 0.75 0.00 0.00 0.64 0.00 0.00 57.07 58.96 1vkp s TYR 216 Cb -0.35 -3.95 0.00 0.00 0.42 0.00 0.00 41.96 38.08 1vkp s TYR 216 CO 0.46 -3.32 0.00 0.41 0.64 0.00 0.00 175.55 173.73 1vkp n GLY 217 N 2.98 0.50 2.06 8.97 0.00 -1.26 -4.63 105.19 113.81 1vkp n GLY 217 Ca 0.11 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.90 1vkp n GLY 217 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1vkp n ASP 218 N 0.00 4.86 -0.29 1.61 4.64 -0.97 -4.46 116.55 121.94 1vkp n ASP 218 Ca 0.00 -3.39 -0.03 0.00 -1.38 0.00 0.00 54.79 50.00 1vkp n ASP 218 Cb 0.00 -0.86 0.14 0.00 -1.04 0.00 0.00 41.12 39.36 1vkp n ASP 218 CO 0.00 0.00 0.00 -0.08 -0.82 0.00 0.00 177.20 176.30 1vkp h GLU 219 N 1.15 1.16 -0.25 -0.67 4.57 -1.94 -0.82 114.58 117.79 1vkp h GLU 219 Ca 0.51 -0.12 -0.07 0.00 -1.18 0.00 0.00 59.36 58.50 1vkp h GLU 219 Cb 1.96 -0.23 -0.01 0.00 -0.16 0.00 0.00 28.75 30.30 1vkp h GLU 219 CO 1.04 0.84 -0.16 -0.44 -1.18 0.00 0.00 179.01 179.10 1vkp h ASP 220 N 1.17 0.42 -0.08 1.04 3.32 -1.96 -2.47 116.42 117.87 1vkp h ASP 220 Ca 0.30 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.23 1vkp h ASP 220 Cb 0.00 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.44 1vkp h ASP 220 CO -0.05 0.61 0.00 0.35 -1.72 0.00 0.00 179.24 178.43 1vkp n THR 221 N -4.19 0.08 -3.24 0.35 -2.24 -1.14 -4.75 114.28 99.16 1vkp n THR 221 Ca 0.00 -0.54 -0.16 0.00 -2.27 0.00 0.00 64.05 61.08 1vkp n THR 221 Cb 0.34 1.37 0.05 0.00 -2.10 0.00 0.00 70.33 69.99 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 1.23 -4.88 -1.54 3.42 4.13 -0.39 -4.34 115.26 112.89 1vkp n ASN 222 Ca 0.13 -0.37 -0.04 0.00 1.68 0.00 0.00 54.58 55.99 1vkp n ASN 222 Cb 0.54 -3.58 0.02 0.00 -1.54 0.00 0.00 39.78 35.22 1vkp n ASN 222 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1vkp n GLY 223 N -1.51 0.28 3.59 7.41 0.00 -0.75 -1.99 105.19 112.21 1vkp n GLY 223 Ca -0.00 -0.35 -0.46 0.00 0.00 0.00 0.00 46.02 45.21 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 -1.82 1.29 -0.19 1.61 8.25 -1.26 -3.83 115.22 119.26 1vkp n HIS 224 Ca -0.06 0.69 0.12 0.00 -0.26 0.00 0.00 57.72 58.21 1vkp n HIS 224 Cb 0.54 -2.26 0.44 0.00 1.12 0.00 0.00 29.99 29.82 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 2.21 0.86 0.00 1.59 6.09 -1.76 -2.53 117.51 123.97 1vkp h ILE 225 Ca -0.41 -0.19 0.00 0.00 -1.37 0.00 0.00 64.86 62.89 1vkp h ILE 225 Cb 1.34 0.25 0.00 0.00 0.47 0.00 0.00 36.82 38.88 1vkp h ILE 225 CO 0.64 0.10 0.00 -0.90 -3.07 0.00 0.00 178.15 174.92 1vkp n ASP 226 N -4.50 0.00 -1.95 2.19 5.75 -0.91 -1.24 116.55 115.88 1vkp n ASP 226 Ca 0.14 0.44 -0.18 0.00 -0.01 0.00 0.00 54.79 55.19 1vkp n ASP 226 Cb 0.44 -0.47 0.20 0.00 -1.03 0.00 0.00 41.12 40.25 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 -1.47 3.53 -4.76 -1.12 5.15 -0.95 -3.77 115.26 111.86 1vkp n ASN 227 Ca 0.04 -3.62 -0.40 0.00 -0.60 0.00 0.00 54.58 50.00 1vkp n ASN 227 Cb 0.15 -0.78 -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 -4.05 3.74 -0.03 0.00 0.08 -1.26 -0.54 117.98 115.91 1vkp s PHE 231 Ca 0.25 1.74 0.12 0.00 0.12 0.00 0.00 56.93 59.17 1vkp s PHE 231 Cb 0.06 -3.16 -0.17 0.00 -0.57 0.00 0.00 43.02 39.18 1vkp s PHE 231 CO 0.04 -0.16 0.96 0.00 -0.10 0.00 0.00 175.22 175.97 1vkp h ALA 232 N 4.77 0.62 -1.04 5.36 0.00 -1.26 -3.46 119.26 124.25 1vkp h ALA 232 Ca -0.45 -1.05 0.37 0.00 0.00 0.00 0.00 54.91 53.78 1vkp h ALA 232 Cb 1.21 0.20 -0.17 0.00 0.00 0.00 0.00 17.79 19.03 1vkp h ALA 232 CO 0.70 1.23 0.98 -0.98 0.00 0.00 0.00 179.25 181.18 1vkp s ARG 233 N -2.75 0.03 0.29 0.00 1.70 -1.21 -4.98 118.95 112.03 1vkp s ARG 233 Ca -0.02 -0.02 -0.30 0.00 -0.47 0.00 0.00 55.73 54.93 1vkp s ARG 233 Cb 0.09 0.01 -0.12 0.00 -0.57 0.00 0.00 34.95 34.36 1vkp s ARG 233 CO 0.81 -0.01 1.53 -2.30 -1.08 0.00 0.00 175.30 174.25 1vkp n PRO 234 N -0.30 2.51 -0.38 3.89 -0.02 -1.26 -1.82 135.00 137.62 1vkp n PRO 234 Ca -0.04 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 1vkp n PRO 234 Cb 0.61 -2.63 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 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 1.98 1.51 2.85 -1.23 0.00 -1.26 -5.02 105.19 104.02 1vkp n GLY 235 Ca 0.09 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.95 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 -3.11 0.17 0.16 1.61 1.01 -0.75 -1.39 120.40 118.09 1vkp s VAL 236 Ca 0.00 0.02 0.09 0.00 0.00 0.00 0.00 61.98 62.09 1vkp s VAL 236 Cb 0.00 -0.22 -0.04 0.00 0.00 0.00 0.00 36.38 36.12 1vkp s VAL 236 CO 0.00 0.10 -0.21 0.68 0.00 0.00 0.00 175.10 175.67 1vkp s VAL 237 N 0.58 1.98 -0.20 2.92 -7.23 -0.08 -0.77 120.40 117.60 1vkp s VAL 237 Ca -0.06 -1.86 -0.09 0.00 -1.81 0.00 0.00 61.98 58.16 1vkp s VAL 237 Cb -0.08 -1.88 -0.04 0.00 0.56 0.00 0.00 36.38 34.94 1vkp s VAL 237 CO -0.01 -0.18 0.10 -0.76 -0.31 0.00 0.00 175.10 173.94 1vkp s LEU 238 N -2.47 3.96 -0.11 1.32 1.43 0.30 -0.52 118.68 122.58 1vkp s LEU 238 Ca 0.15 0.11 0.03 0.00 -1.03 0.00 0.00 54.13 53.40 1vkp s LEU 238 Cb -0.07 -2.02 0.00 0.00 0.03 0.00 0.00 46.19 44.13 1vkp s LEU 238 CO 0.07 0.15 -0.23 -0.22 0.23 0.00 0.00 176.35 176.35 1vkp s LEU 239 N 0.55 2.08 0.19 1.79 2.96 -0.17 -1.86 118.68 124.22 1vkp s LEU 239 Ca 0.05 -0.56 -0.32 0.00 -0.22 0.00 0.00 54.13 53.08 1vkp s LEU 239 Cb -0.12 -1.40 -0.12 0.00 0.50 0.00 0.00 46.19 45.05 1vkp s LEU 239 CO 0.01 0.13 1.72 -1.20 -1.32 0.00 0.00 176.35 175.68 1vkp n SER 240 N 3.70 3.87 -3.91 3.68 7.64 -1.26 -1.00 113.62 126.34 1vkp n SER 240 Ca -0.19 1.06 -0.10 0.00 1.01 0.00 0.00 58.87 60.64 1vkp n SER 240 Cb 0.53 -1.55 -0.11 0.00 -1.01 0.00 0.00 64.21 62.06 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 1.31 0.11 -0.01 1.43 -0.11 -0.67 -4.71 118.94 116.29 1vkp s TRP 241 Ca 0.76 -0.22 -0.07 0.00 1.22 0.00 0.00 56.10 57.79 1vkp s TRP 241 Cb -0.53 -0.09 0.00 0.00 -1.50 0.00 0.00 33.47 31.35 1vkp s TRP 241 CO 0.34 -0.17 0.14 -0.08 -4.62 0.00 0.00 176.95 172.55 1vkp s THR 242 N -1.00 0.07 -2.17 5.86 -1.32 -1.26 -1.56 115.64 114.25 1vkp s THR 242 Ca -0.11 -0.57 0.25 0.00 -1.21 0.00 0.00 61.69 60.06 1vkp s THR 242 Cb -0.07 -0.39 0.23 0.00 -1.51 0.00 0.00 72.50 70.77 1vkp s THR 242 CO 0.00 -0.31 1.42 0.47 -2.21 0.00 0.00 174.62 173.98 1vkp n ASP 243 N 1.75 1.71 -4.56 8.08 8.00 -1.26 -4.81 116.55 125.46 1vkp n ASP 243 Ca -0.21 -1.36 -0.43 0.00 0.71 0.00 0.00 54.79 53.51 1vkp n ASP 243 Cb 0.56 0.19 -0.03 0.00 -0.02 0.00 0.00 41.12 41.82 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 -2.32 6.41 0.00 -2.24 -1.08 -1.26 -4.89 116.67 111.29 1vkp s ASP 244 Ca 0.26 -0.07 0.17 0.00 -0.52 0.00 0.00 52.55 52.40 1vkp s ASP 244 Cb 0.19 -2.50 0.80 0.00 -1.46 0.00 0.00 42.92 39.96 1vkp s ASP 244 CO 0.47 -1.34 1.54 -0.62 0.52 0.00 0.00 175.17 175.73 1vkp n GLU 245 N 7.94 0.11 0.00 4.34 1.02 -1.26 -1.88 120.64 130.91 1vkp n GLU 245 Ca 0.06 0.17 0.13 0.00 -0.02 0.00 0.00 57.16 57.50 1vkp n GLU 245 Cb 0.48 -1.50 0.44 0.00 -0.02 0.00 0.00 31.44 30.84 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 -1.41 0.00 -2.99 2.62 -2.24 -1.26 -4.83 114.28 104.17 1vkp n THR 246 Ca 0.06 -0.03 -0.40 0.00 -2.27 0.00 0.00 64.05 61.41 1vkp n THR 246 Cb 0.18 -0.01 -0.04 0.00 -2.10 0.00 0.00 70.33 68.36 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 -2.84 7.03 0.62 3.42 -1.08 -0.79 -4.93 116.67 118.10 1vkp s ASP 247 Ca 0.17 1.24 0.30 0.00 -0.52 0.00 0.00 52.55 53.73 1vkp s ASP 247 Cb 0.19 -2.44 1.61 0.00 -1.46 0.00 0.00 42.92 40.82 1vkp s ASP 247 CO 0.59 -0.17 1.96 -0.65 0.52 0.00 0.00 175.17 177.43 1vkp h PRO 248 N 6.85 0.00 -0.24 4.34 0.11 -1.88 -0.40 132.00 140.78 1vkp h PRO 248 Ca -0.39 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.70 1vkp h PRO 248 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1vkp h PRO 248 CO 0.76 0.00 0.06 0.37 -0.21 0.00 0.00 178.00 178.98 1vkp h GLN 249 N 0.00 0.33 -0.34 1.05 5.75 -1.91 -3.31 115.11 116.68 1vkp h GLN 249 Ca 0.10 -0.04 0.06 0.00 -0.15 0.00 0.00 58.65 58.61 1vkp h GLN 249 Cb 0.80 -0.06 -0.05 0.00 1.07 0.00 0.00 27.48 29.23 1vkp h GLN 249 CO -0.00 0.31 0.04 -0.92 -2.65 0.00 0.00 178.83 175.61 1vkp h TYR 250 N 0.33 0.05 -0.05 3.99 5.03 -1.29 -1.40 116.97 123.64 1vkp h TYR 250 Ca 0.08 0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.38 1vkp h TYR 250 Cb 0.13 0.03 -0.01 0.00 1.55 0.00 0.00 36.73 38.43 1vkp h TYR 250 CO 0.00 -0.02 -0.13 1.05 -1.32 0.00 0.00 178.16 177.75 1vkp h GLU 251 N 0.14 0.07 -0.12 1.82 4.11 -1.77 -1.00 114.58 117.84 1vkp h GLU 251 Ca 0.16 -0.01 -0.08 0.00 0.07 0.00 0.00 59.36 59.50 1vkp h GLU 251 Cb 0.20 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1vkp h GLU 251 CO -0.24 0.21 -0.22 0.00 0.07 0.00 0.00 179.01 178.82 1vkp h ARG 252 N 0.07 0.37 -0.49 1.06 3.08 -1.48 -2.06 114.38 114.93 1vkp h ARG 252 Ca 0.01 -0.23 0.00 0.00 0.07 0.00 0.00 59.98 59.84 1vkp h ARG 252 Cb 0.28 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 1vkp h ARG 252 CO 0.02 0.82 0.32 0.77 -1.07 0.00 0.00 179.97 180.83 1vkp h SER 253 N -0.04 0.57 -0.54 7.04 0.02 -0.78 -1.24 113.55 118.57 1vkp h SER 253 Ca 0.01 -0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 60.90 1vkp h SER 253 Cb 0.80 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.17 1vkp h SER 253 CO 0.05 0.42 0.19 0.58 -1.14 0.00 0.00 176.83 176.93 1vkp h VAL 254 N 0.66 1.23 -0.63 2.27 2.07 -1.18 -0.72 116.25 119.94 1vkp h VAL 254 Ca 0.18 -0.75 -0.02 0.00 0.82 0.00 0.00 66.70 66.93 1vkp h VAL 254 Cb -0.07 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 30.38 1vkp h VAL 254 CO -0.04 0.28 0.32 -0.08 0.02 0.00 0.00 177.57 178.07 1vkp h GLU 255 N 0.74 0.90 -0.50 1.57 4.81 -1.23 -1.67 114.58 119.20 1vkp h GLU 255 Ca 0.18 -0.12 -0.07 0.00 -0.13 0.00 0.00 59.36 59.21 1vkp h GLU 255 Cb 0.25 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 1vkp h GLU 255 CO -0.01 0.71 0.04 0.00 -0.73 0.00 0.00 179.01 179.02 1vkp h ALA 256 N 1.15 0.66 -0.88 2.92 0.00 -0.99 -2.53 119.26 119.59 1vkp h ALA 256 Ca 0.22 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.88 1vkp h ALA 256 Cb 0.09 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 1vkp h ALA 256 CO -0.03 0.43 0.58 1.25 0.00 0.00 0.00 179.25 181.49 1vkp h LEU 257 N 0.72 1.00 -0.25 0.00 5.85 -0.89 -0.26 115.31 121.47 1vkp h LEU 257 Ca 0.15 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 1vkp h LEU 257 Cb 0.45 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 1vkp h LEU 257 CO 0.02 0.72 0.10 -1.28 -0.34 0.00 0.00 178.44 177.66 1vkp h SER 258 N 1.18 0.34 -0.03 1.25 0.87 -1.05 0.11 113.55 116.21 1vkp h SER 258 Ca 0.33 -0.15 0.01 0.00 -1.23 0.00 0.00 61.79 60.74 1vkp h SER 258 Cb -0.11 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 1vkp h SER 258 CO -0.08 0.40 -0.02 0.58 -0.53 0.00 0.00 176.83 177.19 1vkp h VAL 259 N 0.26 0.95 -0.75 2.23 2.07 -1.10 -2.92 116.25 116.97 1vkp h VAL 259 Ca 0.08 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.60 1vkp h VAL 259 Cb 0.16 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 1vkp h VAL 259 CO -0.01 0.00 0.47 -0.07 0.02 0.00 0.00 177.57 177.98 1vkp h LEU 260 N -0.02 0.89 -1.92 2.57 3.38 -0.87 -2.02 115.31 117.33 1vkp h LEU 260 Ca 0.02 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1vkp h LEU 260 Cb 0.04 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.57 1vkp h LEU 260 CO -0.04 0.67 0.00 0.28 0.09 0.00 0.00 178.44 179.44 1vkp h SER 261 N 1.03 0.00 -0.26 -0.43 0.02 -0.79 -1.61 113.55 111.51 1vkp h SER 261 Ca 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 1vkp h SER 261 Cb -0.07 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.47 1vkp h SER 261 CO -0.05 0.00 0.00 0.59 -1.14 0.00 0.00 176.83 176.23 1vkp n ASN 262 N -2.92 3.46 -4.86 3.07 3.02 -0.79 -4.92 115.26 111.31 1vkp n ASN 262 Ca -0.01 -2.70 -0.37 0.00 -0.03 0.00 0.00 54.58 51.48 1vkp n ASN 262 Cb 0.19 -0.43 -0.06 0.00 -0.61 0.00 0.00 39.78 38.87 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 -1.69 6.24 -0.11 6.41 0.01 -0.61 -5.06 113.70 118.89 1vkp s SER 263 Ca 0.35 0.43 0.03 0.00 1.31 0.00 0.00 55.95 58.06 1vkp s SER 263 Cb 0.26 -1.99 0.01 0.00 0.21 0.00 0.00 66.02 64.51 1vkp s SER 263 CO 0.10 0.40 -0.20 -0.63 0.41 0.00 0.00 173.24 173.33 1vkp s ILE 264 N -1.02 1.82 0.96 1.44 1.01 -1.26 -1.98 121.20 122.17 1vkp s ILE 264 Ca 0.15 -0.85 -0.16 0.00 0.00 0.00 0.00 60.65 59.78 1vkp s ILE 264 Cb -0.12 -1.62 0.23 0.00 0.01 0.00 0.00 42.46 40.96 1vkp s ILE 264 CO 0.04 0.51 1.19 -0.90 0.00 0.00 0.00 174.94 175.78 1vkp n ASP 265 N 3.94 -0.36 0.24 3.58 5.68 -0.22 -4.87 116.55 124.54 1vkp n ASP 265 Ca -0.20 -1.38 0.11 0.00 -0.50 0.00 0.00 54.79 52.82 1vkp n ASP 265 Cb 0.52 -0.94 0.62 0.00 -1.14 0.00 0.00 41.12 40.17 1vkp n ASP 265 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1vkp h ALA 266 N -2.00 1.24 -0.03 2.12 0.00 -1.84 -1.32 119.26 117.43 1vkp h ALA 266 Ca -0.40 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1vkp h ALA 266 Cb 1.12 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1vkp h ALA 266 CO 0.28 0.22 0.00 0.54 0.00 0.00 0.00 179.25 180.29 1vkp n ARG 267 N -3.65 1.85 -0.21 0.00 1.74 -1.26 -4.95 116.66 110.17 1vkp n ARG 267 Ca -0.01 -1.23 0.00 0.00 -0.77 0.00 0.00 57.85 55.83 1vkp n ARG 267 Cb 0.30 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.27 1vkp n ARG 267 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1vkp n GLY 268 N 1.22 0.89 3.80 -0.13 0.00 -0.50 -5.08 105.19 105.39 1vkp n GLY 268 Ca 0.18 -0.04 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.73 4.28 0.12 1.61 0.52 -1.26 -4.80 118.95 118.70 1vkp s ARG 269 Ca 0.00 0.81 -0.30 0.00 -0.52 0.00 0.00 55.73 55.72 1vkp s ARG 269 Cb 0.00 -3.26 -0.07 0.00 0.52 0.00 0.00 34.95 32.14 1vkp s ARG 269 CO 0.00 0.58 1.21 0.15 0.02 0.00 0.00 175.30 177.25 1vkp s LYS 270 N -0.94 4.46 0.22 3.54 1.02 -1.26 -1.06 119.74 125.71 1vkp s LYS 270 Ca 0.31 1.83 -0.30 0.00 0.02 0.00 0.00 55.97 57.83 1vkp s LYS 270 Cb -0.20 -3.29 -0.09 0.00 -0.52 0.00 0.00 37.83 33.73 1vkp s LYS 270 CO 0.20 -0.18 1.34 0.42 -0.92 0.00 0.00 175.35 176.21 1vkp s ILE 271 N 0.53 3.06 -0.12 2.17 -1.09 -0.84 -4.94 121.20 119.98 1vkp s ILE 271 Ca 0.56 0.88 -0.06 0.00 -2.23 0.00 0.00 60.65 59.81 1vkp s ILE 271 Cb -0.31 -3.56 -0.04 0.00 -1.58 0.00 0.00 42.46 36.96 1vkp s ILE 271 CO 0.33 0.14 0.11 -1.58 -1.23 0.00 0.00 174.94 172.70 1vkp s GLN 272 N -0.23 3.39 -0.14 2.79 0.74 -0.49 -4.78 119.66 120.95 1vkp s GLN 272 Ca 0.57 -0.19 0.00 0.00 0.05 0.00 0.00 55.36 55.79 1vkp s GLN 272 Cb -0.38 -3.12 -0.01 0.00 1.10 0.00 0.00 33.01 30.60 1vkp s GLN 272 CO 0.40 0.73 -0.14 0.08 -0.55 0.00 0.00 175.29 175.81 1vkp s VAL 273 N -0.91 2.84 -0.22 1.34 1.01 -1.26 -0.90 120.40 122.30 1vkp s VAL 273 Ca 0.14 -0.72 -0.06 0.00 0.00 0.00 0.00 61.98 61.34 1vkp s VAL 273 Cb -0.12 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 34.04 1vkp s VAL 273 CO 0.03 0.52 0.03 -0.63 0.00 0.00 0.00 175.10 175.05 1vkp s ILE 274 N 0.55 4.13 0.09 2.22 1.01 0.32 -4.98 121.20 124.54 1vkp s ILE 274 Ca -0.09 -0.25 -0.30 0.00 0.00 0.00 0.00 60.65 60.01 1vkp s ILE 274 Cb -0.16 -2.89 -0.06 0.00 0.01 0.00 0.00 42.46 39.36 1vkp s ILE 274 CO 0.04 0.40 1.05 -0.54 0.00 0.00 0.00 174.94 175.88 1vkp s LYS 275 N 1.19 4.59 -0.31 2.79 1.02 -1.26 -1.00 119.74 126.75 1vkp s LYS 275 Ca 0.04 1.58 0.03 0.00 0.02 0.00 0.00 55.97 57.63 1vkp s LYS 275 Cb -0.14 -3.36 0.09 0.00 -0.52 0.00 0.00 37.83 33.89 1vkp s LYS 275 CO 0.02 0.02 0.02 -1.17 -0.92 0.00 0.00 175.35 173.32 1vkp s LEU 276 N 0.35 3.85 0.12 3.17 2.96 -0.17 -4.88 118.68 124.08 1vkp s LEU 276 Ca 0.51 -1.82 -0.30 0.00 -0.22 0.00 0.00 54.13 52.30 1vkp s LEU 276 Cb -0.26 -1.43 -0.07 0.00 0.50 0.00 0.00 46.19 44.93 1vkp s LEU 276 CO 0.31 -0.34 1.23 -0.31 -1.32 0.00 0.00 176.35 175.92 1vkp s TYR 277 N 1.12 3.40 0.79 5.38 2.02 -1.26 -1.67 117.35 127.12 1vkp s TYR 277 Ca 0.05 1.29 -0.11 0.00 -0.37 0.00 0.00 57.07 57.93 1vkp s TYR 277 Cb -0.19 -3.47 0.07 0.00 -0.40 0.00 0.00 41.96 37.96 1vkp s TYR 277 CO -0.10 -1.46 1.11 0.96 -1.57 0.00 0.00 175.55 174.49 1vkp s ILE 278 N 0.61 2.98 0.93 2.71 -4.36 -0.60 -4.76 121.20 118.71 1vkp s ILE 278 Ca 0.57 0.34 -0.11 0.00 -0.26 0.00 0.00 60.65 61.20 1vkp s ILE 278 Cb -0.32 -2.74 0.15 0.00 1.25 0.00 0.00 42.46 40.80 1vkp s ILE 278 CO 0.32 -0.39 1.09 -2.16 0.24 0.00 0.00 174.94 174.05 1vkp s PRO 279 N -4.69 0.95 0.56 0.37 0.04 -1.26 -4.96 135.00 126.01 1vkp s PRO 279 Ca 0.64 1.07 -0.19 0.00 0.04 0.00 0.00 61.00 62.56 1vkp s PRO 279 Cb -0.19 -1.75 -0.07 0.00 0.04 0.00 0.00 34.50 32.52 1vkp s PRO 279 CO 0.54 -2.52 0.86 -0.85 0.04 0.00 0.00 177.00 175.07 1vkp n GLU 280 N -4.11 0.89 -1.63 4.56 0.28 -1.26 -4.79 120.64 114.58 1vkp n GLU 280 Ca 0.08 0.34 -0.48 0.00 -0.16 0.00 0.00 57.16 56.93 1vkp n GLU 280 Cb 0.54 -2.02 -0.05 0.00 1.43 0.00 0.00 31.44 31.34 1vkp n GLU 280 CO 0.00 0.00 0.00 -2.30 -0.16 0.00 0.00 177.13 174.67 1vkp n PRO 281 N -0.53 1.64 -4.70 3.44 -0.02 -1.26 -4.97 135.00 128.60 1vkp n PRO 281 Ca 0.12 0.59 -0.32 0.00 -2.02 0.00 0.00 63.50 61.87 1vkp n PRO 281 Cb 0.46 -2.26 -0.12 0.00 -0.02 0.00 0.00 33.50 31.56 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 0.60 2.87 0.00 2.45 1.43 -1.26 -5.07 118.68 119.69 1vkp s LEU 282 Ca 0.78 -0.21 0.00 0.00 -1.03 0.00 0.00 54.13 53.67 1vkp s LEU 282 Cb -0.80 -1.63 0.00 0.00 0.03 0.00 0.00 46.19 43.79 1vkp s LEU 282 CO 0.45 0.31 0.00 -1.22 0.23 0.00 0.00 176.35 176.12 1vkp n TYR 283 N 1.93 0.00 -4.13 0.29 4.02 -1.26 -0.86 117.16 117.15 1vkp n TYR 283 Ca -0.17 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.64 1vkp n TYR 283 Cb 0.52 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.74 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 3.52 0.37 0.33 -0.72 -4.23 -1.26 -4.81 115.64 108.83 1vkp s THR 285 Ca 0.00 -1.87 0.02 0.00 -1.18 0.00 0.00 61.69 58.66 1vkp s THR 285 Cb 0.00 -1.68 0.28 0.00 1.34 0.00 0.00 72.50 72.44 1vkp s THR 285 CO 0.00 -0.86 1.95 -0.08 -0.54 0.00 0.00 174.62 175.09 1vkp h GLU 286 N 3.03 0.91 -0.51 3.99 4.57 -1.95 -1.14 114.58 123.48 1vkp h GLU 286 Ca -0.35 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 57.77 1vkp h GLU 286 Cb 1.16 -0.21 -0.02 0.00 -0.16 0.00 0.00 28.75 29.52 1vkp h GLU 286 CO 0.64 0.60 0.29 1.49 -1.18 0.00 0.00 179.01 180.86 1vkp h GLU 287 N 0.94 0.71 -0.07 1.92 4.81 -2.02 -0.36 114.58 120.51 1vkp h GLU 287 Ca 0.33 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.48 1vkp h GLU 287 Cb 0.12 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.36 1vkp h GLU 287 CO -0.11 0.54 0.02 0.93 -0.73 0.00 0.00 179.01 179.66 1vkp h GLU 288 N 0.68 0.11 -0.45 1.92 5.08 -1.93 -3.12 114.58 116.87 1vkp h GLU 288 Ca 0.18 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.45 1vkp h GLU 288 Cb 0.02 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1vkp h GLU 288 CO -0.03 0.27 0.01 1.03 -1.00 0.00 0.00 179.01 179.28 1vkp h SER 289 N -0.07 0.70 0.79 1.42 0.87 -1.06 -2.41 113.55 113.78 1vkp h SER 289 Ca 0.02 -0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.43 1vkp h SER 289 Cb 0.20 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 61.98 1vkp h SER 289 CO -0.00 0.76 0.00 0.77 -0.53 0.00 0.00 176.83 177.83 1vkp h SER 290 N 0.69 0.00 -0.07 6.23 4.64 -1.00 -2.39 113.55 121.64 1vkp h SER 290 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1vkp h SER 290 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 1vkp h SER 290 CO 0.02 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.59 1vkp n GLY 291 N -0.04 -0.33 3.62 -0.77 0.00 -0.91 -4.83 105.19 101.93 1vkp n GLY 291 Ca 0.01 -0.29 -0.34 0.00 0.00 0.00 0.00 46.02 45.40 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 -1.91 4.17 0.12 -0.61 1.01 -0.90 -1.17 121.20 121.91 1vkp s ILE 292 Ca 0.33 -0.29 -0.30 0.00 0.00 0.00 0.00 60.65 60.39 1vkp s ILE 292 Cb 0.16 -2.77 -0.06 0.00 0.01 0.00 0.00 42.46 39.80 1vkp s ILE 292 CO 0.26 0.57 1.09 -0.89 0.00 0.00 0.00 174.94 175.97 1vkp s THR 293 N -0.49 4.11 -0.71 2.92 2.01 -0.55 -4.99 115.64 117.94 1vkp s THR 293 Ca 0.08 1.70 -0.15 0.00 0.31 0.00 0.00 61.69 63.63 1vkp s THR 293 Cb -0.12 -4.08 0.18 0.00 0.01 0.00 0.00 72.50 68.49 1vkp s THR 293 CO 0.02 0.23 0.66 -1.10 -0.69 0.00 0.00 174.62 173.75 1vkp s GLN 294 N 0.18 3.35 0.00 4.92 -0.21 -1.26 -4.14 119.66 122.50 1vkp s GLN 294 Ca 0.51 -2.14 0.10 0.00 0.02 0.00 0.00 55.36 53.85 1vkp s GLN 294 Cb -0.28 -4.38 -0.02 0.00 1.00 0.00 0.00 33.01 29.34 1vkp s GLN 294 CO 0.32 -1.31 0.59 -0.40 -2.12 0.00 0.00 175.29 172.37 1vkp n ASP 295 N 4.53 1.08 -0.73 5.90 5.68 -1.26 -5.02 116.55 126.73 1vkp n ASP 295 Ca 0.02 -1.04 -0.09 0.00 -0.50 0.00 0.00 54.79 53.18 1vkp n ASP 295 Cb 0.44 0.56 -0.04 0.00 -1.14 0.00 0.00 41.12 40.94 1vkp n ASP 295 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1vkp n GLY 296 N 0.94 1.11 0.01 6.12 0.00 -1.26 -4.86 105.19 107.25 1vkp n GLY 296 Ca 0.04 -0.59 0.11 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.70 0.39 -4.32 1.61 -0.58 -1.26 -4.96 120.64 108.82 1vkp n GLU 297 Ca -0.09 -0.11 -0.17 0.00 -0.42 0.00 0.00 57.16 56.36 1vkp n GLU 297 Cb 0.31 -1.51 -0.10 0.00 -0.57 0.00 0.00 31.44 29.58 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 -3.28 1.79 0.68 0.62 0.00 -1.26 -1.18 121.76 119.13 1vkp s ALA 298 Ca -0.01 -1.73 -0.14 0.00 0.00 0.00 0.00 51.96 50.09 1vkp s ALA 298 Cb 0.15 0.38 0.01 0.00 0.00 0.00 0.00 23.12 23.66 1vkp s ALA 298 CO 0.89 -0.21 1.09 0.96 0.00 0.00 0.00 175.76 178.49 1vkp s ILE 299 N -3.37 3.43 0.46 0.00 -4.36 -0.93 -4.90 121.20 111.54 1vkp s ILE 299 Ca 0.26 0.60 -0.24 0.00 -0.26 0.00 0.00 60.65 61.01 1vkp s ILE 299 Cb 0.05 -3.13 -0.07 0.00 1.25 0.00 0.00 42.46 40.55 1vkp s ILE 299 CO 0.08 -0.48 1.32 -2.84 0.24 0.00 0.00 174.94 173.26 1vkp s PRO 300 N -4.37 3.66 -0.30 0.37 0.02 -1.26 -4.96 135.00 128.15 1vkp s PRO 300 Ca 0.64 2.18 0.02 0.00 0.02 0.00 0.00 61.00 63.86 1vkp s PRO 300 Cb -0.18 -2.55 0.08 0.00 0.02 0.00 0.00 34.50 31.86 1vkp s PRO 300 CO 0.45 -0.75 -0.01 1.03 -0.33 0.00 0.00 177.00 177.39 1vkp s ARG 301 N -2.53 1.99 -0.06 5.54 1.81 -1.26 -5.11 118.95 119.34 1vkp s ARG 301 Ca 0.63 -1.55 0.03 0.00 -1.72 0.00 0.00 55.73 53.11 1vkp s ARG 301 Cb -0.38 -3.10 -0.03 0.00 -0.45 0.00 0.00 34.95 30.99 1vkp s ARG 301 CO 0.48 -0.74 -0.12 -0.51 -0.68 0.00 0.00 175.30 173.73 1vkp s LEU 302 N 1.06 2.85 0.23 2.53 1.43 -1.26 -4.76 118.68 120.75 1vkp s LEU 302 Ca -0.00 -0.16 -0.31 0.00 -1.03 0.00 0.00 54.13 52.63 1vkp s LEU 302 Cb -0.20 -1.59 -0.14 0.00 0.03 0.00 0.00 46.19 44.28 1vkp s LEU 302 CO -0.05 0.34 1.22 0.00 0.23 0.00 0.00 176.35 178.09 1vkp n ALA 303 N 2.35 0.09 0.00 4.21 0.00 -1.26 -2.49 120.51 123.41 1vkp n ALA 303 Ca -0.17 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.69 1vkp n ALA 303 Cb 0.52 -2.12 0.00 0.00 0.00 0.00 0.00 19.45 17.85 1vkp n ALA 303 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vkp n GLY 304 N 1.82 0.66 3.74 0.00 0.00 -1.26 -4.99 105.19 105.17 1vkp n GLY 304 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 1vkp n GLY 304 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vkp s THR 305 N -2.18 2.73 0.10 2.61 2.01 -1.04 -4.88 115.64 115.00 1vkp s THR 305 Ca 0.00 0.60 -0.31 0.00 0.31 0.00 0.00 61.69 62.29 1vkp s THR 305 Cb 0.00 -3.38 -0.09 0.00 0.01 0.00 0.00 72.50 69.04 1vkp s THR 305 CO 0.00 0.09 1.58 -0.60 -0.69 0.00 0.00 174.62 175.00 1vkp s ARG 306 N -0.14 4.22 0.14 4.92 6.06 -1.26 -4.23 118.95 128.67 1vkp s ARG 306 Ca 0.60 2.29 -0.25 0.00 -2.50 0.00 0.00 55.73 55.88 1vkp s ARG 306 Cb -0.41 -3.40 -0.08 0.00 0.06 0.00 0.00 34.95 31.13 1vkp s ARG 306 CO 0.41 -0.65 0.76 -0.51 -2.50 0.00 0.00 175.30 172.81 1vkp s LEU 307 N 1.91 4.57 -1.27 -0.88 1.43 -0.04 -4.83 118.68 119.57 1vkp s LEU 307 Ca 0.71 1.59 -0.14 0.00 -1.03 0.00 0.00 54.13 55.25 1vkp s LEU 307 Cb -0.40 -3.25 0.13 0.00 0.03 0.00 0.00 46.19 42.69 1vkp s LEU 307 CO 0.31 0.19 1.68 0.00 0.23 0.00 0.00 176.35 178.76 1vkp n ALA 308 N 1.78 4.23 -3.13 4.21 0.00 -1.26 -4.73 120.51 121.61 1vkp n ALA 308 Ca -0.06 -4.11 -0.36 0.00 0.00 0.00 0.00 53.44 48.91 1vkp n ALA 308 Cb 0.49 -3.24 -0.13 0.00 0.00 0.00 0.00 19.45 16.57 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 2.24 3.11 -0.07 0.00 0.00 -1.26 -4.87 121.76 120.90 1vkp s ALA 309 Ca 0.46 -1.17 -0.07 0.00 0.00 0.00 0.00 51.96 51.18 1vkp s ALA 309 Cb 0.03 -2.04 0.02 0.00 0.00 0.00 0.00 23.12 21.12 1vkp s ALA 309 CO 0.01 -0.53 0.19 0.45 0.00 0.00 0.00 175.76 175.88 1vkp s SER 310 N 1.59 -0.20 0.16 0.00 0.15 -1.26 -4.46 113.70 109.68 1vkp s SER 310 Ca 0.06 0.38 0.20 0.00 0.70 0.00 0.00 55.95 57.29 1vkp s SER 310 Cb -0.15 0.39 0.85 0.00 -1.71 0.00 0.00 66.02 65.40 1vkp s SER 310 CO 0.03 -0.07 1.62 -1.22 1.20 0.00 0.00 173.24 174.80 1vkp n TYR 311 N 2.94 0.52 0.28 3.44 4.01 -1.26 -2.37 117.16 124.72 1vkp n TYR 311 Ca -0.13 0.20 0.15 0.00 -0.16 0.00 0.00 57.90 57.96 1vkp n TYR 311 Cb 0.59 -0.83 0.82 0.00 -0.31 0.00 0.00 39.34 39.61 1vkp n TYR 311 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1vkp h VAL 312 N 0.00 0.44 -0.08 -0.72 2.07 -1.89 -3.24 116.25 112.83 1vkp h VAL 312 Ca 0.00 -0.37 -0.32 0.00 0.82 0.00 0.00 66.70 66.83 1vkp h VAL 312 Cb 0.33 1.25 -0.05 0.00 -1.52 0.00 0.00 31.29 31.29 1vkp h VAL 312 CO 0.00 0.07 0.62 -3.20 0.02 0.00 0.00 177.57 175.08 1vkp n ASN 313 N -3.56 6.12 -4.98 0.57 5.15 -1.00 -4.87 115.26 112.70 1vkp n ASN 313 Ca -0.02 -2.55 -0.21 0.00 -0.60 0.00 0.00 54.58 51.21 1vkp n ASN 313 Cb 0.19 -1.44 0.01 0.00 -0.53 0.00 0.00 39.78 38.01 1vkp n ASN 313 CO 0.00 0.00 0.00 0.72 1.40 0.00 0.00 177.26 179.38 1vkp s PHE 314 N 1.07 3.11 -0.04 1.20 -0.12 -1.23 -2.30 117.98 119.67 1vkp s PHE 314 Ca 0.67 -0.03 0.05 0.00 -0.05 0.00 0.00 56.93 57.57 1vkp s PHE 314 Cb 0.29 -2.23 -0.02 0.00 -0.63 0.00 0.00 43.02 40.43 1vkp s PHE 314 CO -0.03 -0.27 -0.20 -0.47 -0.05 0.00 0.00 175.22 174.21 1vkp s TYR 315 N -2.40 2.54 -0.26 3.49 5.04 -0.57 -4.35 117.35 120.84 1vkp s TYR 315 Ca 0.48 -0.31 -0.12 0.00 -2.44 0.00 0.00 57.07 54.68 1vkp s TYR 315 Cb -0.10 -1.58 -0.05 0.00 0.35 0.00 0.00 41.96 40.59 1vkp s TYR 315 CO 0.35 0.07 0.24 0.42 -1.34 0.00 0.00 175.55 175.28 1vkp s ILE 316 N -0.63 5.29 0.48 3.14 1.01 -1.26 -0.61 121.20 128.61 1vkp s ILE 316 Ca 0.10 0.30 0.05 0.00 0.00 0.00 0.00 60.65 61.10 1vkp s ILE 316 Cb -0.11 -3.57 -0.01 0.00 0.01 0.00 0.00 42.46 38.78 1vkp s ILE 316 CO 0.00 0.26 0.19 0.00 0.00 0.00 0.00 174.94 175.39 1vkp s ALA 317 N 1.58 3.99 -0.60 9.38 0.00 -0.04 -4.81 121.76 131.25 1vkp s ALA 317 Ca 0.10 -1.33 -0.26 0.00 0.00 0.00 0.00 51.96 50.47 1vkp s ALA 317 Cb -0.15 -0.33 -0.08 0.00 0.00 0.00 0.00 23.12 22.56 1vkp s ALA 317 CO 0.09 -0.21 2.32 -0.80 0.00 0.00 0.00 175.76 177.16 1vkp s ASN 318 N -4.00 4.43 0.00 0.00 0.01 -1.26 -2.02 114.94 112.10 1vkp s ASN 318 Ca 0.28 0.65 0.00 0.00 -0.71 0.00 0.00 52.86 53.08 1vkp s ASN 318 Cb 0.02 -2.52 0.00 0.00 0.41 0.00 0.00 41.25 39.16 1vkp s ASN 318 CO 0.16 -3.06 0.00 0.61 -1.51 0.00 0.00 177.10 173.30 1vkp n GLY 319 N 6.21 0.75 3.07 0.66 0.00 -1.26 -4.74 105.19 109.88 1vkp n GLY 319 Ca 0.37 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.28 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 -1.89 0.51 -0.13 -0.02 0.00 -0.86 -1.07 107.32 103.86 1vkp s GLY 320 Ca 0.00 -0.86 0.02 0.00 0.00 0.00 0.00 44.72 43.88 1vkp s GLY 320 CO 0.00 -0.93 -0.21 -0.42 0.00 0.00 0.00 173.10 171.55 1vkp s ILE 321 N -1.88 1.94 -0.38 0.90 -1.09 -0.25 -0.86 121.20 119.59 1vkp s ILE 321 Ca -0.06 -0.91 -0.07 0.00 -2.23 0.00 0.00 60.65 57.38 1vkp s ILE 321 Cb -0.07 -1.73 0.07 0.00 -1.58 0.00 0.00 42.46 39.15 1vkp s ILE 321 CO -0.01 0.53 0.17 -0.63 -1.23 0.00 0.00 174.94 173.77 1vkp s ILE 322 N 0.86 3.81 0.07 2.92 -1.09 0.22 -0.66 121.20 127.33 1vkp s ILE 322 Ca -0.07 -1.40 0.09 0.00 -2.23 0.00 0.00 60.65 57.05 1vkp s ILE 322 Cb -0.15 -3.30 -0.03 0.00 -1.58 0.00 0.00 42.46 37.40 1vkp s ILE 322 CO -0.02 -0.38 -0.23 0.00 -1.23 0.00 0.00 174.94 173.09 1vkp s ALA 323 N 1.36 2.44 0.54 9.38 0.00 0.03 -1.51 121.76 134.01 1vkp s ALA 323 Ca 0.01 -1.29 -0.18 0.00 0.00 0.00 0.00 51.96 50.50 1vkp s ALA 323 Cb -0.21 -0.57 -0.06 0.00 0.00 0.00 0.00 23.12 22.28 1vkp s ALA 323 CO 0.01 0.56 1.07 -1.25 0.00 0.00 0.00 175.76 176.15 1vkp s PRO 324 N -1.58 3.46 -0.12 0.00 0.04 -1.26 -0.52 135.00 135.03 1vkp s PRO 324 Ca 0.14 1.39 0.02 0.00 0.04 0.00 0.00 61.00 62.60 1vkp s PRO 324 Cb -0.10 -2.04 0.01 0.00 0.04 0.00 0.00 34.50 32.41 1vkp s PRO 324 CO 0.05 -0.72 -0.19 -0.65 0.04 0.00 0.00 177.00 175.53 1vkp s GLN 325 N -3.54 2.62 0.00 4.56 -1.52 -0.68 -4.71 119.66 116.39 1vkp s GLN 325 Ca 0.68 -0.71 0.20 0.00 -1.95 0.00 0.00 55.36 53.58 1vkp s GLN 325 Cb -0.19 -2.13 -0.03 0.00 -0.22 0.00 0.00 33.01 30.44 1vkp s GLN 325 CO 0.28 -0.01 0.97 1.19 -0.25 0.00 0.00 175.29 177.48 1vkp n PHE 326 N 4.05 0.00 -0.16 0.91 3.01 -1.26 -2.59 117.46 121.41 1vkp n PHE 326 Ca -0.20 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.26 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 1.32 0.62 3.43 1.37 0.00 -1.26 -4.68 105.19 106.00 1vkp n GLY 327 Ca 0.08 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.88 6.19 0.45 1.61 3.68 -1.26 -4.94 116.67 119.51 1vkp s ASP 328 Ca 0.00 -1.07 0.15 0.00 2.13 0.00 0.00 52.55 53.76 1vkp s ASP 328 Cb 0.00 -2.38 1.01 0.00 -1.45 0.00 0.00 42.92 40.10 1vkp s ASP 328 CO 0.00 -1.30 1.99 -0.65 0.13 0.00 0.00 175.17 175.34 1vkp h PRO 329 N 9.40 0.00 0.10 4.34 0.11 -1.98 0.72 132.00 144.69 1vkp h PRO 329 Ca -0.29 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.82 1vkp h PRO 329 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1vkp h PRO 329 CO 1.14 0.18 -0.05 0.82 -0.21 0.00 0.00 178.00 179.88 1vkp h ILE 330 N 0.00 1.06 0.00 4.15 2.04 -2.00 -2.88 117.51 119.87 1vkp h ILE 330 Ca -0.00 -1.35 -0.10 0.00 1.00 0.00 0.00 64.86 64.41 1vkp h ILE 330 Cb 0.32 1.82 -0.01 0.00 -0.74 0.00 0.00 36.82 38.21 1vkp h ILE 330 CO 0.02 0.29 -0.46 0.03 0.00 0.00 0.00 178.15 178.03 1vkp h ARG 331 N -0.84 0.00 -0.46 2.37 2.47 -1.91 -1.97 114.38 114.04 1vkp h ARG 331 Ca -0.01 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.68 1vkp h ARG 331 Cb 0.58 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.88 1vkp h ARG 331 CO 0.02 0.46 0.17 -0.44 0.56 0.00 0.00 179.97 180.74 1vkp h ASP 332 N 0.00 0.65 -0.32 7.04 3.32 -0.94 -0.11 116.42 126.06 1vkp h ASP 332 Ca -0.00 -0.19 -0.13 0.00 0.02 0.00 0.00 57.03 56.73 1vkp h ASP 332 Cb 0.89 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.26 1vkp h ASP 332 CO 0.06 0.66 -0.30 0.50 -1.72 0.00 0.00 179.24 178.44 1vkp h LYS 333 N 0.60 0.77 -0.70 3.56 3.64 -1.35 -2.75 116.57 120.34 1vkp h LYS 333 Ca 0.15 -0.40 -0.04 0.00 -1.27 0.00 0.00 60.65 59.09 1vkp h LYS 333 Cb 0.23 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 1vkp h LYS 333 CO -0.01 1.03 0.28 1.49 -2.27 0.00 0.00 179.45 179.97 1vkp h GLU 334 N 0.54 1.04 -0.58 1.90 4.57 -1.19 -1.21 114.58 119.65 1vkp h GLU 334 Ca 0.05 -0.18 -0.06 0.00 -1.18 0.00 0.00 59.36 58.00 1vkp h GLU 334 Cb 0.88 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 29.27 1vkp h GLU 334 CO 0.08 0.84 0.14 0.00 -1.18 0.00 0.00 179.01 178.89 1vkp h ALA 335 N 1.29 0.76 -0.82 2.92 0.00 -0.94 -0.05 119.26 122.42 1vkp h ALA 335 Ca 0.24 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1vkp h ALA 335 Cb 0.19 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 1vkp h ALA 335 CO -0.02 0.47 0.42 0.82 0.00 0.00 0.00 179.25 180.93 1vkp h ILE 336 N 0.83 1.25 -0.14 0.00 1.08 -1.15 -0.07 117.51 119.32 1vkp h ILE 336 Ca 0.18 -0.67 0.00 0.00 -0.39 0.00 0.00 64.86 63.98 1vkp h ILE 336 Cb 0.34 0.18 -0.01 0.00 -3.07 0.00 0.00 36.82 34.27 1vkp h ILE 336 CO 0.00 0.29 0.09 -0.09 -0.69 0.00 0.00 178.15 177.75 1vkp h ARG 337 N 1.15 0.18 -0.16 2.37 2.43 -0.68 -0.15 114.38 119.52 1vkp h ARG 337 Ca 0.28 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.43 1vkp h ARG 337 Cb 0.08 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 1vkp h ARG 337 CO -0.04 0.14 0.05 0.28 -1.51 0.00 0.00 179.97 178.90 1vkp h VAL 338 N 0.17 1.18 -0.69 0.20 2.07 -0.81 -1.67 116.25 116.70 1vkp h VAL 338 Ca 0.05 -0.55 -0.01 0.00 0.82 0.00 0.00 66.70 67.01 1vkp h VAL 338 Cb 0.00 1.23 -0.03 0.00 -1.52 0.00 0.00 31.29 30.97 1vkp h VAL 338 CO -0.01 0.17 0.37 -0.07 0.02 0.00 0.00 177.57 178.05 1vkp h LEU 339 N 0.09 0.86 -0.85 2.57 3.38 -0.93 -0.73 115.31 119.71 1vkp h LEU 339 Ca 0.05 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 1vkp h LEU 339 Cb 0.21 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1vkp h LEU 339 CO -0.00 0.70 -0.02 0.28 0.09 0.00 0.00 178.44 179.49 1vkp h SER 340 N 0.97 0.82 -0.04 -0.43 0.02 -0.76 -0.78 113.55 113.35 1vkp h SER 340 Ca 0.25 -0.21 -0.15 0.00 -0.84 0.00 0.00 61.79 60.83 1vkp h SER 340 Cb 0.04 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 1vkp h SER 340 CO -0.04 0.89 -0.49 -0.78 -1.14 0.00 0.00 176.83 175.28 1vkp h ASP 341 N 0.78 0.65 0.85 3.07 1.82 -1.00 -3.20 116.42 119.39 1vkp h ASP 341 Ca 0.15 -0.32 -0.17 0.00 -0.39 0.00 0.00 57.03 56.30 1vkp h ASP 341 Cb 0.49 -0.18 -0.02 0.00 0.68 0.00 0.00 39.33 40.30 1vkp h ASP 341 CO 0.02 1.03 -0.80 0.74 -1.61 0.00 0.00 179.24 178.62 1vkp h THR 342 N 0.47 1.55 -2.20 2.25 2.02 -0.79 -3.36 112.91 112.85 1vkp h THR 342 Ca 0.02 -2.77 -0.60 0.00 0.77 0.00 0.00 66.41 63.83 1vkp h THR 342 Cb 1.02 2.51 -0.42 0.00 -1.74 0.00 0.00 68.15 69.52 1vkp h THR 342 CO 0.09 0.79 -0.61 0.49 0.37 0.00 0.00 175.52 176.65 1vkp n PHE 343 N -3.54 3.64 0.35 3.16 3.01 -0.33 -4.94 117.46 118.81 1vkp n PHE 343 Ca -0.00 -4.12 0.12 0.00 1.01 0.00 0.00 57.45 54.46 1vkp n PHE 343 Cb 0.78 -0.54 0.51 0.00 -0.01 0.00 0.00 39.48 40.22 1vkp n PHE 343 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1vkp n PRO 344 N 0.65 0.18 -0.39 -1.08 -0.04 -1.21 -1.68 135.00 131.44 1vkp n PRO 344 Ca 0.30 0.46 0.11 0.00 -0.04 0.00 0.00 63.50 64.33 1vkp n PRO 344 Cb 0.41 -1.89 0.32 0.00 -0.04 0.00 0.00 33.50 32.30 1vkp n PRO 344 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1vkp n HIS 345 N -2.24 1.00 -4.40 0.54 8.25 -1.26 -4.94 115.22 112.17 1vkp n HIS 345 Ca 0.01 -0.51 -0.27 0.00 -0.26 0.00 0.00 57.72 56.69 1vkp n HIS 345 Cb 0.19 -0.03 -0.12 0.00 1.12 0.00 0.00 29.99 31.16 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 -1.08 2.25 -0.29 4.41 3.76 -0.67 -4.82 115.29 118.85 1vkp s HIS 346 Ca 0.48 -0.37 -0.18 0.00 -0.15 0.00 0.00 55.06 54.84 1vkp s HIS 346 Cb 0.26 -1.15 -0.02 0.00 1.11 0.00 0.00 32.58 32.77 1vkp s HIS 346 CO 0.32 0.43 0.51 0.45 -0.85 0.00 0.00 174.74 175.60 1vkp s SER 347 N -2.45 6.40 -0.18 1.40 0.15 -0.24 -4.88 113.70 113.91 1vkp s SER 347 Ca 0.18 0.37 -0.23 0.00 0.70 0.00 0.00 55.95 56.97 1vkp s SER 347 Cb -0.08 -2.28 -0.02 0.00 -1.71 0.00 0.00 66.02 61.93 1vkp s SER 347 CO 0.08 -0.34 0.73 -0.69 1.20 0.00 0.00 173.24 174.22 1vkp s VAL 348 N 2.34 4.96 -0.11 4.45 1.01 -1.26 -1.09 120.40 130.71 1vkp s VAL 348 Ca 0.21 1.41 0.04 0.00 0.00 0.00 0.00 61.98 63.63 1vkp s VAL 348 Cb -0.15 -4.04 0.00 0.00 0.00 0.00 0.00 36.38 32.19 1vkp s VAL 348 CO 0.10 0.08 -0.24 -0.69 0.00 0.00 0.00 175.10 174.36 1vkp s VAL 349 N 1.94 2.06 -0.14 2.92 1.01 0.17 -4.96 120.40 123.40 1vkp s VAL 349 Ca 0.34 -1.01 -0.12 0.00 0.00 0.00 0.00 61.98 61.18 1vkp s VAL 349 Cb -0.16 -1.79 -0.05 0.00 0.00 0.00 0.00 36.38 34.38 1vkp s VAL 349 CO 0.12 0.56 0.27 -0.83 0.00 0.00 0.00 175.10 175.21 1vkp s GLY 350 N 0.43 2.22 -0.38 4.51 0.00 -1.26 -0.79 107.32 112.04 1vkp s GLY 350 Ca -0.17 -0.48 -0.17 0.00 0.00 0.00 0.00 44.72 43.90 1vkp s GLY 350 CO 0.07 0.24 0.45 -0.42 0.00 0.00 0.00 173.10 173.43 1vkp s ILE 351 N 0.03 5.08 0.58 0.90 -1.09 0.32 -4.92 121.20 122.10 1vkp s ILE 351 Ca 0.16 -0.04 -0.18 0.00 -2.23 0.00 0.00 60.65 58.35 1vkp s ILE 351 Cb -0.13 -3.97 -0.04 0.00 -1.58 0.00 0.00 42.46 36.74 1vkp s ILE 351 CO 0.04 -0.29 1.14 -1.61 -1.23 0.00 0.00 174.94 173.00 1vkp s GLU 352 N 2.21 3.15 -1.63 2.79 0.41 -1.26 -1.69 118.70 122.67 1vkp s GLU 352 Ca 0.14 1.61 0.00 0.00 -0.41 0.00 0.00 54.97 56.31 1vkp s GLU 352 Cb -0.16 -1.98 0.00 0.00 -1.78 0.00 0.00 34.13 30.21 1vkp s GLU 352 CO 0.13 -1.01 0.00 0.09 -0.49 0.00 0.00 175.26 173.98 1vkp n ASN 353 N -1.60 -5.18 0.32 -0.19 5.03 -1.25 -4.89 115.26 107.51 1vkp n ASN 353 Ca 0.12 0.12 0.20 0.00 0.87 0.00 0.00 54.58 55.89 1vkp n ASN 353 Cb 0.51 -4.25 1.12 0.00 -1.02 0.00 0.00 39.78 36.14 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 0.59 1.18 -0.93 5.41 0.00 -1.52 -1.06 119.26 122.92 1vkp h ALA 354 Ca -0.41 -0.00 0.24 0.00 0.00 0.00 0.00 54.91 54.74 1vkp h ALA 354 Cb 1.27 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.00 1vkp h ALA 354 CO 0.51 -0.02 0.63 -0.09 0.00 0.00 0.00 179.25 180.28 1vkp h ARG 355 N 0.00 0.26 -0.07 0.00 2.43 -1.84 -0.81 114.38 114.35 1vkp h ARG 355 Ca 0.00 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 1vkp h ARG 355 Cb 0.03 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 1vkp h ARG 355 CO -0.00 0.17 -0.02 0.93 -1.51 0.00 0.00 179.97 179.54 1vkp h GLU 356 N 0.26 0.09 0.05 0.20 4.39 -1.58 -1.70 114.58 116.31 1vkp h GLU 356 Ca 0.48 -0.01 -0.23 0.00 0.34 0.00 0.00 59.36 59.94 1vkp h GLU 356 Cb 1.43 -0.02 0.02 0.00 -0.10 0.00 0.00 28.75 30.08 1vkp h GLU 356 CO -0.14 0.13 -0.92 0.82 -1.16 0.00 0.00 179.01 177.74 1vkp h ILE 357 N 0.10 1.36 0.00 3.13 2.04 -1.34 -3.31 117.51 119.48 1vkp h ILE 357 Ca 0.02 -2.29 -0.03 0.00 1.00 0.00 0.00 64.86 63.57 1vkp h ILE 357 Cb 0.10 2.66 -0.00 0.00 -0.74 0.00 0.00 36.82 38.84 1vkp h ILE 357 CO 0.00 0.68 -0.15 1.62 0.00 0.00 0.00 178.15 180.30 1vkp h VAL 358 N 0.08 0.63 -0.02 1.67 3.04 -0.75 -1.68 116.25 119.22 1vkp h VAL 358 Ca -0.13 -0.67 0.00 0.00 -1.01 0.00 0.00 66.70 64.89 1vkp h VAL 358 Cb 1.62 1.43 -0.00 0.00 -2.01 0.00 0.00 31.29 32.32 1vkp h VAL 358 CO 0.18 0.15 0.02 -0.07 -1.01 0.00 0.00 177.57 176.84 1vkp h LEU 359 N 0.00 0.00 -2.22 3.16 3.38 -1.42 -2.03 115.31 116.18 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 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1vkp h LEU 359 CO 0.02 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.55 1vkp n ALA 360 N -2.30 2.38 0.00 1.53 0.00 -0.64 -4.97 120.51 116.50 1vkp n ALA 360 Ca -0.03 -0.92 0.00 0.00 0.00 0.00 0.00 53.44 52.50 1vkp n ALA 360 Cb 0.10 -0.64 0.00 0.00 0.00 0.00 0.00 19.45 18.91 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 1.04 1.30 0.00 0.00 0.00 -0.76 -5.08 105.19 101.69 1vkp n GLY 361 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 -1.34 2.54 0.00 -0.02 0.00 -1.20 -5.00 105.19 100.16 1vkp n GLY 362 Ca 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.97 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 -1.00 0.00 -0.20 1.61 2.85 -1.26 -1.89 115.26 115.36 1vkp n ASN 363 Ca 0.00 -0.52 -0.01 0.00 -0.11 0.00 0.00 54.58 53.93 1vkp n ASN 363 Cb 0.00 0.00 0.09 0.00 1.24 0.00 0.00 39.78 41.11 1vkp n ASN 363 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 1vkp h ILE 364 N 0.52 0.86 -0.43 -1.44 2.04 -1.92 -1.16 117.51 115.98 1vkp h ILE 364 Ca 0.00 -0.17 -0.02 0.00 1.00 0.00 0.00 64.86 65.67 1vkp h ILE 364 Cb 0.00 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 36.38 1vkp h ILE 364 CO 0.00 0.09 0.19 -0.74 0.00 0.00 0.00 178.15 177.69 1vkp h HIS 365 N 0.50 0.60 0.00 1.37 2.76 -1.66 -2.60 115.15 116.12 1vkp h HIS 365 Ca 0.29 -0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.42 1vkp h HIS 365 Cb 0.28 -0.19 -0.00 0.00 1.55 0.00 0.00 27.41 29.04 1vkp h HIS 365 CO -0.13 0.46 -0.10 0.00 -1.30 0.00 0.00 177.93 176.86 1vkp n ILE 367 N -3.29 0.00 -4.33 0.00 -5.35 -0.98 -2.25 119.36 103.16 1vkp n ILE 367 Ca -0.00 -0.40 -0.24 0.00 -0.27 0.00 0.00 62.75 61.83 1vkp n ILE 367 Cb 0.32 1.21 -0.08 0.00 -1.74 0.00 0.00 39.64 39.35 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 -2.07 3.18 -0.18 7.28 -4.23 -1.18 -4.04 115.64 114.40 1vkp s THR 368 Ca 0.29 -1.95 -0.04 0.00 -1.18 0.00 0.00 61.69 58.80 1vkp s THR 368 Cb 0.20 -2.67 0.09 0.00 1.34 0.00 0.00 72.50 71.46 1vkp s THR 368 CO 0.35 -0.31 0.30 -1.58 -0.54 0.00 0.00 174.62 172.83 1vkp s GLN 369 N -3.43 0.23 0.34 3.99 2.00 -0.38 -2.71 119.66 119.70 1vkp s GLN 369 Ca 0.29 0.62 -0.27 0.00 -2.00 0.00 0.00 55.36 54.01 1vkp s GLN 369 Cb -0.07 -0.34 -0.09 0.00 0.80 0.00 0.00 33.01 33.31 1vkp s GLN 369 CO 0.18 -0.44 1.10 1.14 -0.50 0.00 0.00 175.29 176.77 1vkp s GLN 370 N 2.46 4.40 -0.38 1.67 0.00 -1.26 -1.26 119.66 125.29 1vkp s GLN 370 Ca 0.05 1.73 -0.07 0.00 -0.00 0.00 0.00 55.36 57.07 1vkp s GLN 370 Cb -0.14 -2.91 0.06 0.00 0.00 0.00 0.00 33.01 30.02 1vkp s GLN 370 CO -0.12 0.01 0.17 -1.14 0.00 0.00 0.00 175.29 174.22 1vkp s GLN 371 N -1.90 2.57 0.58 9.60 0.74 0.01 -4.66 119.66 126.60 1vkp s GLN 371 Ca 0.51 -1.33 -0.20 0.00 0.05 0.00 0.00 55.36 54.38 1vkp s GLN 371 Cb -0.29 -3.60 -0.04 0.00 1.10 0.00 0.00 33.01 30.18 1vkp s GLN 371 CO 0.37 -0.81 1.21 -2.30 -0.55 0.00 0.00 175.29 173.21 1vkp n PRO 372 N 4.84 1.30 -1.81 1.67 -0.02 -1.26 -0.22 135.00 139.50 1vkp n PRO 372 Ca -0.11 0.49 -0.41 0.00 -2.02 0.00 0.00 63.50 61.45 1vkp n PRO 372 Cb 0.44 -2.42 -0.01 0.00 -0.02 0.00 0.00 33.50 31.49 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 -1.37 3.62 -0.22 3.55 0.00 -0.11 -4.01 121.76 123.22 1vkp s ALA 373 Ca 0.75 1.56 -0.29 0.00 0.00 0.00 0.00 51.96 53.98 1vkp s ALA 373 Cb -0.42 -3.62 -0.00 0.00 0.00 0.00 0.00 23.12 19.08 1vkp s ALA 373 CO 0.47 -1.02 1.21 -2.00 0.00 0.00 0.00 175.76 174.42 1vkp s GLU 374 N -1.65 4.16 0.60 0.00 2.12 -1.26 -4.91 118.70 117.76 1vkp s GLU 374 Ca 0.55 1.47 -0.20 0.00 0.36 0.00 0.00 54.97 57.16 1vkp s GLU 374 Cb -0.47 -3.76 -0.03 0.00 0.26 0.00 0.00 34.13 30.13 1vkp s GLU 374 CO 0.59 -0.79 1.33 -2.30 -0.54 0.00 0.00 175.26 173.55 1vkp n PRO 375 N 6.72 1.42 0.00 4.30 -0.02 -1.26 -5.04 135.00 141.12 1vkp n PRO 375 Ca 0.14 0.54 0.07 0.00 -2.02 0.00 0.00 63.50 62.22 1vkp n PRO 375 Cb 0.46 -2.56 0.42 0.00 -0.02 0.00 0.00 33.50 31.79 1vkp n PRO 375 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11