#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w2k s ASN 2 N 0.00 3.35 0.87 0.00 0.01 -1.26 -4.97 114.94 112.93 1w2k s ASN 2 Ca 0.00 -1.15 -0.02 0.00 -0.71 0.00 0.00 52.86 50.97 1w2k s ASN 2 Cb 0.00 -0.61 0.04 0.00 0.41 0.00 0.00 41.25 41.09 1w2k s ASN 2 CO 0.00 -0.37 0.22 0.00 -1.51 0.00 0.00 177.10 175.45 1w2k n ALA 3 N 5.04 -0.20 -2.29 0.60 0.00 -1.26 -4.98 120.51 117.42 1w2k n ALA 3 Ca -0.06 -0.32 -0.43 0.00 0.00 0.00 0.00 53.44 52.63 1w2k n ALA 3 Cb 0.45 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.87 1w2k n ALA 3 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1w2k s PHE 4 N -1.25 2.52 0.20 0.00 5.36 -1.26 -5.01 117.98 118.54 1w2k s PHE 4 Ca 0.13 0.74 0.00 0.00 -0.96 0.00 0.00 56.93 56.84 1w2k s PHE 4 Cb -0.00 -3.74 0.00 0.00 -0.34 0.00 0.00 43.02 38.94 1w2k s PHE 4 CO 0.09 -2.34 0.00 1.28 -1.46 0.00 0.00 175.22 172.80 1w2k n LEU 5 N 7.21 -4.81 0.00 6.12 4.77 -1.26 -5.13 117.00 123.90 1w2k n LEU 5 Ca 0.16 2.15 0.00 0.00 -0.03 0.00 0.00 56.01 58.28 1w2k n LEU 5 Cb 0.45 -2.06 0.00 0.00 -2.33 0.00 0.00 43.42 39.48 1w2k n LEU 5 CO 0.60 -0.78 0.00 0.18 -1.33 0.00 0.00 177.39 176.06 1w2k n LEU 8 N 0.70 0.00 -4.79 2.23 4.32 -1.26 -5.11 117.00 113.09 1w2k n LEU 8 Ca 0.00 0.00 -0.35 0.00 -0.02 0.00 0.00 56.01 55.64 1w2k n LEU 8 Cb 0.00 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 41.77 1w2k n LEU 8 CO 0.00 0.00 0.73 -0.13 -1.22 0.00 0.00 177.39 176.77 1w2k s ARG 9 N -0.04 3.78 1.05 3.23 0.52 -1.26 -5.02 118.95 121.20 1w2k s ARG 9 Ca 0.00 1.44 -0.13 0.00 -0.52 0.00 0.00 55.73 56.53 1w2k s ARG 9 Cb 0.00 -2.16 0.22 0.00 0.52 0.00 0.00 34.95 33.53 1w2k s ARG 9 CO 0.00 -0.46 1.08 -2.14 0.02 0.00 0.00 175.30 173.79 1w2k s PRO 10 N -3.11 0.02 0.37 3.54 0.02 -1.26 -4.95 135.00 129.63 1w2k s PRO 10 Ca 0.67 0.58 -0.27 0.00 0.02 0.00 0.00 61.00 62.00 1w2k s PRO 10 Cb -0.19 -1.68 -0.10 0.00 0.02 0.00 0.00 34.50 32.55 1w2k s PRO 10 CO 0.23 -3.03 1.32 0.20 -0.33 0.00 0.00 177.00 175.39 1w2k s GLY 11 N -3.21 2.96 -0.21 0.52 0.00 -1.26 -5.02 107.32 101.09 1w2k s GLY 11 Ca 0.66 1.27 -0.04 0.00 0.00 0.00 0.00 44.72 46.61 1w2k s GLY 11 CO 0.59 1.89 0.17 -0.45 0.00 0.00 0.00 173.10 175.30 1w2k s SER 12 N -0.59 2.09 0.00 1.64 0.15 -1.26 -5.01 113.70 110.72 1w2k s SER 12 Ca 0.53 -0.58 0.00 0.00 0.70 0.00 0.00 55.95 56.60 1w2k s SER 12 Cb -0.39 0.06 0.00 0.00 -1.71 0.00 0.00 66.02 63.97 1w2k s SER 12 CO 0.52 -0.36 0.00 -0.11 1.20 0.00 0.00 173.24 174.49 1w2k n LEU 13 N 5.29 0.00 0.00 3.45 7.94 -1.26 -4.28 117.00 128.14 1w2k n LEU 13 Ca -0.06 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.84 1w2k n LEU 13 Cb 0.48 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.43 1w2k n LEU 13 CO 0.07 0.00 0.00 -1.14 -1.11 0.00 0.00 177.39 175.21 1w2k n ARG 15 N 0.32 0.00 -0.03 1.96 0.63 -1.26 -2.33 116.66 115.94 1w2k n ARG 15 Ca 0.00 0.00 0.03 0.00 -0.92 0.00 0.00 57.85 56.96 1w2k n ARG 15 Cb 0.00 0.00 0.04 0.00 0.45 0.00 0.00 32.46 32.95 1w2k n ARG 15 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1w2k n LYS 18 N -2.46 1.29 -3.93 0.00 4.76 -0.99 -4.53 118.16 112.32 1w2k n LYS 18 Ca 0.02 -0.62 -0.35 0.00 -2.87 0.00 0.00 58.31 54.50 1w2k n LYS 18 Cb 0.10 -1.24 -0.14 0.00 -1.84 0.00 0.00 35.03 31.90 1w2k n LYS 18 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 1w2k s GLN 21 N -0.70 3.25 0.05 1.97 -0.21 -1.26 -5.23 119.66 117.52 1w2k s GLN 21 Ca 0.12 -0.71 0.00 0.00 0.02 0.00 0.00 55.36 54.79 1w2k s GLN 21 Cb 0.10 -2.99 -0.04 0.00 1.00 0.00 0.00 33.01 31.08 1w2k s GLN 21 CO 0.01 -0.24 0.18 0.00 -2.12 0.00 0.00 175.29 173.12 1w2k n SER 23 N 0.45 0.00 -3.86 0.00 3.41 -1.26 -4.84 113.62 107.52 1w2k n SER 23 Ca -0.07 -0.74 -0.41 0.00 -0.26 0.00 0.00 58.87 57.39 1w2k n SER 23 Cb 0.51 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.44 1w2k n SER 23 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1w2k n PHE 24 N -1.42 2.92 0.00 7.33 7.35 -1.26 -4.71 117.46 127.67 1w2k n PHE 24 Ca 0.00 -2.35 0.00 0.00 -0.76 0.00 0.00 57.45 54.34 1w2k n PHE 24 Cb 0.00 -2.23 0.00 0.00 0.35 0.00 0.00 39.48 37.60 1w2k n PHE 24 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1w2k n ALA 27 N 7.68 0.00 -0.03 3.13 0.00 -1.26 -4.99 120.51 125.05 1w2k n ALA 27 Ca 0.50 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.94 1w2k n ALA 27 Cb 0.41 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.86 1w2k n ALA 27 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1w2k n ARG 28 N 0.00 0.05 0.00 0.00 0.63 -1.26 -2.15 116.66 113.93 1w2k n ARG 28 Ca 0.00 -0.02 0.00 0.00 -0.92 0.00 0.00 57.85 56.91 1w2k n ARG 28 Cb 0.00 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 31.41 1w2k n ARG 28 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 1w2k n ILE 30 N 2.54 0.00 0.17 5.15 5.41 -1.26 -0.37 119.36 131.00 1w2k n ILE 30 Ca 0.01 0.00 0.05 0.00 1.00 0.00 0.00 62.75 63.80 1w2k n ILE 30 Cb 0.02 0.00 0.19 0.00 -0.71 0.00 0.00 39.64 39.14 1w2k n ILE 30 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 176.55 176.29 1w2k h PHE 31 N 0.00 0.00 0.00 1.39 -1.00 -1.85 -3.47 116.94 112.01 1w2k h PHE 31 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1w2k h PHE 31 Cb 0.00 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.56 1w2k h PHE 31 CO 0.00 0.42 0.00 1.63 -1.61 0.00 0.00 178.31 178.75 1w2k n LYS 32 N -3.34 0.00 -1.83 1.51 4.76 0.50 -4.87 118.16 114.89 1w2k n LYS 32 Ca 0.01 0.00 -0.39 0.00 -2.87 0.00 0.00 58.31 55.07 1w2k n LYS 32 Cb 0.62 0.00 0.03 0.00 -1.84 0.00 0.00 35.03 33.84 1w2k n LYS 32 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1w2k s ASP 33 N 0.00 5.47 -0.07 4.39 3.68 -1.26 -4.92 116.67 123.97 1w2k s ASP 33 Ca 0.00 2.75 -0.26 0.00 2.13 0.00 0.00 52.55 57.17 1w2k s ASP 33 Cb 0.00 -2.64 -0.23 0.00 -1.45 0.00 0.00 42.92 38.60 1w2k s ASP 33 CO 0.00 -1.43 1.03 0.00 0.13 0.00 0.00 175.17 174.90 1w2k h ALA 34 N 1.69 0.02 -0.96 3.66 0.00 -1.95 -1.43 119.26 120.29 1w2k h ALA 34 Ca -0.51 -0.40 0.08 0.00 0.00 0.00 0.00 54.91 54.08 1w2k h ALA 34 Cb 1.29 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 19.01 1w2k h ALA 34 CO 0.58 -0.05 0.62 1.49 0.00 0.00 0.00 179.25 181.89 1w2k h GLU 35 N -0.64 1.03 0.04 0.00 4.57 -1.99 0.18 114.58 117.77 1w2k h GLU 35 Ca -0.01 -0.06 -0.00 0.00 -1.18 0.00 0.00 59.36 58.11 1w2k h GLU 35 Cb 0.83 -0.23 0.00 0.00 -0.16 0.00 0.00 28.75 29.19 1w2k h GLU 35 CO 0.02 0.68 -0.02 0.00 -1.18 0.00 0.00 179.01 178.51 1w2k h ARG 36 N 1.06 -0.06 -0.70 1.92 3.08 -1.94 -2.41 114.38 115.33 1w2k h ARG 36 Ca 0.43 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.58 1w2k h ARG 36 Cb 0.27 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.29 1w2k h ARG 36 CO -0.18 0.41 0.46 1.15 -1.07 0.00 0.00 179.97 180.74 1w2k h THR 37 N -0.54 0.93 -0.03 2.04 2.02 -0.72 -2.19 112.91 114.42 1w2k h THR 37 Ca -0.01 -0.20 -0.01 0.00 0.77 0.00 0.00 66.41 66.96 1w2k h THR 37 Cb 0.49 0.29 -0.00 0.00 -1.74 0.00 0.00 68.15 67.19 1w2k h THR 37 CO 0.01 0.11 -0.02 0.11 0.37 0.00 0.00 175.52 176.10 1w2k h LYS 38 N 0.59 0.07 -0.74 6.66 1.57 -0.61 0.12 116.57 124.24 1w2k h LYS 38 Ca 0.32 -0.03 0.13 0.00 -1.87 0.00 0.00 60.65 59.20 1w2k h LYS 38 Cb 0.47 -0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.69 1w2k h LYS 38 CO -0.11 0.49 0.29 1.25 -0.57 0.00 0.00 179.45 180.80 1w2k h LEU 39 N -0.34 0.28 0.13 2.94 5.85 -0.95 0.16 115.31 123.36 1w2k h LEU 39 Ca 0.01 0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 1w2k h LEU 39 Cb 0.47 0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.58 1w2k h LEU 39 CO 0.01 0.11 -0.06 0.15 -0.34 0.00 0.00 178.44 178.31 1w2k h PHE 40 N 0.45 -0.16 -0.61 1.25 3.57 -1.35 -3.31 116.94 116.77 1w2k h PHE 40 Ca 0.40 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.96 1w2k h PHE 40 Cb 0.59 0.05 -0.06 0.00 2.79 0.00 0.00 35.95 39.32 1w2k h PHE 40 CO -0.17 0.23 0.30 2.35 -2.23 0.00 0.00 178.31 178.79 1w2k h TRP 41 N -0.58 0.54 -0.91 0.41 2.91 -0.01 -2.58 115.95 115.72 1w2k h TRP 41 Ca -0.02 0.03 0.24 0.00 1.13 0.00 0.00 58.89 60.27 1w2k h TRP 41 Cb 0.46 -0.15 -0.16 0.00 -0.51 0.00 0.00 29.16 28.79 1w2k h TRP 41 CO 0.05 0.23 0.08 0.97 -1.03 0.00 0.00 178.44 178.74 1w2k h ILE 42 N 0.55 0.16 0.00 2.65 2.10 -0.81 -1.58 117.51 120.58 1w2k h ILE 42 Ca 0.29 -0.03 0.00 0.00 1.08 0.00 0.00 64.86 66.20 1w2k h ILE 42 Cb 0.24 0.08 0.00 0.00 -1.09 0.00 0.00 36.82 36.05 1w2k h ILE 42 CO -0.22 0.01 -0.21 0.28 -1.08 0.00 0.00 178.15 176.94 1w2k h SER 43 N 0.08 0.00 -1.31 2.19 0.02 -1.67 -3.17 113.55 109.68 1w2k h SER 43 Ca 0.55 0.00 0.43 0.00 -0.84 0.00 0.00 61.79 61.93 1w2k h SER 43 Cb 1.12 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 63.55 1w2k h SER 43 CO -0.80 0.58 0.88 0.00 -1.14 0.00 0.00 176.83 176.34 1w2k n TYR 44 N -4.57 0.43 0.76 3.45 9.36 -0.99 0.97 117.16 126.56 1w2k n TYR 44 Ca -0.03 0.43 0.09 0.00 3.32 0.00 0.00 57.90 61.71 1w2k n TYR 44 Cb 0.11 -0.85 0.02 0.00 -0.63 0.00 0.00 39.34 37.99 1w2k n TYR 44 CO 0.00 0.00 0.00 -1.13 0.22 0.00 0.00 176.86 175.95 1w2k n SER 45 N -4.17 1.92 -0.32 2.98 3.41 -0.61 -4.62 113.62 112.20 1w2k n SER 45 Ca 0.35 -1.46 0.05 0.00 -0.26 0.00 0.00 58.87 57.55 1w2k n SER 45 Cb 1.43 0.34 0.20 0.00 -0.26 0.00 0.00 64.21 65.92 1w2k n SER 45 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 1w2k h ASP 46 N 2.35 0.77 -1.78 4.04 3.58 0.63 -3.49 116.42 122.53 1w2k h ASP 46 Ca 0.00 0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.50 1w2k h ASP 46 Cb 0.63 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 41.58 1w2k h ASP 46 CO 0.00 0.42 0.00 0.61 -2.88 0.00 0.00 179.24 177.39 1w2k n GLY 47 N -1.33 -0.38 3.56 -0.78 0.00 -1.26 -4.73 105.19 100.26 1w2k n GLY 47 Ca 0.16 -1.28 -0.37 0.00 0.00 0.00 0.00 46.02 44.53 1w2k n GLY 47 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1w2k s ASP 48 N -0.62 5.93 0.19 1.61 3.68 -1.26 -4.71 116.67 121.49 1w2k s ASP 48 Ca 0.00 -0.83 0.08 0.00 2.13 0.00 0.00 52.55 53.93 1w2k s ASP 48 Cb 0.00 -2.56 0.44 0.00 -1.45 0.00 0.00 42.92 39.35 1w2k s ASP 48 CO 0.00 -2.00 1.12 0.00 0.13 0.00 0.00 175.17 174.42 1w2k n GLN 49 N 9.02 0.06 0.11 4.34 3.00 -1.26 -0.40 117.38 132.23 1w2k n GLN 49 Ca 0.27 0.47 0.13 0.00 -0.01 0.00 0.00 57.00 57.86 1w2k n GLN 49 Cb 0.50 -1.91 0.30 0.00 0.00 0.00 0.00 30.24 29.13 1w2k n GLN 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1w2k h ALA 51 N 2.44 2.46 0.00 0.00 0.00 -1.14 0.81 119.26 123.82 1w2k h ALA 51 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1w2k h ALA 51 Cb 0.78 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1w2k h ALA 51 CO 0.00 -0.96 0.00 -1.13 0.00 0.00 0.00 179.25 177.16 1w2k n SER 52 N -4.66 0.00 -3.65 0.00 3.41 -1.26 -4.91 113.62 102.56 1w2k n SER 52 Ca 0.31 -0.97 -0.21 0.00 -0.26 0.00 0.00 58.87 57.73 1w2k n SER 52 Cb 1.13 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 65.08 1w2k n SER 52 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1w2k n SER 53 N -0.91 -5.47 0.06 4.04 7.64 0.28 -4.90 113.62 114.36 1w2k n SER 53 Ca 0.16 -0.80 -0.21 0.00 1.01 0.00 0.00 58.87 59.03 1w2k n SER 53 Cb 0.07 -2.57 -0.12 0.00 -1.01 0.00 0.00 64.21 60.59 1w2k n SER 53 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1w2k h PRO 54 N -0.39 0.67 -6.85 1.43 0.13 -1.88 -3.46 132.00 121.66 1w2k h PRO 54 Ca -0.51 -0.79 -0.53 0.00 -0.87 0.00 0.00 66.00 63.30 1w2k h PRO 54 Cb 1.31 0.24 0.08 0.00 0.13 0.00 0.00 31.00 32.76 1w2k h PRO 54 CO 0.37 1.35 0.77 0.00 -0.23 0.00 0.00 178.00 180.26 1w2k s GLN 56 N -1.22 2.24 -1.68 0.00 -0.21 -0.10 -4.61 119.66 114.08 1w2k s GLN 56 Ca 0.56 -2.12 -0.17 0.00 0.02 0.00 0.00 55.36 53.64 1w2k s GLN 56 Cb -0.44 -1.91 0.15 0.00 1.00 0.00 0.00 33.01 31.80 1w2k s GLN 56 CO 0.52 -0.50 0.78 0.09 -2.12 0.00 0.00 175.29 174.07 1w2k n ASN 57 N -1.57 -3.22 0.00 5.90 3.02 -1.26 -0.93 115.26 117.20 1w2k n ASN 57 Ca -0.07 -1.00 0.00 0.00 -0.03 0.00 0.00 54.58 53.48 1w2k n ASN 57 Cb 0.65 -2.83 0.00 0.00 -0.61 0.00 0.00 39.78 36.99 1w2k n ASN 57 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1w2k n GLY 58 N -1.45 0.55 3.67 7.41 0.00 -1.26 -4.68 105.19 109.43 1w2k n GLY 58 Ca 0.05 -0.59 -0.29 0.00 0.00 0.00 0.00 46.02 45.19 1w2k n GLY 58 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1w2k s GLY 59 N -2.54 1.56 -0.12 -0.02 0.00 -0.11 -4.64 107.32 101.46 1w2k s GLY 59 Ca 0.00 -0.46 0.01 0.00 0.00 0.00 0.00 44.72 44.27 1w2k s GLY 59 CO 0.00 0.19 -0.12 -0.56 0.00 0.00 0.00 173.10 172.61 1w2k s SER 60 N -3.55 2.32 0.12 1.64 0.01 -0.72 -4.85 113.70 108.68 1w2k s SER 60 Ca 0.66 -0.38 -0.21 0.00 1.31 0.00 0.00 55.95 57.33 1w2k s SER 60 Cb -0.18 -0.99 -0.07 0.00 0.21 0.00 0.00 66.02 65.00 1w2k s SER 60 CO 0.57 -0.05 0.64 0.00 0.41 0.00 0.00 173.24 174.81 1w2k s LYS 62 N -1.25 1.07 0.56 0.00 2.47 -0.29 -4.98 119.74 117.32 1w2k s LYS 62 Ca 0.33 -0.71 -0.21 0.00 -1.56 0.00 0.00 55.97 53.82 1w2k s LYS 62 Cb -0.20 -2.32 -0.04 0.00 -1.46 0.00 0.00 37.83 33.81 1w2k s LYS 62 CO 0.21 -0.64 1.30 0.34 0.16 0.00 0.00 175.35 176.72 1w2k s ASP 63 N 1.64 5.27 0.26 1.43 2.15 -1.26 -1.38 116.67 124.78 1w2k s ASP 63 Ca -0.02 2.63 0.03 0.00 0.43 0.00 0.00 52.55 55.61 1w2k s ASP 63 Cb -0.18 -2.62 -0.04 0.00 -0.30 0.00 0.00 42.92 39.78 1w2k s ASP 63 CO -0.08 -1.56 0.19 -1.10 -0.17 0.00 0.00 175.17 172.46 1w2k s GLN 64 N -3.01 1.45 -0.78 4.34 -1.52 0.71 -4.88 119.66 115.97 1w2k s GLN 64 Ca 0.73 -1.80 -0.25 0.00 -1.95 0.00 0.00 55.36 52.09 1w2k s GLN 64 Cb -0.37 0.28 -0.07 0.00 -0.22 0.00 0.00 33.01 32.63 1w2k s GLN 64 CO 0.43 -0.50 2.09 -0.51 -0.25 0.00 0.00 175.29 176.54 1w2k s LEU 65 N -3.26 3.14 -0.74 2.90 1.43 -1.26 -2.77 118.68 118.13 1w2k s LEU 65 Ca 0.40 -0.12 -0.03 0.00 -1.03 0.00 0.00 54.13 53.34 1w2k s LEU 65 Cb 0.05 -2.55 0.00 0.00 0.03 0.00 0.00 46.19 43.73 1w2k s LEU 65 CO 0.19 -2.96 0.64 0.00 0.23 0.00 0.00 176.35 174.44 1w2k n GLN 66 N 8.93 -4.25 -3.13 1.70 6.02 -1.26 -4.98 117.38 120.40 1w2k n GLN 66 Ca 0.37 0.47 0.00 0.00 -0.01 0.00 0.00 57.00 57.84 1w2k n GLN 66 Cb 0.48 -4.42 0.00 0.00 1.02 0.00 0.00 30.24 27.32 1w2k n GLN 66 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1w2k n SER 67 N -1.48 0.00 -3.88 1.08 3.41 -1.11 -5.09 113.62 106.54 1w2k n SER 67 Ca -0.06 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.46 1w2k n SER 67 Cb 0.56 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.46 1w2k n SER 67 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1w2k s TYR 68 N -2.05 0.15 -0.04 7.33 -0.85 -1.26 -0.20 117.35 120.43 1w2k s TYR 68 Ca 0.00 -0.51 0.02 0.00 -0.52 0.00 0.00 57.07 56.05 1w2k s TYR 68 Cb 0.00 0.25 0.01 0.00 0.38 0.00 0.00 41.96 42.60 1w2k s TYR 68 CO 0.00 -0.92 -0.07 0.42 -1.52 0.00 0.00 175.55 173.46 1w2k s ILE 69 N -3.95 0.68 -0.16 -3.49 1.01 -0.48 -4.92 121.20 109.89 1w2k s ILE 69 Ca 0.16 -0.24 -0.06 0.00 0.00 0.00 0.00 60.65 60.51 1w2k s ILE 69 Cb -0.00 -0.65 -0.04 0.00 0.01 0.00 0.00 42.46 41.78 1w2k s ILE 69 CO 0.03 0.24 0.03 0.00 0.00 0.00 0.00 174.94 175.24 1w2k s PHE 71 N 0.12 3.34 0.69 0.00 2.99 -0.32 -4.93 117.98 119.87 1w2k s PHE 71 Ca 0.03 -1.50 -0.08 0.00 0.00 0.00 0.00 56.93 55.38 1w2k s PHE 71 Cb -0.13 -3.19 0.04 0.00 0.00 0.00 0.00 43.02 39.74 1w2k s PHE 71 CO 0.01 -0.89 1.02 0.00 -0.00 0.00 0.00 175.22 175.37 1w2k s LEU 73 N -5.25 3.76 0.07 0.00 1.43 -1.26 -4.96 118.68 112.47 1w2k s LEU 73 Ca 0.58 1.03 -0.13 0.00 -1.03 0.00 0.00 54.13 54.59 1w2k s LEU 73 Cb -0.11 -3.94 -0.02 0.00 0.03 0.00 0.00 46.19 42.15 1w2k s LEU 73 CO 0.47 -0.46 0.66 -2.65 0.23 0.00 0.00 176.35 174.59 1w2k n PRO 74 N -1.67 -0.18 0.00 1.29 -0.02 -1.26 -1.14 135.00 132.02 1w2k n PRO 74 Ca 0.01 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 1w2k n PRO 74 Cb 0.54 -0.95 0.00 0.00 -0.02 0.00 0.00 33.50 33.07 1w2k n PRO 74 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1w2k n ALA 75 N -3.69 2.09 -2.87 3.55 0.00 -1.26 -4.83 120.51 113.51 1w2k n ALA 75 Ca 0.01 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.32 1w2k n ALA 75 Cb 0.12 -1.00 -0.12 0.00 0.00 0.00 0.00 19.45 18.45 1w2k n ALA 75 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1w2k s PHE 76 N -1.30 0.57 0.26 0.00 0.08 -0.30 -2.09 117.98 115.21 1w2k s PHE 76 Ca 0.00 -0.45 0.06 0.00 0.12 0.00 0.00 56.93 56.67 1w2k s PHE 76 Cb 0.00 -0.35 -0.02 0.00 -0.57 0.00 0.00 43.02 42.08 1w2k s PHE 76 CO 0.00 -0.09 0.22 0.39 -0.10 0.00 0.00 175.22 175.64 1w2k n GLU 77 N 1.69 0.33 0.00 0.44 1.02 -0.62 -4.64 120.64 118.85 1w2k n GLU 77 Ca -0.22 -2.62 0.00 0.00 -0.02 0.00 0.00 57.16 54.31 1w2k n GLU 77 Cb 0.55 2.14 0.00 0.00 -0.02 0.00 0.00 31.44 34.11 1w2k n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1w2k n GLY 78 N -0.49 2.32 0.42 0.62 0.00 -1.26 -1.11 105.19 105.69 1w2k n GLY 78 Ca 0.06 -1.82 0.23 0.00 0.00 0.00 0.00 46.02 44.49 1w2k n GLY 78 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1w2k h ARG 79 N 0.00 0.31 0.00 1.61 2.43 -2.00 -0.80 114.38 115.94 1w2k h ARG 79 Ca 0.00 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1w2k h ARG 79 Cb 0.00 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.47 1w2k h ARG 79 CO 0.00 0.21 -0.22 0.09 -1.51 0.00 0.00 179.97 178.53 1w2k n ASN 80 N -4.50 2.04 -1.78 -3.80 5.03 -1.26 -4.37 115.26 106.60 1w2k n ASN 80 Ca 0.22 -3.40 -0.21 0.00 0.87 0.00 0.00 54.58 52.07 1w2k n ASN 80 Cb 0.86 -0.47 -0.07 0.00 -1.02 0.00 0.00 39.78 39.08 1w2k n ASN 80 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1w2k n GLU 82 N -2.53 0.98 -4.21 0.00 0.00 -1.01 -4.49 120.64 109.39 1w2k n GLU 82 Ca -0.22 0.00 -0.34 0.00 0.00 0.00 0.00 57.16 56.60 1w2k n GLU 82 Cb 0.69 -1.10 -0.14 0.00 0.00 0.00 0.00 31.44 30.88 1w2k n GLU 82 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 1w2k s THR 83 N -2.00 3.11 -0.40 3.84 2.01 -0.27 -4.98 115.64 116.95 1w2k s THR 83 Ca 0.10 -0.60 -0.24 0.00 0.31 0.00 0.00 61.69 61.26 1w2k s THR 83 Cb 0.05 -2.37 0.02 0.00 0.01 0.00 0.00 72.50 70.20 1w2k s THR 83 CO 0.08 0.47 0.82 -1.00 -0.69 0.00 0.00 174.62 174.29 1w2k s HIS 84 N 1.09 3.05 0.23 4.92 3.76 -1.26 -1.59 115.29 125.48 1w2k s HIS 84 Ca 0.00 0.43 -0.05 0.00 -0.15 0.00 0.00 55.06 55.30 1w2k s HIS 84 Cb -0.15 -3.58 0.24 0.00 1.11 0.00 0.00 32.58 30.20 1w2k s HIS 84 CO -0.02 -0.87 1.73 0.87 -0.85 0.00 0.00 174.74 175.60 1w2k h LYS 85 N 8.71 0.92 0.00 1.40 1.57 -1.80 -2.79 116.57 124.58 1w2k h LYS 85 Ca -0.24 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 1w2k h LYS 85 Cb 1.09 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.29 1w2k h LYS 85 CO 0.95 0.89 0.00 -0.25 -0.57 0.00 0.00 179.45 180.47 1w2k n ASP 86 N -4.21 0.00 -0.28 0.86 10.43 -1.26 -2.32 116.55 119.76 1w2k n ASP 86 Ca 0.03 -0.59 0.08 0.00 2.57 0.00 0.00 54.79 56.89 1w2k n ASP 86 Cb 0.30 0.00 0.17 0.00 1.84 0.00 0.00 41.12 43.43 1w2k n ASP 86 CO 0.00 0.00 0.00 0.47 -1.07 0.00 0.00 177.20 176.60 1w2k n ASP 87 N -0.75 2.27 -1.25 -2.24 10.43 -1.05 -4.58 116.55 119.38 1w2k n ASP 87 Ca 0.05 -3.32 0.04 0.00 2.57 0.00 0.00 54.79 54.12 1w2k n ASP 87 Cb 0.02 -0.47 0.28 0.00 1.84 0.00 0.00 41.12 42.79 1w2k n ASP 87 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1w2k n GLN 88 N -1.30 3.13 -0.95 -1.24 1.13 -0.98 -4.85 117.38 112.32 1w2k n GLN 88 Ca 0.18 -2.98 -0.29 0.00 -1.94 0.00 0.00 57.00 51.97 1w2k n GLN 88 Cb 0.68 -1.96 -0.02 0.00 0.11 0.00 0.00 30.24 29.04 1w2k n GLN 88 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 1w2k n LEU 89 N -0.42 5.81 -4.65 1.08 7.94 -1.26 -4.67 117.00 120.84 1w2k n LEU 89 Ca 0.28 -3.28 -0.26 0.00 -1.11 0.00 0.00 56.01 51.64 1w2k n LEU 89 Cb 1.04 -1.23 -0.09 0.00 0.53 0.00 0.00 43.42 43.68 1w2k n LEU 89 CO 0.23 0.88 -0.27 0.27 -1.11 0.00 0.00 177.39 177.39 1w2k s ILE 90 N 3.28 2.33 0.21 1.96 -4.36 -1.26 -4.31 121.20 119.05 1w2k s ILE 90 Ca 0.48 -1.93 0.15 0.00 -0.26 0.00 0.00 60.65 59.09 1w2k s ILE 90 Cb 0.12 -2.89 0.06 0.00 1.25 0.00 0.00 42.46 41.01 1w2k s ILE 90 CO -0.03 -0.10 1.68 0.00 0.24 0.00 0.00 174.94 176.73 1w2k h VAL 92 N 0.00 0.37 -2.68 0.00 3.04 -1.93 -2.80 116.25 112.25 1w2k h VAL 92 Ca -0.00 -0.99 -0.67 0.00 -1.01 0.00 0.00 66.70 64.02 1w2k h VAL 92 Cb 0.99 1.74 -0.17 0.00 -2.01 0.00 0.00 31.29 31.84 1w2k h VAL 92 CO 0.06 0.16 0.50 0.21 -1.01 0.00 0.00 177.57 177.49 1w2k s ASN 93 N -6.07 6.31 -1.35 3.17 2.47 -1.11 -4.42 114.94 113.93 1w2k s ASN 93 Ca 0.01 -1.42 -0.00 0.00 0.42 0.00 0.00 52.86 51.87 1w2k s ASN 93 Cb 0.09 -2.38 0.00 0.00 -1.45 0.00 0.00 41.25 37.51 1w2k s ASN 93 CO 0.62 -1.24 0.58 -0.62 -3.72 0.00 0.00 177.10 172.71 1w2k n GLU 94 N 6.97 -4.21 -2.60 0.43 -0.58 -1.26 -1.31 120.64 118.08 1w2k n GLU 94 Ca 0.02 0.53 -0.12 0.00 -0.42 0.00 0.00 57.16 57.17 1w2k n GLU 94 Cb 0.46 -4.90 -0.00 0.00 -0.57 0.00 0.00 31.44 26.42 1w2k n GLU 94 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1w2k n ASN 95 N -3.03 -3.48 -1.46 1.62 5.15 -1.06 0.47 115.26 113.47 1w2k n ASN 95 Ca -0.30 0.14 -0.18 0.00 -0.60 0.00 0.00 54.58 53.64 1w2k n ASN 95 Cb 0.68 -2.96 -0.08 0.00 -0.53 0.00 0.00 39.78 36.89 1w2k n ASN 95 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1w2k n GLY 96 N -0.83 1.71 2.46 8.20 0.00 -0.42 -1.08 105.19 115.24 1w2k n GLY 96 Ca -0.10 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.90 1w2k n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w2k n GLY 97 N -0.28 0.35 3.79 -0.02 0.00 0.18 -4.91 105.19 104.31 1w2k n GLY 97 Ca -0.18 -0.06 -0.35 0.00 0.00 0.00 0.00 46.02 45.43 1w2k n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w2k h GLU 99 N 2.47 0.00 0.00 0.00 4.81 -0.90 -3.45 114.58 117.51 1w2k h GLU 99 Ca -0.48 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 1w2k h GLU 99 Cb 1.20 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.58 1w2k h GLU 99 CO 0.63 0.73 0.00 1.04 -0.73 0.00 0.00 179.01 180.67 1w2k n GLN 100 N -3.65 0.00 -3.47 1.92 6.02 -1.26 -4.98 117.38 111.96 1w2k n GLN 100 Ca -0.01 0.00 -0.36 0.00 -0.01 0.00 0.00 57.00 56.62 1w2k n GLN 100 Cb 0.71 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.92 1w2k n GLN 100 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 1w2k s TYR 101 N 0.45 3.64 -0.01 1.08 4.12 -0.42 -4.96 117.35 121.25 1w2k s TYR 101 Ca 0.00 0.96 0.07 0.00 0.02 0.00 0.00 57.07 58.11 1w2k s TYR 101 Cb 0.00 -2.28 -0.02 0.00 -1.52 0.00 0.00 41.96 38.14 1w2k s TYR 101 CO 0.00 0.52 -0.22 0.00 0.02 0.00 0.00 175.55 175.88 1w2k s SER 103 N -0.58 2.70 0.75 0.00 0.01 0.43 -4.95 113.70 112.05 1w2k s SER 103 Ca 0.08 -0.68 -0.14 0.00 1.31 0.00 0.00 55.95 56.53 1w2k s SER 103 Cb -0.08 -0.64 0.05 0.00 0.21 0.00 0.00 66.02 65.55 1w2k s SER 103 CO -0.01 -0.26 1.15 -1.81 0.41 0.00 0.00 173.24 172.72 1w2k s ASP 104 N 1.82 4.30 -0.27 2.44 -0.00 -1.26 -1.41 116.67 122.29 1w2k s ASP 104 Ca 0.00 2.15 -0.01 0.00 -0.00 0.00 0.00 52.55 54.69 1w2k s ASP 104 Cb -0.16 -2.56 0.14 0.00 -0.00 0.00 0.00 42.92 40.33 1w2k s ASP 104 CO -0.07 -2.18 0.34 -1.00 -0.00 0.00 0.00 175.17 172.25 1w2k s HIS 105 N -2.33 -0.69 -0.43 4.23 3.76 -1.26 -4.85 115.29 113.71 1w2k s HIS 105 Ca 0.69 0.25 -0.42 0.00 -0.15 0.00 0.00 55.06 55.43 1w2k s HIS 105 Cb -0.24 -0.25 -0.17 0.00 1.11 0.00 0.00 32.58 33.03 1w2k s HIS 105 CO 0.48 -0.86 1.96 0.25 -0.85 0.00 0.00 174.74 175.72 1w2k n THR 106 N 5.34 0.09 0.00 1.30 -2.24 -1.26 -2.55 114.28 114.96 1w2k n THR 106 Ca -0.02 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1w2k n THR 106 Cb 0.48 -0.84 0.00 0.00 -2.10 0.00 0.00 70.33 67.87 1w2k n THR 106 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1w2k n GLY 107 N 5.98 2.35 2.74 3.38 0.00 -1.26 -4.99 105.19 113.40 1w2k n GLY 107 Ca 0.42 -0.45 -0.21 0.00 0.00 0.00 0.00 46.02 45.78 1w2k n GLY 107 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1w2k n THR 108 N 0.00 0.00 -2.03 2.61 5.66 -1.06 -5.06 114.28 114.40 1w2k n THR 108 Ca 0.00 -0.64 -0.29 0.00 -3.05 0.00 0.00 64.05 60.08 1w2k n THR 108 Cb 0.00 -1.55 0.05 0.00 -1.55 0.00 0.00 70.33 67.28 1w2k n THR 108 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 175.07 170.43 1w2k s LYS 109 N -5.04 2.70 0.66 1.09 -2.85 -1.26 -4.66 119.74 110.38 1w2k s LYS 109 Ca 0.54 0.25 -0.11 0.00 -1.00 0.00 0.00 55.97 55.65 1w2k s LYS 109 Cb -0.02 -2.08 -0.01 0.00 -2.06 0.00 0.00 37.83 33.66 1w2k s LYS 109 CO 0.39 -1.05 1.05 -0.98 0.10 0.00 0.00 175.35 174.85 1w2k s ARG 110 N -5.30 3.20 0.15 1.78 1.04 -1.26 -4.50 118.95 114.06 1w2k s ARG 110 Ca 0.58 0.89 0.08 0.00 -1.04 0.00 0.00 55.73 56.24 1w2k s ARG 110 Cb -0.11 -2.03 -0.04 0.00 -2.04 0.00 0.00 34.95 30.74 1w2k s ARG 110 CO 0.49 -0.89 -0.06 -1.54 -0.04 0.00 0.00 175.30 173.26 1w2k s SER 111 N -3.88 4.52 -0.09 -2.89 1.04 -0.50 -4.97 113.70 106.94 1w2k s SER 111 Ca 0.57 -0.43 0.04 0.00 0.48 0.00 0.00 55.95 56.60 1w2k s SER 111 Cb -0.13 -0.88 0.00 0.00 0.10 0.00 0.00 66.02 65.11 1w2k s SER 111 CO 0.54 0.13 -0.20 0.00 0.98 0.00 0.00 173.24 174.68 1w2k s ARG 113 N 0.42 2.06 0.29 0.00 0.52 0.59 -4.91 118.95 117.92 1w2k s ARG 113 Ca -0.17 -2.25 0.05 0.00 -0.52 0.00 0.00 55.73 52.85 1w2k s ARG 113 Cb -0.17 -1.50 -0.06 0.00 0.52 0.00 0.00 34.95 33.74 1w2k s ARG 113 CO 0.07 -0.23 -0.02 0.00 0.02 0.00 0.00 175.30 175.15 1w2k s HIS 115 N -3.13 3.50 0.52 0.00 2.46 -1.26 -4.91 115.29 112.46 1w2k s HIS 115 Ca 0.31 1.07 -0.23 0.00 0.47 0.00 0.00 55.06 56.68 1w2k s HIS 115 Cb 0.06 -2.73 -0.06 0.00 -0.13 0.00 0.00 32.58 29.71 1w2k s HIS 115 CO 0.13 -0.75 1.35 -1.91 -2.47 0.00 0.00 174.74 171.08 1w2k n GLU 116 N -2.71 1.80 -0.49 2.88 2.13 -1.26 -1.74 120.64 121.25 1w2k n GLU 116 Ca 0.05 0.65 0.00 0.00 0.66 0.00 0.00 57.16 58.52 1w2k n GLU 116 Cb 0.55 -2.55 0.00 0.00 0.27 0.00 0.00 31.44 29.72 1w2k n GLU 116 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1w2k n GLY 117 N 0.75 0.89 3.28 8.31 0.00 -1.26 -4.79 105.19 112.38 1w2k n GLY 117 Ca 0.09 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.92 1w2k n GLY 117 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1w2k s TYR 118 N -3.04 1.54 -0.00 1.61 2.02 -0.71 0.35 117.35 119.11 1w2k s TYR 118 Ca 0.00 -0.55 0.04 0.00 -0.37 0.00 0.00 57.07 56.18 1w2k s TYR 118 Cb 0.00 -0.78 -0.01 0.00 -0.40 0.00 0.00 41.96 40.77 1w2k s TYR 118 CO 0.00 0.22 -0.12 0.45 -1.57 0.00 0.00 175.55 174.52 1w2k s SER 119 N -2.70 1.46 -0.21 2.29 0.15 0.39 -4.70 113.70 110.38 1w2k s SER 119 Ca 0.13 -0.25 -0.28 0.00 0.70 0.00 0.00 55.95 56.25 1w2k s SER 119 Cb -0.04 -0.15 0.00 0.00 -1.71 0.00 0.00 66.02 64.12 1w2k s SER 119 CO 0.04 0.14 1.00 -0.22 1.20 0.00 0.00 173.24 175.40 1w2k s LEU 120 N -0.39 4.12 1.02 3.45 2.96 -1.26 -1.08 118.68 127.50 1w2k s LEU 120 Ca 0.04 1.35 -0.13 0.00 -0.22 0.00 0.00 54.13 55.17 1w2k s LEU 120 Cb -0.05 -3.49 0.20 0.00 0.50 0.00 0.00 46.19 43.35 1w2k s LEU 120 CO -0.00 -0.61 1.11 -0.76 -1.32 0.00 0.00 176.35 174.76 1w2k s LEU 121 N 2.96 1.50 0.58 -0.68 1.43 0.75 -4.90 118.68 120.31 1w2k s LEU 121 Ca 0.43 1.04 0.28 0.00 -1.03 0.00 0.00 54.13 54.85 1w2k s LEU 121 Cb -0.16 -3.16 1.73 0.00 0.03 0.00 0.00 46.19 44.64 1w2k s LEU 121 CO 0.08 -3.22 2.22 0.00 0.23 0.00 0.00 176.35 175.66 1w2k h ALA 122 N -1.95 1.52 0.00 4.21 0.00 -1.95 -0.88 119.26 120.20 1w2k h ALA 122 Ca -0.53 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1w2k h ALA 122 Cb 1.33 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1w2k h ALA 122 CO 0.55 0.02 0.00 -0.40 0.00 0.00 0.00 179.25 179.42 1w2k n ASP 123 N -3.87 0.27 0.00 0.00 3.85 -1.26 -4.83 116.55 110.72 1w2k n ASP 123 Ca -0.03 0.60 0.00 0.00 -0.71 0.00 0.00 54.79 54.65 1w2k n ASP 123 Cb 0.11 -0.64 0.00 0.00 -1.35 0.00 0.00 41.12 39.23 1w2k n ASP 123 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1w2k n GLY 124 N -0.84 2.32 0.00 6.12 0.00 -0.34 -4.76 105.19 107.70 1w2k n GLY 124 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1w2k n GLY 124 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1w2k n VAL 125 N -2.00 0.00 -3.67 1.61 0.24 -1.26 -4.26 118.33 108.99 1w2k n VAL 125 Ca 0.00 -0.08 -0.26 0.00 -2.04 0.00 0.00 64.34 61.97 1w2k n VAL 125 Cb 0.00 0.50 -0.03 0.00 -1.47 0.00 0.00 33.84 32.85 1w2k n VAL 125 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1w2k s SER 126 N -1.32 6.36 -0.05 -1.34 0.01 -1.26 -0.18 113.70 115.91 1w2k s SER 126 Ca 0.00 0.36 0.02 0.00 1.31 0.00 0.00 55.95 57.64 1w2k s SER 126 Cb 0.00 -1.99 0.01 0.00 0.21 0.00 0.00 66.02 64.25 1w2k s SER 126 CO 0.00 -0.10 -0.11 0.00 0.41 0.00 0.00 173.24 173.44 1w2k s THR 128 N 0.54 2.66 0.51 0.00 -1.32 -0.24 -4.86 115.64 112.92 1w2k s THR 128 Ca -0.11 -1.53 -0.23 0.00 -1.21 0.00 0.00 61.69 58.61 1w2k s THR 128 Cb -0.14 -2.19 -0.06 0.00 -1.51 0.00 0.00 72.50 68.60 1w2k s THR 128 CO 0.02 0.13 1.31 -2.84 -2.21 0.00 0.00 174.62 171.04 1w2k s PRO 129 N -2.01 3.40 0.00 7.08 0.02 -1.26 -0.46 135.00 141.76 1w2k s PRO 129 Ca 0.16 2.13 0.00 0.00 0.02 0.00 0.00 61.00 63.31 1w2k s PRO 129 Cb -0.10 -2.36 -0.00 0.00 0.02 0.00 0.00 34.50 32.05 1w2k s PRO 129 CO 0.08 -0.95 0.19 0.25 -0.33 0.00 0.00 177.00 176.24 1w2k n THR 130 N -0.75 0.00 -4.62 0.99 -2.24 0.16 -4.79 114.28 103.03 1w2k n THR 130 Ca 0.09 -0.50 -0.28 0.00 -2.27 0.00 0.00 64.05 61.09 1w2k n THR 130 Cb 0.45 1.00 -0.11 0.00 -2.10 0.00 0.00 70.33 69.58 1w2k n THR 130 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1w2k s VAL 131 N -0.63 1.84 -0.10 2.28 -7.23 -1.22 -5.01 120.40 110.33 1w2k s VAL 131 Ca 0.00 -2.00 0.19 0.00 -1.81 0.00 0.00 61.98 58.36 1w2k s VAL 131 Cb 0.00 -2.90 0.16 0.00 0.56 0.00 0.00 36.38 34.21 1w2k s VAL 131 CO 0.00 0.00 1.60 -0.08 -0.31 0.00 0.00 175.10 176.31 1w2k h GLU 132 N 1.76 0.00 -2.04 4.82 4.81 -1.96 -3.37 114.58 118.61 1w2k h GLU 132 Ca -0.44 0.00 -0.57 0.00 -0.13 0.00 0.00 59.36 58.23 1w2k h GLU 132 Cb 1.25 0.00 -0.40 0.00 0.63 0.00 0.00 28.75 30.23 1w2k h GLU 132 CO 0.79 0.33 -1.02 0.66 -0.73 0.00 0.00 179.01 179.04 1w2k n TYR 133 N -3.26 0.39 -2.28 0.92 4.01 -1.26 -5.08 117.16 110.59 1w2k n TYR 133 Ca 0.02 -3.68 -0.39 0.00 -0.16 0.00 0.00 57.90 53.69 1w2k n TYR 133 Cb 0.60 -0.39 -0.02 0.00 -0.31 0.00 0.00 39.34 39.21 1w2k n TYR 133 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1w2k s PRO 134 N -1.46 4.27 0.86 -0.72 0.04 -1.26 -4.96 135.00 131.77 1w2k s PRO 134 Ca 0.36 1.95 -0.14 0.00 0.04 0.00 0.00 61.00 63.21 1w2k s PRO 134 Cb 0.17 -2.91 -0.01 0.00 0.04 0.00 0.00 34.50 31.79 1w2k s PRO 134 CO -0.09 -0.16 0.39 0.00 0.04 0.00 0.00 177.00 177.17 1w2k n GLY 136 N 1.68 1.26 3.53 0.00 0.00 -1.26 -5.02 105.19 105.38 1w2k n GLY 136 Ca 0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 1w2k n GLY 136 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1w2k s LYS 137 N -0.05 2.21 -0.80 1.61 -0.14 -1.20 -5.08 119.74 116.28 1w2k s LYS 137 Ca 0.00 -0.93 -0.06 0.00 -1.36 0.00 0.00 55.97 53.62 1w2k s LYS 137 Cb 0.00 -2.31 0.21 0.00 -1.68 0.00 0.00 37.83 34.05 1w2k s LYS 137 CO 0.00 0.55 0.69 0.42 -0.76 0.00 0.00 175.35 176.25 1w2k s ILE 138 N -1.04 4.63 0.08 2.17 1.01 -1.26 -4.98 121.20 121.81 1w2k s ILE 138 Ca 0.17 -3.14 -0.04 0.00 0.00 0.00 0.00 60.65 57.64 1w2k s ILE 138 Cb -0.11 -3.90 0.11 0.00 0.01 0.00 0.00 42.46 38.57 1w2k s ILE 138 CO 0.09 -1.01 0.50 -2.65 0.00 0.00 0.00 174.94 171.87 1w2k n PRO 139 N 3.20 -0.06 0.00 2.79 -0.02 -1.26 0.12 135.00 139.78 1w2k n PRO 139 Ca 0.15 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 1w2k n PRO 139 Cb 0.40 -0.74 0.01 0.00 -0.02 0.00 0.00 33.50 33.15 1w2k n PRO 139 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 1w2k n ILE 140 N -4.50 0.00 -0.03 4.25 -5.35 -1.26 -1.68 119.36 110.79 1w2k n ILE 140 Ca 0.04 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.52 1w2k n ILE 140 Cb 0.14 -0.23 0.00 0.00 -1.74 0.00 0.00 39.64 37.81 1w2k n ILE 140 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1w2k n LEU 141 N -0.51 0.04 -0.85 7.28 4.77 0.32 -5.33 117.00 122.73 1w2k n LEU 141 Ca 0.00 -0.34 0.12 0.00 -0.03 0.00 0.00 56.01 55.77 1w2k n LEU 141 Cb 0.00 0.00 0.20 0.00 -2.33 0.00 0.00 43.42 41.29 1w2k n LEU 141 CO 0.00 0.01 0.69 -0.62 -1.33 0.00 0.00 177.39 176.14