#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kbz n VAL 10 N 0.00 4.10 -3.90 2.53 3.14 -1.26 -5.03 118.33 117.91 3kbz n VAL 10 Ca 0.00 -0.42 -0.11 0.00 -2.96 0.00 0.00 64.34 60.85 3kbz n VAL 10 Cb 0.00 -1.39 -0.13 0.00 -1.06 0.00 0.00 33.84 31.26 3kbz n VAL 10 CO 0.00 0.00 0.00 0.21 -6.46 0.00 0.00 176.83 170.58 3kbz s ASN 11 N -1.58 0.06 0.33 6.55 3.84 -1.26 -5.08 114.94 117.79 3kbz s ASN 11 Ca 0.80 -0.14 0.10 0.00 0.21 0.00 0.00 52.86 53.83 3kbz s ASN 11 Cb -0.36 0.07 -0.06 0.00 -0.55 0.00 0.00 41.25 40.36 3kbz s ASN 11 CO 0.43 -0.12 -0.07 0.42 -2.79 0.00 0.00 177.10 174.98 3kbz s THR 12 N -0.52 2.50 0.21 -5.21 -4.23 -1.26 -1.48 115.64 105.66 3kbz s THR 12 Ca -0.06 -2.14 -0.09 0.00 -1.18 0.00 0.00 61.69 58.22 3kbz s THR 12 Cb -0.04 -2.65 0.16 0.00 1.34 0.00 0.00 72.50 71.31 3kbz s THR 12 CO -0.00 -0.25 1.85 0.25 -0.54 0.00 0.00 174.62 175.93 3kbz h LEU 13 N 1.98 0.75 0.06 4.79 5.85 -1.47 0.54 115.31 127.81 3kbz h LEU 13 Ca -0.42 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.31 3kbz h LEU 13 Cb 1.25 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.12 3kbz h LEU 13 CO 0.67 0.51 -0.07 0.74 -0.34 0.00 0.00 178.44 179.95 3kbz h THR 14 N 0.89 0.84 -0.12 1.05 2.02 -1.96 0.14 112.91 115.77 3kbz h THR 14 Ca 0.30 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.48 3kbz h THR 14 Cb 0.04 0.84 -0.01 0.00 -1.74 0.00 0.00 68.15 67.28 3kbz h THR 14 CO -0.12 0.00 0.08 -0.09 0.37 0.00 0.00 175.52 175.76 3kbz h ARG 15 N -0.15 0.16 0.21 6.66 2.43 -1.88 -0.71 114.38 121.11 3kbz h ARG 15 Ca 0.01 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.17 3kbz h ARG 15 Cb 0.15 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.64 3kbz h ARG 15 CO -0.03 0.11 -0.26 0.35 -1.51 0.00 0.00 179.97 178.63 3kbz h PHE 16 N 0.17 -0.70 -0.54 2.20 3.57 -0.74 -1.32 116.94 119.57 3kbz h PHE 16 Ca 0.05 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.59 3kbz h PHE 16 Cb -0.02 0.28 -0.04 0.00 2.79 0.00 0.00 35.95 38.96 3kbz h PHE 16 CO -0.07 -0.38 0.30 0.28 -2.23 0.00 0.00 178.31 176.21 3kbz h VAL 17 N -0.53 0.99 -0.46 1.41 2.07 -0.89 -1.29 116.25 117.55 3kbz h VAL 17 Ca 0.01 -0.20 -0.04 0.00 0.82 0.00 0.00 66.70 67.29 3kbz h VAL 17 Cb 0.51 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 3kbz h VAL 17 CO -0.09 0.11 0.11 -0.03 0.02 0.00 0.00 177.57 177.68 3kbz h MET 18 N 0.58 0.70 -0.11 1.57 1.85 -0.92 -1.41 114.93 117.19 3kbz h MET 18 Ca 0.23 -0.13 -0.10 0.00 -0.61 0.00 0.00 59.70 59.09 3kbz h MET 18 Cb 0.10 -0.11 0.00 0.00 0.43 0.00 0.00 31.60 32.02 3kbz h MET 18 CO -0.14 0.64 -0.34 1.49 -0.40 0.00 0.00 176.91 178.16 3kbz h GLU 19 N 0.68 0.42 -0.45 0.39 4.81 -0.64 -1.68 114.58 118.11 3kbz h GLU 19 Ca 0.15 -0.31 -0.03 0.00 -0.13 0.00 0.00 59.36 59.05 3kbz h GLU 19 Cb 0.26 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.67 3kbz h GLU 19 CO -0.00 0.93 0.16 0.93 -0.73 0.00 0.00 179.01 180.30 3kbz h GLU 20 N -0.02 0.64 -0.44 1.92 4.39 -1.16 -1.69 114.58 118.23 3kbz h GLU 20 Ca -0.01 -0.10 -0.11 0.00 0.34 0.00 0.00 59.36 59.48 3kbz h GLU 20 Cb 0.97 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 29.49 3kbz h GLU 20 CO 0.07 0.55 -0.16 0.78 -1.16 0.00 0.00 179.01 179.09 3kbz h GLY 21 N 0.81 0.90 1.05 -3.84 0.00 -1.16 -2.21 103.07 98.62 3kbz h GLY 21 Ca 0.15 -0.73 -0.07 0.00 0.00 0.00 0.00 47.33 46.68 3kbz h GLY 21 CO -0.01 0.67 0.11 3.21 0.00 0.00 0.00 176.54 180.52 3kbz h ARG 22 N 0.74 1.05 -0.09 4.80 -0.00 -0.62 -2.69 114.38 117.56 3kbz h ARG 22 Ca 0.11 -0.28 -0.07 0.00 -0.50 0.00 0.00 59.98 59.24 3kbz h ARG 22 Cb 0.68 -0.12 -0.01 0.00 0.00 0.00 0.00 29.97 30.51 3kbz h ARG 22 CO 0.05 0.97 -0.28 0.87 0.00 0.00 0.00 179.97 181.58 3kbz h LYS 23 N 0.96 0.16 0.00 0.04 1.57 -1.13 -2.34 116.57 115.83 3kbz h LYS 23 Ca 0.19 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 3kbz h LYS 23 Cb 0.42 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.72 3kbz h LYS 23 CO 0.01 0.43 0.00 0.00 -0.57 0.00 0.00 179.45 179.33 3kbz h ALA 24 N 1.57 1.00 -6.35 3.86 0.00 -1.07 -3.47 119.26 114.80 3kbz h ALA 24 Ca 0.02 0.00 -0.47 0.00 0.00 0.00 0.00 54.91 54.46 3kbz h ALA 24 Cb 0.57 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 3kbz h ALA 24 CO 0.04 0.00 -0.87 0.54 0.00 0.00 0.00 179.25 178.96 3kbz n ARG 25 N -2.63 -3.65 0.00 0.00 1.74 -0.88 -4.98 116.66 106.25 3kbz n ARG 25 Ca 0.02 0.47 0.00 0.00 -0.77 0.00 0.00 57.85 57.57 3kbz n ARG 25 Cb 0.28 -4.70 0.00 0.00 -1.02 0.00 0.00 32.46 27.02 3kbz n ARG 25 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3kbz n GLY 26 N -1.84 3.12 0.03 -0.13 0.00 -1.26 -5.02 105.19 100.08 3kbz n GLY 26 Ca -0.30 -1.83 0.12 0.00 0.00 0.00 0.00 46.02 44.01 3kbz n GLY 26 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3kbz n THR 27 N 0.00 0.17 -0.44 2.61 -2.24 -1.26 -4.95 114.28 108.18 3kbz n THR 27 Ca 0.00 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 3kbz n THR 27 Cb 0.00 0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.29 3kbz n THR 27 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kbz n GLY 28 N 1.42 0.72 0.16 3.38 0.00 -1.26 -4.97 105.19 104.63 3kbz n GLY 28 Ca 0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 3kbz n GLY 28 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3kbz h GLU 29 N 4.10 -0.26 -0.25 1.61 5.08 -1.97 -2.24 114.58 120.64 3kbz h GLU 29 Ca 0.00 0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.41 3kbz h GLU 29 Cb 0.00 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 3kbz h GLU 29 CO 0.00 -0.18 0.17 1.25 -1.00 0.00 0.00 179.01 179.26 3kbz h LEU 30 N -0.27 0.17 -0.22 1.33 5.85 -1.93 0.13 115.31 120.36 3kbz h LEU 30 Ca -0.00 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 3kbz h LEU 30 Cb 0.25 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 3kbz h LEU 30 CO -0.02 0.12 0.09 0.74 -0.34 0.00 0.00 178.44 179.03 3kbz h THR 31 N 0.19 1.16 -0.41 1.05 2.02 -1.80 0.16 112.91 115.29 3kbz h THR 31 Ca 0.11 -0.48 -0.07 0.00 0.77 0.00 0.00 66.41 66.74 3kbz h THR 31 Cb 0.19 1.07 -0.02 0.00 -1.74 0.00 0.00 68.15 67.65 3kbz h THR 31 CO -0.02 0.16 -0.04 1.56 0.37 0.00 0.00 175.52 177.55 3kbz h GLN 32 N 0.21 0.68 -0.09 6.66 4.20 -0.54 -0.44 115.11 125.79 3kbz h GLN 32 Ca 0.07 -0.18 -0.02 0.00 0.06 0.00 0.00 58.65 58.58 3kbz h GLN 32 Cb 0.16 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 27.86 3kbz h GLN 32 CO -0.01 0.72 -0.01 1.25 -0.67 0.00 0.00 178.83 180.12 3kbz h LEU 33 N 0.63 0.16 -0.81 1.46 6.46 -0.56 -1.84 115.31 120.81 3kbz h LEU 33 Ca 0.12 -0.35 -0.05 0.00 -0.12 0.00 0.00 57.88 57.49 3kbz h LEU 33 Cb 0.46 -0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 40.31 3kbz h LEU 33 CO 0.02 0.47 0.31 -0.07 -0.62 0.00 0.00 178.44 178.56 3kbz h LEU 34 N -0.15 1.10 -0.68 2.25 3.38 -0.77 -0.30 115.31 120.15 3kbz h LEU 34 Ca 0.02 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.78 3kbz h LEU 34 Cb 0.40 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 3kbz h LEU 34 CO 0.01 0.97 0.28 0.78 0.09 0.00 0.00 178.44 180.57 3kbz h ASN 35 N 1.16 0.93 -0.49 -0.43 -0.26 -1.04 0.64 115.58 116.09 3kbz h ASN 35 Ca 0.26 -0.17 -0.10 0.00 -0.56 0.00 0.00 56.30 55.73 3kbz h ASN 35 Cb 0.22 -0.24 -0.02 0.00 -1.06 0.00 0.00 38.32 37.22 3kbz h ASN 35 CO -0.02 0.84 -0.08 0.28 -1.06 0.00 0.00 177.43 177.39 3kbz h SER 36 N 0.96 0.95 -0.57 5.81 0.02 -0.92 -1.40 113.55 118.39 3kbz h SER 36 Ca 0.23 -0.29 -0.07 0.00 -0.84 0.00 0.00 61.79 60.81 3kbz h SER 36 Cb 0.20 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.46 3kbz h SER 36 CO -0.02 1.05 0.07 0.25 -1.14 0.00 0.00 176.83 177.04 3kbz h LEU 37 N 0.86 0.93 -0.34 5.07 5.85 -0.70 -1.34 115.31 125.65 3kbz h LEU 37 Ca 0.14 -0.27 0.02 0.00 0.84 0.00 0.00 57.88 58.61 3kbz h LEU 37 Cb 0.62 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.37 3kbz h LEU 37 CO 0.04 0.97 0.17 0.00 -0.34 0.00 0.00 178.44 179.28 3kbz h THR 39 N 0.35 1.23 -0.80 0.00 2.02 -1.02 -2.21 112.91 112.48 3kbz h THR 39 Ca 0.14 -0.57 -0.04 0.00 0.77 0.00 0.00 66.41 66.72 3kbz h THR 39 Cb 0.05 0.26 -0.04 0.00 -1.74 0.00 0.00 68.15 66.68 3kbz h THR 39 CO -0.10 0.25 0.35 0.00 0.37 0.00 0.00 175.52 176.39 3kbz h ALA 40 N 1.20 1.12 -0.62 6.16 0.00 -0.71 -2.27 119.26 124.14 3kbz h ALA 40 Ca 0.26 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 3kbz h ALA 40 Cb 0.04 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 3kbz h ALA 40 CO -0.04 0.65 0.23 0.28 0.00 0.00 0.00 179.25 180.36 3kbz h VAL 41 N 1.15 1.24 -0.62 0.00 2.07 -0.64 0.20 116.25 119.64 3kbz h VAL 41 Ca 0.27 -0.77 -0.04 0.00 0.82 0.00 0.00 66.70 66.98 3kbz h VAL 41 Cb 0.16 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 3kbz h VAL 41 CO -0.03 0.30 0.22 0.11 0.02 0.00 0.00 177.57 178.19 3kbz h LYS 42 N 0.87 0.92 -0.38 1.57 1.57 -1.18 0.16 116.57 120.09 3kbz h LYS 42 Ca 0.20 -0.16 -0.14 0.00 -1.87 0.00 0.00 60.65 58.68 3kbz h LYS 42 Cb 0.24 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 3kbz h LYS 42 CO -0.01 0.77 -0.32 0.00 -0.57 0.00 0.00 179.45 179.32 3kbz h ALA 43 N 1.34 0.71 -0.35 3.86 0.00 -0.93 -1.04 119.26 122.85 3kbz h ALA 43 Ca 0.21 -0.42 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 3kbz h ALA 43 Cb 0.22 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3kbz h ALA 43 CO -0.01 0.66 0.00 0.82 0.00 0.00 0.00 179.25 180.72 3kbz h ILE 44 N 0.71 1.26 -0.45 0.00 2.04 -0.46 -2.23 117.51 118.39 3kbz h ILE 44 Ca 0.08 -0.97 0.04 0.00 1.00 0.00 0.00 64.86 65.00 3kbz h ILE 44 Cb 0.88 1.19 -0.04 0.00 -0.74 0.00 0.00 36.82 38.11 3kbz h ILE 44 CO 0.08 0.32 0.22 -1.28 0.00 0.00 0.00 178.15 177.49 3kbz h SER 45 N 0.43 0.31 -0.78 1.72 0.87 -0.55 0.23 113.55 115.79 3kbz h SER 45 Ca 0.10 0.03 0.04 0.00 -1.23 0.00 0.00 61.79 60.72 3kbz h SER 45 Cb 0.45 -0.03 -0.05 0.00 -0.44 0.00 0.00 62.40 62.33 3kbz h SER 45 CO 0.02 0.22 0.49 -1.28 -0.53 0.00 0.00 176.83 175.75 3kbz h SER 46 N 0.44 0.80 0.11 6.23 0.87 -1.04 -0.38 113.55 120.58 3kbz h SER 46 Ca 0.20 0.00 -0.16 0.00 -1.23 0.00 0.00 61.79 60.60 3kbz h SER 46 Cb 0.11 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 3kbz h SER 46 CO -0.14 0.54 -0.56 0.00 -0.53 0.00 0.00 176.83 176.14 3kbz h ALA 47 N 1.34 0.74 -0.50 6.23 0.00 -0.73 -2.49 119.26 123.84 3kbz h ALA 47 Ca 0.32 -0.52 -0.10 0.00 0.00 0.00 0.00 54.91 54.61 3kbz h ALA 47 Cb 0.05 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3kbz h ALA 47 CO -0.12 0.69 -0.10 0.28 0.00 0.00 0.00 179.25 180.00 3kbz h VAL 48 N 0.36 1.26 0.00 0.00 2.07 -0.03 -1.43 116.25 118.48 3kbz h VAL 48 Ca 0.00 -1.22 0.00 0.00 0.82 0.00 0.00 66.70 66.31 3kbz h VAL 48 Cb 1.09 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 31.84 3kbz h VAL 48 CO 0.10 0.43 0.00 0.54 0.02 0.00 0.00 177.57 178.66 3kbz n ARG 49 N -4.15 0.70 -2.75 1.57 3.00 -0.20 -4.87 116.66 109.96 3kbz n ARG 49 Ca 0.02 0.00 -0.14 0.00 -0.01 0.00 0.00 57.85 57.72 3kbz n ARG 49 Cb 0.38 -1.25 0.02 0.00 0.00 0.00 0.00 32.46 31.62 3kbz n ARG 49 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 3kbz n LYS 50 N -0.75 -3.14 -1.81 5.56 4.76 -0.54 -4.98 118.16 117.27 3kbz n LYS 50 Ca 0.08 0.56 -0.42 0.00 -2.87 0.00 0.00 58.31 55.67 3kbz n LYS 50 Cb 0.04 -4.68 -0.02 0.00 -1.84 0.00 0.00 35.03 28.53 3kbz n LYS 50 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3kbz s ALA 51 N -2.94 3.76 0.00 7.82 0.00 -0.95 -2.05 121.76 127.40 3kbz s ALA 51 Ca 0.20 1.53 0.00 0.00 0.00 0.00 0.00 51.96 53.69 3kbz s ALA 51 Cb -0.09 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.39 3kbz s ALA 51 CO 0.24 -0.94 0.00 0.41 0.00 0.00 0.00 175.76 175.48 3kbz n GLY 52 N 2.50 0.47 0.32 0.00 0.00 -1.26 -4.88 105.19 102.34 3kbz n GLY 52 Ca 0.09 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.30 3kbz n GLY 52 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3kbz h ILE 53 N 0.00 0.30 -0.57 -0.61 2.10 -1.82 -1.19 117.51 115.73 3kbz h ILE 53 Ca 0.00 0.00 0.01 0.00 1.08 0.00 0.00 64.86 65.95 3kbz h ILE 53 Cb 0.18 0.98 -0.03 0.00 -1.09 0.00 0.00 36.82 36.86 3kbz h ILE 53 CO 0.00 0.00 0.38 0.00 -1.08 0.00 0.00 178.15 177.45 3kbz h ALA 54 N 1.97 1.62 -0.03 0.18 0.00 -1.90 -1.37 119.26 119.73 3kbz h ALA 54 Ca 0.00 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 3kbz h ALA 54 Cb 0.04 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3kbz h ALA 54 CO -0.00 0.35 -0.43 0.45 0.00 0.00 0.00 179.25 179.62 3kbz h HIS 55 N 0.75 0.09 0.00 0.00 3.86 -1.62 -1.99 115.15 116.24 3kbz h HIS 55 Ca 0.21 -0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 59.35 3kbz h HIS 55 Cb -0.06 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 28.39 3kbz h HIS 55 CO -0.00 0.50 -0.23 1.25 0.86 0.00 0.00 177.93 180.31 3kbz h LEU 56 N 0.06 0.00 -3.46 2.43 7.12 -1.32 -3.01 115.31 117.14 3kbz h LEU 56 Ca 0.00 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.01 3kbz h LEU 56 Cb 0.80 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.93 3kbz h LEU 56 CO 0.06 0.23 0.00 -1.22 -0.13 0.00 0.00 178.44 177.38 3kbz n TYR 57 N -3.55 1.75 -1.10 1.25 4.02 -0.79 -4.96 117.16 113.77 3kbz n TYR 57 Ca -0.01 -0.76 0.00 0.00 -0.01 0.00 0.00 57.90 57.12 3kbz n TYR 57 Cb 0.38 -0.44 0.00 0.00 -0.02 0.00 0.00 39.34 39.25 3kbz n TYR 57 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3kbz n GLY 58 N 0.35 0.56 0.29 2.72 0.00 -1.14 -4.96 105.19 103.02 3kbz n GLY 58 Ca 0.26 -0.83 0.07 0.00 0.00 0.00 0.00 46.02 45.52 3kbz n GLY 58 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3kbz h ILE 59 N 0.00 1.03 -0.49 -0.61 2.10 -1.66 -0.78 117.51 117.10 3kbz h ILE 59 Ca 0.00 -0.09 0.00 0.00 1.08 0.00 0.00 64.86 65.85 3kbz h ILE 59 Cb 0.29 0.76 0.00 0.00 -1.09 0.00 0.00 36.82 36.77 3kbz h ILE 59 CO 0.00 0.05 0.00 0.00 -1.08 0.00 0.00 178.15 177.12 3kbz n ALA 60 N -2.52 3.10 -0.37 0.18 0.00 -1.26 -5.08 120.51 114.56 3kbz n ALA 60 Ca 0.01 -1.79 0.00 0.00 0.00 0.00 0.00 53.44 51.66 3kbz n ALA 60 Cb 0.11 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 18.68 3kbz n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kbz n GLY 61 N 0.52 0.73 3.94 0.00 0.00 -0.30 -5.21 105.19 104.87 3kbz n GLY 61 Ca 0.23 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.01 3kbz n GLY 61 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kbz s LYS 71 N -0.63 2.80 0.60 1.61 -2.85 -1.26 -4.74 119.74 115.27 3kbz s LYS 71 Ca 0.00 -0.29 -0.19 0.00 -1.00 0.00 0.00 55.97 54.49 3kbz s LYS 71 Cb 0.00 -2.37 -0.03 0.00 -2.06 0.00 0.00 37.83 33.37 3kbz s LYS 71 CO 0.00 -0.66 1.23 1.17 0.10 0.00 0.00 175.35 177.19 3kbz n LYS 72 N -2.46 1.25 -0.30 1.78 4.81 -1.26 -4.76 118.16 117.21 3kbz n LYS 72 Ca 0.05 0.48 -0.01 0.00 -0.87 0.00 0.00 58.31 57.95 3kbz n LYS 72 Cb 0.58 -2.45 0.11 0.00 0.02 0.00 0.00 35.03 33.29 3kbz n LYS 72 CO 0.00 0.00 0.00 1.25 1.17 0.00 0.00 177.40 179.82 3kbz h LEU 73 N 0.82 0.88 -0.87 3.14 5.85 -1.99 -0.30 115.31 122.83 3kbz h LEU 73 Ca -0.50 -0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.14 3kbz h LEU 73 Cb 1.33 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 42.15 3kbz h LEU 73 CO 0.54 0.60 -0.02 -2.24 -0.34 0.00 0.00 178.44 176.98 3kbz h ASP 74 N 1.03 0.79 -0.26 1.25 -0.00 -1.93 0.89 116.42 118.18 3kbz h ASP 74 Ca 0.34 -0.20 -0.07 0.00 -0.00 0.00 0.00 57.03 57.10 3kbz h ASP 74 Cb 0.03 -0.21 -0.01 0.00 -0.00 0.00 0.00 39.33 39.15 3kbz h ASP 74 CO -0.12 0.86 -0.11 0.58 -0.00 0.00 0.00 179.24 180.45 3kbz h VAL 75 N 0.76 1.29 -0.40 4.15 2.07 -1.80 -0.94 116.25 121.38 3kbz h VAL 75 Ca 0.14 -1.18 -0.01 0.00 0.82 0.00 0.00 66.70 66.48 3kbz h VAL 75 Cb 0.48 1.51 -0.02 0.00 -1.52 0.00 0.00 31.29 31.74 3kbz h VAL 75 CO 0.02 0.37 0.22 0.25 0.02 0.00 0.00 177.57 178.46 3kbz h LEU 76 N 0.28 0.50 -0.59 2.57 5.85 -0.82 0.10 115.31 123.21 3kbz h LEU 76 Ca 0.06 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.72 3kbz h LEU 76 Cb 0.61 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.48 3kbz h LEU 76 CO 0.04 0.45 0.36 0.28 -0.34 0.00 0.00 178.44 179.22 3kbz h SER 77 N 0.52 0.59 -0.70 1.25 0.02 -0.73 0.60 113.55 115.10 3kbz h SER 77 Ca 0.14 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.07 3kbz h SER 77 Cb 0.05 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 3kbz h SER 77 CO -0.02 0.41 0.35 -1.13 -1.14 0.00 0.00 176.83 175.30 3kbz h ASN 78 N 0.71 0.90 -0.40 3.07 -1.24 -0.74 -2.00 115.58 115.88 3kbz h ASN 78 Ca 0.23 -0.12 -0.03 0.00 0.71 0.00 0.00 56.30 57.09 3kbz h ASN 78 Cb 0.01 -0.23 -0.02 0.00 0.73 0.00 0.00 38.32 38.81 3kbz h ASN 78 CO -0.10 0.77 0.14 0.44 -1.29 0.00 0.00 177.43 177.40 3kbz h ASP 79 N 0.96 0.57 -0.00 1.15 3.32 -0.25 -0.96 116.42 121.21 3kbz h ASP 79 Ca 0.24 -0.18 0.02 0.00 0.02 0.00 0.00 57.03 57.12 3kbz h ASP 79 Cb 0.10 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 3kbz h ASP 79 CO -0.03 0.60 -0.10 -0.07 -1.72 0.00 0.00 179.24 177.91 3kbz h LEU 80 N 0.50 -0.30 0.03 1.55 3.38 -0.61 0.97 115.31 120.83 3kbz h LEU 80 Ca 0.13 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 3kbz h LEU 80 Cb 0.22 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3kbz h LEU 80 CO -0.01 -0.15 -0.02 0.58 0.09 0.00 0.00 178.44 178.94 3kbz h VAL 81 N -0.18 1.05 -0.12 1.22 2.07 -1.32 -0.96 116.25 118.01 3kbz h VAL 81 Ca 0.04 -0.26 0.05 0.00 0.82 0.00 0.00 66.70 67.34 3kbz h VAL 81 Cb 0.23 1.23 -0.05 0.00 -1.52 0.00 0.00 31.29 31.17 3kbz h VAL 81 CO -0.11 0.07 -0.22 0.24 0.02 0.00 0.00 177.57 177.56 3kbz h MET 82 N -0.16 -0.28 -0.56 1.57 2.86 -1.00 0.15 114.93 117.51 3kbz h MET 82 Ca -0.00 0.02 -0.06 0.00 -2.06 0.00 0.00 59.70 57.60 3kbz h MET 82 Cb 0.14 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.85 3kbz h MET 82 CO 0.01 -0.19 0.13 -0.97 1.06 0.00 0.00 176.91 176.95 3kbz h ASN 83 N -0.29 0.86 -0.52 1.22 -0.73 -0.76 -0.80 115.58 114.56 3kbz h ASN 83 Ca 0.10 -0.24 -0.06 0.00 1.87 0.00 0.00 56.30 57.97 3kbz h ASN 83 Cb 0.43 -0.23 -0.02 0.00 0.27 0.00 0.00 38.32 38.78 3kbz h ASN 83 CO -0.29 0.87 0.08 0.24 -0.37 0.00 0.00 177.43 177.96 3kbz h MET 84 N 0.80 0.86 -0.20 6.67 2.86 -0.92 -1.45 114.93 123.56 3kbz h MET 84 Ca 0.17 -0.23 -0.03 0.00 -2.06 0.00 0.00 59.70 57.55 3kbz h MET 84 Cb 0.36 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 3kbz h MET 84 CO 0.00 0.85 -0.01 -0.07 1.06 0.00 0.00 176.91 178.74 3kbz h LEU 85 N 0.75 0.35 -0.14 1.22 3.38 -0.88 -2.31 115.31 117.69 3kbz h LEU 85 Ca 0.16 -0.32 0.02 0.00 0.09 0.00 0.00 57.88 57.83 3kbz h LEU 85 Cb 0.41 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 3kbz h LEU 85 CO 0.01 0.59 -0.02 0.11 0.09 0.00 0.00 178.44 179.23 3kbz h LYS 86 N 0.11 0.02 0.00 1.13 1.57 -1.11 -2.03 116.57 116.26 3kbz h LYS 86 Ca 0.05 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 3kbz h LYS 86 Cb 0.42 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.72 3kbz h LYS 86 CO 0.01 0.02 0.00 -1.13 -0.57 0.00 0.00 179.45 177.78 3kbz n SER 87 N -5.14 0.00 0.17 0.86 3.41 -0.55 -2.20 113.62 110.17 3kbz n SER 87 Ca -0.04 0.15 0.12 0.00 -0.26 0.00 0.00 58.87 58.84 3kbz n SER 87 Cb 0.09 -0.30 0.24 0.00 -0.26 0.00 0.00 64.21 63.97 3kbz n SER 87 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3kbz h SER 88 N 0.00 0.00 -0.53 4.04 4.64 -0.78 -3.47 113.55 117.46 3kbz h SER 88 Ca 0.00 -0.01 -0.23 0.00 -0.47 0.00 0.00 61.79 61.09 3kbz h SER 88 Cb 0.12 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.12 3kbz h SER 88 CO 0.00 0.00 -0.21 0.49 -0.87 0.00 0.00 176.83 176.25 3kbz n PHE 89 N -2.78 0.00 0.56 4.77 3.01 -0.94 -4.76 117.46 117.32 3kbz n PHE 89 Ca 0.04 0.00 0.06 0.00 1.01 0.00 0.00 57.45 58.57 3kbz n PHE 89 Cb 0.50 -2.40 0.01 0.00 -0.01 0.00 0.00 39.48 37.57 3kbz n PHE 89 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3kbz n ALA 90 N 1.21 2.89 -2.52 4.37 0.00 -1.26 -3.26 120.51 121.94 3kbz n ALA 90 Ca -0.11 -0.50 -0.25 0.00 0.00 0.00 0.00 53.44 52.58 3kbz n ALA 90 Cb 0.48 -0.45 -0.11 0.00 0.00 0.00 0.00 19.45 19.38 3kbz n ALA 90 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3kbz s THR 91 N -1.51 1.94 0.00 0.00 -4.23 -1.26 -0.76 115.64 109.83 3kbz s THR 91 Ca 0.11 -2.13 0.00 0.00 -1.18 0.00 0.00 61.69 58.49 3kbz s THR 91 Cb 0.10 -2.66 0.00 0.00 1.34 0.00 0.00 72.50 71.29 3kbz s THR 91 CO 0.29 -0.18 0.00 0.00 -0.54 0.00 0.00 174.62 174.19 3kbz s VAL 93 N -1.13 0.71 -0.13 0.00 1.01 -1.25 -1.65 120.40 117.96 3kbz s VAL 93 Ca 0.00 -0.19 0.01 0.00 0.00 0.00 0.00 61.98 61.80 3kbz s VAL 93 Cb 0.00 -0.72 0.02 0.00 0.00 0.00 0.00 36.38 35.68 3kbz s VAL 93 CO 0.00 0.27 -0.14 -0.76 0.00 0.00 0.00 175.10 174.48 3kbz s LEU 94 N 1.07 1.65 -0.18 3.92 1.43 0.03 -1.65 118.68 124.95 3kbz s LEU 94 Ca -0.08 -0.44 -0.02 0.00 -1.03 0.00 0.00 54.13 52.55 3kbz s LEU 94 Cb -0.14 -1.11 -0.01 0.00 0.03 0.00 0.00 46.19 44.96 3kbz s LEU 94 CO -0.01 -0.03 -0.09 -0.69 0.23 0.00 0.00 176.35 175.76 3kbz s VAL 95 N 1.31 3.20 0.06 -1.59 1.01 0.27 -0.16 120.40 124.51 3kbz s VAL 95 Ca 0.00 -0.58 0.06 0.00 0.00 0.00 0.00 61.98 61.47 3kbz s VAL 95 Cb -0.14 -2.40 -0.03 0.00 0.00 0.00 0.00 36.38 33.81 3kbz s VAL 95 CO -0.07 0.48 -0.16 -0.55 0.00 0.00 0.00 175.10 174.80 3kbz s SER 96 N 0.92 1.90 0.17 3.32 0.15 -1.26 -0.15 113.70 118.76 3kbz s SER 96 Ca -0.02 -0.54 0.18 0.00 0.70 0.00 0.00 55.95 56.27 3kbz s SER 96 Cb -0.15 -0.11 0.79 0.00 -1.71 0.00 0.00 66.02 64.84 3kbz s SER 96 CO 0.00 0.02 1.54 1.21 1.20 0.00 0.00 173.24 177.21 3kbz n GLU 97 N 1.61 0.11 0.08 5.44 2.13 -0.96 -2.09 120.64 126.96 3kbz n GLU 97 Ca -0.19 0.44 0.12 0.00 0.66 0.00 0.00 57.16 58.19 3kbz n GLU 97 Cb 0.54 -1.74 0.20 0.00 0.27 0.00 0.00 31.44 30.70 3kbz n GLU 97 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 3kbz h GLU 98 N 0.00 0.00 -5.05 5.31 4.39 -1.95 -3.45 114.58 113.82 3kbz h GLU 98 Ca 0.00 0.00 -0.64 0.00 0.34 0.00 0.00 59.36 59.06 3kbz h GLU 98 Cb 0.21 0.00 -0.34 0.00 -0.10 0.00 0.00 28.75 28.52 3kbz h GLU 98 CO 0.00 0.00 -0.86 -0.51 -1.16 0.00 0.00 179.01 176.48 3kbz s ASP 99 N -4.54 2.78 0.28 1.42 1.01 -0.89 -5.02 116.67 111.70 3kbz s ASP 99 Ca 0.06 -0.51 -0.01 0.00 0.71 0.00 0.00 52.55 52.81 3kbz s ASP 99 Cb 0.12 -1.27 0.48 0.00 1.01 0.00 0.00 42.92 43.26 3kbz s ASP 99 CO 0.70 0.09 1.87 0.50 0.21 0.00 0.00 175.17 178.53 3kbz h LYS 100 N 7.10 1.06 -6.28 8.23 3.64 -1.88 -3.42 116.57 125.01 3kbz h LYS 100 Ca -0.27 -0.06 -0.61 0.00 -1.27 0.00 0.00 60.65 58.43 3kbz h LYS 100 Cb 1.20 -0.24 -0.10 0.00 -0.41 0.00 0.00 32.23 32.68 3kbz h LYS 100 CO 0.50 0.70 -0.63 -1.01 -2.27 0.00 0.00 179.45 176.75 3kbz s HIS 101 N -5.99 3.01 0.32 1.91 3.76 -1.26 -4.98 115.29 112.06 3kbz s HIS 101 Ca -0.12 -0.05 -0.29 0.00 -0.15 0.00 0.00 55.06 54.45 3kbz s HIS 101 Cb 0.21 -1.49 -0.10 0.00 1.11 0.00 0.00 32.58 32.31 3kbz s HIS 101 CO 0.81 0.51 1.33 0.00 -0.85 0.00 0.00 174.74 176.54 3kbz s ALA 102 N -1.58 3.52 0.04 -1.40 0.00 -1.26 -4.83 121.76 116.24 3kbz s ALA 102 Ca 0.28 1.29 -0.22 0.00 0.00 0.00 0.00 51.96 53.31 3kbz s ALA 102 Cb -0.10 -3.50 -0.06 0.00 0.00 0.00 0.00 23.12 19.46 3kbz s ALA 102 CO 0.20 -0.68 0.66 0.42 0.00 0.00 0.00 175.76 176.36 3kbz s ILE 103 N -0.99 4.78 -0.23 0.00 1.09 0.77 -4.90 121.20 121.72 3kbz s ILE 103 Ca 0.50 1.39 -0.06 0.00 -1.10 0.00 0.00 60.65 61.39 3kbz s ILE 103 Cb -0.40 -4.00 -0.02 0.00 -1.06 0.00 0.00 42.46 36.98 3kbz s ILE 103 CO 0.52 0.43 0.02 -0.63 -0.10 0.00 0.00 174.94 175.19 3kbz s ILE 104 N -0.37 3.93 0.28 2.92 -1.09 -1.26 -0.79 121.20 124.83 3kbz s ILE 104 Ca 0.33 -0.30 -0.29 0.00 -2.23 0.00 0.00 60.65 58.16 3kbz s ILE 104 Cb -0.19 -2.82 -0.10 0.00 -1.58 0.00 0.00 42.46 37.77 3kbz s ILE 104 CO 0.20 0.38 1.31 -0.69 -1.23 0.00 0.00 174.94 174.90 3kbz s VAL 105 N 1.51 2.90 0.55 2.92 1.01 -0.66 -4.96 120.40 123.67 3kbz s VAL 105 Ca 0.06 0.84 -0.22 0.00 0.00 0.00 0.00 61.98 62.66 3kbz s VAL 105 Cb -0.15 -3.53 -0.05 0.00 0.00 0.00 0.00 36.38 32.65 3kbz s VAL 105 CO 0.01 0.17 1.34 -1.83 0.00 0.00 0.00 175.10 174.80 3kbz s GLU 106 N -1.14 3.15 0.29 2.72 -1.05 -1.26 -4.76 118.70 116.65 3kbz s GLU 106 Ca 0.52 2.20 -0.02 0.00 -0.15 0.00 0.00 54.97 57.51 3kbz s GLU 106 Cb -0.38 -2.25 0.62 0.00 -0.44 0.00 0.00 34.13 31.68 3kbz s GLU 106 CO 0.47 -1.17 1.58 -1.35 0.95 0.00 0.00 175.26 175.73 3kbz h PRO 107 N 1.45 0.02 0.00 -4.83 0.11 -1.99 -1.14 132.00 125.62 3kbz h PRO 107 Ca -0.51 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3kbz h PRO 107 Cb 1.30 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 3kbz h PRO 107 CO 0.57 0.01 0.00 0.39 -0.21 0.00 0.00 178.00 178.76 3kbz n GLU 108 N -5.51 0.24 0.00 1.05 1.02 -1.26 -2.62 120.64 113.56 3kbz n GLU 108 Ca 0.20 0.12 0.00 0.00 -0.02 0.00 0.00 57.16 57.46 3kbz n GLU 108 Cb 0.64 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.56 3kbz n GLU 108 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3kbz n LYS 109 N -1.21 1.81 -2.32 3.49 5.02 -0.44 -5.05 118.16 119.46 3kbz n LYS 109 Ca 0.07 -1.11 -0.41 0.00 -2.02 0.00 0.00 58.31 54.84 3kbz n LYS 109 Cb 0.09 -0.84 -0.03 0.00 -0.02 0.00 0.00 35.03 34.23 3kbz n LYS 109 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3kbz s ARG 110 N -0.62 4.46 0.38 1.97 0.52 -1.08 -3.89 118.95 120.69 3kbz s ARG 110 Ca 0.00 1.93 0.00 0.00 -0.52 0.00 0.00 55.73 57.15 3kbz s ARG 110 Cb 0.00 -3.23 -0.00 0.00 0.52 0.00 0.00 34.95 32.24 3kbz s ARG 110 CO 0.00 -0.14 0.02 0.41 0.02 0.00 0.00 175.30 175.60 3kbz n GLY 111 N 2.25 3.67 0.61 -3.53 0.00 0.29 -4.72 105.19 103.76 3kbz n GLY 111 Ca 0.05 -2.30 0.11 0.00 0.00 0.00 0.00 46.02 43.89 3kbz n GLY 111 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3kbz n LYS 112 N -0.94 1.81 -3.99 1.61 2.85 -1.06 -3.41 118.16 115.04 3kbz n LYS 112 Ca -0.15 -1.21 -0.30 0.00 -1.05 0.00 0.00 58.31 55.61 3kbz n LYS 112 Cb 0.49 -1.43 -0.05 0.00 -0.65 0.00 0.00 35.03 33.40 3kbz n LYS 112 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 3kbz s TYR 113 N -1.82 3.36 -0.11 5.58 2.02 0.06 -0.23 117.35 126.21 3kbz s TYR 113 Ca 0.34 0.14 0.02 0.00 -0.37 0.00 0.00 57.07 57.20 3kbz s TYR 113 Cb 0.19 -1.67 -0.01 0.00 -0.40 0.00 0.00 41.96 40.06 3kbz s TYR 113 CO 0.28 0.55 -0.18 0.08 -1.57 0.00 0.00 175.55 174.72 3kbz s VAL 114 N -1.51 2.65 -0.09 0.71 1.01 0.92 -0.96 120.40 123.13 3kbz s VAL 114 Ca 0.32 -0.81 0.02 0.00 0.00 0.00 0.00 61.98 61.51 3kbz s VAL 114 Cb -0.12 -2.07 0.01 0.00 0.00 0.00 0.00 36.38 34.20 3kbz s VAL 114 CO 0.25 0.54 -0.15 -0.69 0.00 0.00 0.00 175.10 175.06 3kbz s VAL 115 N 0.23 1.41 -0.13 2.92 1.01 -0.66 -0.56 120.40 124.62 3kbz s VAL 115 Ca -0.11 -0.62 -0.01 0.00 0.00 0.00 0.00 61.98 61.23 3kbz s VAL 115 Cb -0.16 -1.28 -0.02 0.00 0.00 0.00 0.00 36.38 34.92 3kbz s VAL 115 CO 0.06 0.42 -0.09 0.00 0.00 0.00 0.00 175.10 175.50 3kbz s PHE 117 N 0.22 -0.17 -0.30 0.00 -0.71 0.78 -0.95 117.98 116.85 3kbz s PHE 117 Ca -0.05 -0.15 0.03 0.00 -1.04 0.00 0.00 56.93 55.72 3kbz s PHE 117 Cb -0.15 0.32 0.08 0.00 -1.21 0.00 0.00 43.02 42.06 3kbz s PHE 117 CO 0.04 -0.80 -0.02 0.34 -1.34 0.00 0.00 175.22 173.44 3kbz s ASP 118 N -2.83 4.61 0.22 1.98 -1.08 -0.22 -2.28 116.67 117.07 3kbz s ASP 118 Ca 0.06 -1.81 -0.10 0.00 -0.52 0.00 0.00 52.55 50.17 3kbz s ASP 118 Cb 0.01 -1.58 0.32 0.00 -1.46 0.00 0.00 42.92 40.20 3kbz s ASP 118 CO -0.08 -0.30 1.65 -0.65 0.52 0.00 0.00 175.17 176.32 3kbz h PRO 119 N 7.69 0.10 -1.96 4.34 0.11 -1.87 -2.41 132.00 138.00 3kbz h PRO 119 Ca -0.11 -0.01 -0.45 0.00 0.11 0.00 0.00 66.00 65.55 3kbz h PRO 119 Cb 1.03 -0.02 -0.31 0.00 0.11 0.00 0.00 31.00 31.80 3kbz h PRO 119 CO 0.49 0.06 -0.81 -1.17 -0.21 0.00 0.00 178.00 176.37 3kbz s LEU 120 N -10.73 0.44 0.15 2.35 2.96 -1.25 -4.35 118.68 108.26 3kbz s LEU 120 Ca -0.14 -2.49 -0.31 0.00 -0.22 0.00 0.00 54.13 50.97 3kbz s LEU 120 Cb 0.20 0.31 -0.10 0.00 0.50 0.00 0.00 46.19 47.10 3kbz s LEU 120 CO 0.74 -0.16 1.60 -0.62 -1.32 0.00 0.00 176.35 176.59 3kbz s ASP 121 N 0.50 6.57 0.00 3.68 2.15 0.25 -2.38 116.67 127.44 3kbz s ASP 121 Ca 0.29 2.61 0.00 0.00 0.43 0.00 0.00 52.55 55.89 3kbz s ASP 121 Cb -0.01 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 40.02 3kbz s ASP 121 CO -0.13 -0.85 0.00 0.61 -0.17 0.00 0.00 175.17 174.63 3kbz n GLY 122 N 3.82 0.65 0.00 2.66 0.00 -1.26 -2.37 105.19 108.69 3kbz n GLY 122 Ca 0.14 -0.03 0.06 0.00 0.00 0.00 0.00 46.02 46.19 3kbz n GLY 122 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3kbz n SER 123 N 0.06 0.00 0.02 1.61 3.41 -1.00 -2.73 113.62 114.99 3kbz n SER 123 Ca 0.00 -0.78 -0.11 0.00 -0.26 0.00 0.00 58.87 57.72 3kbz n SER 123 Cb 0.00 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 63.82 3kbz n SER 123 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3kbz h SER 124 N 0.00 0.12 -0.44 4.04 0.02 -1.92 -3.29 113.55 112.09 3kbz h SER 124 Ca 0.00 -0.18 -0.03 0.00 -0.84 0.00 0.00 61.79 60.73 3kbz h SER 124 Cb 0.00 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 3kbz h SER 124 CO 0.00 1.16 0.03 -3.20 -1.14 0.00 0.00 176.83 173.68 3kbz n ASN 125 N -3.26 4.62 -0.08 3.07 5.15 -1.11 -4.65 115.26 119.01 3kbz n ASN 125 Ca -0.13 -3.05 0.11 0.00 -0.60 0.00 0.00 54.58 50.91 3kbz n ASN 125 Cb 1.02 -0.63 0.49 0.00 -0.53 0.00 0.00 39.78 40.13 3kbz n ASN 125 CO 0.00 0.00 0.00 -0.29 1.40 0.00 0.00 177.26 178.37 3kbz h ILE 126 N 2.66 0.92 -0.07 -1.44 6.09 -1.62 -2.78 117.51 121.28 3kbz h ILE 126 Ca 0.04 -0.15 0.02 0.00 -1.37 0.00 0.00 64.86 63.40 3kbz h ILE 126 Cb 1.76 0.45 -0.00 0.00 0.47 0.00 0.00 36.82 39.50 3kbz h ILE 126 CO 0.39 0.08 0.26 0.44 -3.07 0.00 0.00 178.15 176.25 3kbz h ASP 127 N 0.44 0.00 -0.49 2.19 5.19 -1.87 0.26 116.42 122.14 3kbz h ASP 127 Ca 0.26 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.67 3kbz h ASP 127 Cb 0.46 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.97 3kbz h ASP 127 CO -0.07 0.00 0.00 0.00 -3.12 0.00 0.00 179.24 176.05 3kbz n LEU 129 N 1.15 -1.41 -4.75 0.00 4.77 0.93 -4.98 117.00 112.72 3kbz n LEU 129 Ca 0.19 0.22 -0.35 0.00 -0.03 0.00 0.00 56.01 56.04 3kbz n LEU 129 Cb 0.49 -2.35 0.04 0.00 -2.33 0.00 0.00 43.42 39.28 3kbz n LEU 129 CO 0.14 -0.56 0.82 0.54 -1.33 0.00 0.00 177.39 177.00 3kbz s VAL 130 N -2.69 2.68 0.48 4.08 0.11 -1.26 -4.93 120.40 118.87 3kbz s VAL 130 Ca 0.00 0.39 -0.23 0.00 -2.93 0.00 0.00 61.98 59.21 3kbz s VAL 130 Cb 0.00 -3.09 -0.08 0.00 -1.53 0.00 0.00 36.38 31.68 3kbz s VAL 130 CO 0.00 -0.12 1.22 -1.20 -3.33 0.00 0.00 175.10 171.67 3kbz n SER 131 N -1.85 2.17 -4.32 3.54 7.64 -1.26 -4.87 113.62 114.67 3kbz n SER 131 Ca 0.13 1.03 -0.17 0.00 1.01 0.00 0.00 58.87 60.87 3kbz n SER 131 Cb 0.50 -1.48 -0.10 0.00 -1.01 0.00 0.00 64.21 62.11 3kbz n SER 131 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 3kbz s VAL 132 N -1.27 0.59 0.32 0.44 -7.23 -1.22 -4.77 120.40 107.26 3kbz s VAL 132 Ca 0.66 -2.00 -0.18 0.00 -1.81 0.00 0.00 61.98 58.65 3kbz s VAL 132 Cb -0.48 -2.62 0.06 0.00 0.56 0.00 0.00 36.38 33.90 3kbz s VAL 132 CO 0.54 -0.03 0.86 -0.83 -0.31 0.00 0.00 175.10 175.33 3kbz s GLY 133 N -3.31 0.27 -0.11 2.32 0.00 -1.00 -0.37 107.32 105.12 3kbz s GLY 133 Ca 0.37 -0.60 0.03 0.00 0.00 0.00 0.00 44.72 44.52 3kbz s GLY 133 CO 0.13 0.45 -0.20 -1.59 0.00 0.00 0.00 173.10 171.89 3kbz s THR 134 N -2.35 1.82 -0.04 0.90 2.01 -0.38 0.86 115.64 118.45 3kbz s THR 134 Ca 0.17 -0.86 0.04 0.00 0.31 0.00 0.00 61.69 61.35 3kbz s THR 134 Cb -0.04 -1.61 -0.03 0.00 0.01 0.00 0.00 72.50 70.83 3kbz s THR 134 CO 0.09 0.51 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.75 3kbz s ILE 135 N 0.67 3.05 -0.00 1.82 1.01 -0.91 -0.45 121.20 126.39 3kbz s ILE 135 Ca -0.12 -0.75 -0.12 0.00 0.00 0.00 0.00 60.65 59.66 3kbz s ILE 135 Cb -0.16 -2.20 0.01 0.00 0.01 0.00 0.00 42.46 40.12 3kbz s ILE 135 CO 0.03 0.57 0.23 0.72 0.00 0.00 0.00 174.94 176.49 3kbz s PHE 136 N -0.75 -0.08 -0.02 3.97 -0.12 -0.70 -1.05 117.98 119.23 3kbz s PHE 136 Ca 0.12 0.06 0.01 0.00 -0.05 0.00 0.00 56.93 57.07 3kbz s PHE 136 Cb -0.11 0.03 0.02 0.00 -0.63 0.00 0.00 43.02 42.33 3kbz s PHE 136 CO 0.01 -0.36 -0.01 0.20 -0.05 0.00 0.00 175.22 175.01 3kbz s GLY 137 N -1.43 0.23 -0.15 1.99 0.00 -0.12 -1.93 107.32 105.91 3kbz s GLY 137 Ca -0.13 0.06 0.00 0.00 0.00 0.00 0.00 44.72 44.65 3kbz s GLY 137 CO 0.02 0.36 -0.15 -0.42 0.00 0.00 0.00 173.10 172.92 3kbz s ILE 138 N 0.67 2.71 0.25 0.90 1.01 0.91 -1.67 121.20 125.98 3kbz s ILE 138 Ca -0.07 -0.76 0.12 0.00 0.00 0.00 0.00 60.65 59.94 3kbz s ILE 138 Cb -0.10 -2.14 -0.05 0.00 0.01 0.00 0.00 42.46 40.18 3kbz s ILE 138 CO -0.01 0.51 -0.21 -0.31 0.00 0.00 0.00 174.94 174.92 3kbz s TYR 139 N 0.77 2.30 -0.18 3.97 1.51 0.28 -0.73 117.35 125.27 3kbz s TYR 139 Ca -0.06 -0.34 -0.12 0.00 -1.01 0.00 0.00 57.07 55.54 3kbz s TYR 139 Cb -0.15 -1.04 -0.05 0.00 -0.11 0.00 0.00 41.96 40.61 3kbz s TYR 139 CO 0.01 0.64 0.24 0.50 -1.11 0.00 0.00 175.55 175.83 3kbz s ARG 140 N -3.22 4.23 0.07 -0.62 3.52 -1.26 -0.06 118.95 121.62 3kbz s ARG 140 Ca 0.27 -0.02 -0.31 0.00 -0.13 0.00 0.00 55.73 55.54 3kbz s ARG 140 Cb -0.06 -3.43 -0.10 0.00 -1.56 0.00 0.00 34.95 29.80 3kbz s ARG 140 CO 0.13 0.25 1.89 1.17 -0.81 0.00 0.00 175.30 177.93 3kbz n LYS 141 N 3.60 2.76 -0.21 5.12 4.81 0.68 -4.85 118.16 130.06 3kbz n LYS 141 Ca -0.13 1.01 0.11 0.00 -0.87 0.00 0.00 58.31 58.42 3kbz n LYS 141 Cb 0.52 -2.92 0.26 0.00 0.02 0.00 0.00 35.03 32.91 3kbz n LYS 141 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 3kbz n LYS 142 N 6.45 2.33 -4.34 1.64 4.81 -1.26 -4.97 118.16 122.82 3kbz n LYS 142 Ca 0.19 -2.04 -0.24 0.00 -0.87 0.00 0.00 58.31 55.35 3kbz n LYS 142 Cb 0.38 -1.48 -0.08 0.00 0.02 0.00 0.00 35.03 33.86 3kbz n LYS 142 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 3kbz s SER 143 N -1.33 4.18 0.00 3.14 1.04 -1.26 -5.04 113.70 114.42 3kbz s SER 143 Ca 0.38 -0.96 0.18 0.00 0.48 0.00 0.00 55.95 56.03 3kbz s SER 143 Cb 0.21 -0.55 -0.09 0.00 0.10 0.00 0.00 66.02 65.70 3kbz s SER 143 CO 0.29 -0.20 0.84 0.41 0.98 0.00 0.00 173.24 175.57 3kbz n THR 144 N -0.93 0.00 -1.51 2.02 -1.04 -1.26 -5.01 114.28 106.56 3kbz n THR 144 Ca -0.04 -0.22 0.00 0.00 -2.04 0.00 0.00 64.05 61.75 3kbz n THR 144 Cb 0.62 1.12 0.00 0.00 -1.82 0.00 0.00 70.33 70.25 3kbz n THR 144 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 3kbz n ASP 145 N -0.66 0.00 -4.73 8.00 5.75 -1.26 -5.04 116.55 118.61 3kbz n ASP 145 Ca 0.06 -0.43 -0.42 0.00 -0.01 0.00 0.00 54.79 53.99 3kbz n ASP 145 Cb 0.33 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.39 3kbz n ASP 145 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 3kbz s GLU 146 N -0.13 4.44 0.24 0.11 2.02 -1.26 -4.96 118.70 119.16 3kbz s GLU 146 Ca 0.00 1.88 -0.31 0.00 0.02 0.00 0.00 54.97 56.56 3kbz s GLU 146 Cb 0.00 -3.27 -0.14 0.00 0.10 0.00 0.00 34.13 30.82 3kbz s GLU 146 CO 0.00 -0.20 1.37 -2.30 0.02 0.00 0.00 175.26 174.15 3kbz n PRO 147 N 3.18 1.93 -4.01 0.39 -0.02 -1.26 -4.97 135.00 130.23 3kbz n PRO 147 Ca 0.07 0.69 -0.13 0.00 -2.02 0.00 0.00 63.50 62.11 3kbz n PRO 147 Cb 0.45 -2.32 -0.03 0.00 -0.02 0.00 0.00 33.50 31.58 3kbz n PRO 147 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3kbz s SER 148 N 0.23 0.56 0.53 2.55 1.04 -1.26 -5.02 113.70 112.34 3kbz s SER 148 Ca 0.68 -1.33 0.22 0.00 0.48 0.00 0.00 55.95 56.01 3kbz s SER 148 Cb -0.67 0.70 1.38 0.00 0.10 0.00 0.00 66.02 67.53 3kbz s SER 148 CO 0.50 -1.37 2.08 -0.08 0.98 0.00 0.00 173.24 175.35 3kbz h GLU 149 N 2.10 0.00 -0.24 4.02 4.81 -1.93 -1.89 114.58 121.45 3kbz h GLU 149 Ca -0.29 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.01 3kbz h GLU 149 Cb 1.24 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.61 3kbz h GLU 149 CO 0.39 0.00 0.17 0.87 -0.73 0.00 0.00 179.01 179.71 3kbz h LYS 150 N 0.00 0.02 0.00 1.92 1.79 -1.96 -1.60 116.57 116.73 3kbz h LYS 150 Ca 0.12 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.59 3kbz h LYS 150 Cb 0.52 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.16 3kbz h LYS 150 CO -0.00 0.01 0.00 -0.44 -1.08 0.00 0.00 179.45 177.94 3kbz h ASP 151 N 0.02 0.00 -0.06 0.86 3.32 -1.74 -2.15 116.42 116.68 3kbz h ASP 151 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 3kbz h ASP 151 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 3kbz h ASP 151 CO -0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 3kbz n ALA 152 N -1.80 2.50 -2.48 3.45 0.00 -0.60 -4.50 120.51 117.09 3kbz n ALA 152 Ca 0.02 -0.61 -0.41 0.00 0.00 0.00 0.00 53.44 52.44 3kbz n ALA 152 Cb 0.21 -0.96 0.01 0.00 0.00 0.00 0.00 19.45 18.71 3kbz n ALA 152 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3kbz n LEU 153 N 0.87 7.52 -4.50 0.00 4.77 -0.81 -4.95 117.00 119.90 3kbz n LEU 153 Ca 0.16 -5.25 -0.30 0.00 -0.03 0.00 0.00 56.01 50.60 3kbz n LEU 153 Cb 0.50 -1.23 -0.11 0.00 -2.33 0.00 0.00 43.42 40.25 3kbz n LEU 153 CO 0.16 2.04 -0.47 -1.10 -1.33 0.00 0.00 177.39 176.68 3kbz s GLN 154 N -3.41 1.98 0.44 3.23 -0.21 -1.26 -4.65 119.66 115.78 3kbz s GLN 154 Ca 0.43 -1.06 -0.24 0.00 0.02 0.00 0.00 55.36 54.51 3kbz s GLN 154 Cb 0.18 -2.20 -0.08 0.00 1.00 0.00 0.00 33.01 31.92 3kbz s GLN 154 CO -0.11 0.51 1.19 -1.25 -2.12 0.00 0.00 175.29 173.50 3kbz s PRO 155 N -1.90 3.83 0.64 2.91 0.04 -1.26 -4.71 135.00 134.56 3kbz s PRO 155 Ca 0.18 1.84 0.23 0.00 0.04 0.00 0.00 61.00 63.29 3kbz s PRO 155 Cb -0.11 -2.51 1.26 0.00 0.04 0.00 0.00 34.50 33.19 3kbz s PRO 155 CO 0.09 -0.51 1.70 0.78 0.04 0.00 0.00 177.00 179.11 3kbz h GLY 156 N 2.25 0.00 2.00 0.56 0.00 -1.55 0.58 103.07 106.91 3kbz h GLY 156 Ca -0.49 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 46.84 3kbz h GLY 156 CO 0.61 0.00 -0.00 -0.09 0.00 0.00 0.00 176.54 177.06 3kbz h ARG 157 N 0.00 0.00 -0.00 4.80 9.65 -1.34 -1.66 114.38 125.82 3kbz h ARG 157 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 3kbz h ARG 157 Cb 0.92 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.50 3kbz h ARG 157 CO 0.00 0.00 -0.11 0.09 2.80 0.00 0.00 179.97 182.75 3kbz n ASN 158 N -3.91 0.55 -4.66 -3.80 5.03 0.19 -4.94 115.26 103.73 3kbz n ASN 158 Ca -0.03 -0.67 -0.44 0.00 0.87 0.00 0.00 54.58 54.31 3kbz n ASN 158 Cb 0.08 -0.05 -0.02 0.00 -1.02 0.00 0.00 39.78 38.78 3kbz n ASN 158 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 3kbz n LEU 159 N -0.87 2.87 -0.05 3.41 4.77 -0.63 -4.66 117.00 121.84 3kbz n LEU 159 Ca 0.15 1.18 -0.02 0.00 -0.03 0.00 0.00 56.01 57.29 3kbz n LEU 159 Cb 0.28 -1.40 -0.15 0.00 -2.33 0.00 0.00 43.42 39.82 3kbz n LEU 159 CO 0.23 -0.76 -0.87 0.52 -1.33 0.00 0.00 177.39 175.19 3kbz n VAL 160 N 0.84 0.96 -3.57 4.08 0.31 0.09 -4.99 118.33 116.05 3kbz n VAL 160 Ca 0.09 -0.72 -0.10 0.00 -0.01 0.00 0.00 64.34 63.59 3kbz n VAL 160 Cb 0.33 -0.40 -0.05 0.00 -0.91 0.00 0.00 33.84 32.81 3kbz n VAL 160 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3kbz s ALA 161 N -2.87 -1.93 0.21 3.52 0.00 -1.20 -4.48 121.76 115.01 3kbz s ALA 161 Ca -0.08 1.55 -0.22 0.00 0.00 0.00 0.00 51.96 53.21 3kbz s ALA 161 Cb 0.09 -0.63 0.04 0.00 0.00 0.00 0.00 23.12 22.63 3kbz s ALA 161 CO 0.85 -0.34 0.72 0.00 0.00 0.00 0.00 175.76 176.98 3kbz s ALA 162 N -1.29 -1.41 0.00 0.00 0.00 -0.51 -0.06 121.76 118.49 3kbz s ALA 162 Ca -0.01 0.05 0.00 0.00 0.00 0.00 0.00 51.96 52.00 3kbz s ALA 162 Cb -0.01 0.82 0.00 0.00 0.00 0.00 0.00 23.12 23.93 3kbz s ALA 162 CO 0.01 -0.94 0.00 0.41 0.00 0.00 0.00 175.76 175.24 3kbz n GLY 163 N -0.43 -0.87 3.62 0.00 0.00 -0.81 0.39 105.19 107.09 3kbz n GLY 163 Ca -0.08 -1.00 -0.10 0.00 0.00 0.00 0.00 46.02 44.84 3kbz n GLY 163 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3kbz s TYR 164 N -3.00 -0.36 -0.12 1.61 1.13 -0.44 -1.73 117.35 114.43 3kbz s TYR 164 Ca 0.00 0.04 0.03 0.00 -1.41 0.00 0.00 57.07 55.73 3kbz s TYR 164 Cb 0.00 0.62 0.00 0.00 -1.10 0.00 0.00 41.96 41.48 3kbz s TYR 164 CO 0.00 -1.02 -0.23 0.00 -2.51 0.00 0.00 175.55 171.79 3kbz s ALA 165 N -3.83 2.23 -0.23 9.51 0.00 0.40 -0.36 121.76 129.48 3kbz s ALA 165 Ca 0.06 -1.04 -0.07 0.00 0.00 0.00 0.00 51.96 50.91 3kbz s ALA 165 Cb -0.03 -0.92 -0.03 0.00 0.00 0.00 0.00 23.12 22.14 3kbz s ALA 165 CO -0.04 0.12 0.05 -1.17 0.00 0.00 0.00 175.76 174.72 3kbz s LEU 166 N 0.60 3.47 -1.06 0.00 2.96 0.11 -1.25 118.68 123.50 3kbz s LEU 166 Ca -0.12 -0.15 -0.05 0.00 -0.22 0.00 0.00 54.13 53.59 3kbz s LEU 166 Cb -0.17 -1.91 0.29 0.00 0.50 0.00 0.00 46.19 44.90 3kbz s LEU 166 CO 0.03 0.03 1.29 -1.22 -1.32 0.00 0.00 176.35 175.16 3kbz n TYR 167 N 4.52 3.41 0.00 5.38 4.01 0.51 -1.61 117.16 133.37 3kbz n TYR 167 Ca -0.16 -3.17 0.00 0.00 -0.16 0.00 0.00 57.90 54.40 3kbz n TYR 167 Cb 0.52 -1.36 0.00 0.00 -0.31 0.00 0.00 39.34 38.19 3kbz n TYR 167 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3kbz n GLY 168 N 1.78 2.01 0.37 2.72 0.00 -1.26 -3.44 105.19 107.36 3kbz n GLY 168 Ca 0.25 -0.79 0.13 0.00 0.00 0.00 0.00 46.02 45.62 3kbz n GLY 168 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3kbz h SER 169 N 0.00 0.40 -5.47 1.61 4.64 -2.00 -3.42 113.55 109.32 3kbz h SER 169 Ca 0.00 0.02 -0.20 0.00 -0.47 0.00 0.00 61.79 61.14 3kbz h SER 169 Cb 0.00 -0.07 -0.15 0.00 -0.31 0.00 0.00 62.40 61.88 3kbz h SER 169 CO 0.00 0.23 -0.59 0.00 -0.87 0.00 0.00 176.83 175.60 3kbz s ALA 170 N -5.42 0.88 -0.21 5.18 0.00 -1.26 -5.15 121.76 115.78 3kbz s ALA 170 Ca -0.08 -1.50 -0.10 0.00 0.00 0.00 0.00 51.96 50.28 3kbz s ALA 170 Cb 0.20 1.08 -0.05 0.00 0.00 0.00 0.00 23.12 24.36 3kbz s ALA 170 CO 0.76 -0.55 0.15 0.99 0.00 0.00 0.00 175.76 177.10 3kbz s THR 171 N -4.09 5.39 0.00 0.00 2.01 -1.26 -4.49 115.64 113.21 3kbz s THR 171 Ca 0.29 0.21 0.03 0.00 0.31 0.00 0.00 61.69 62.53 3kbz s THR 171 Cb 0.07 -3.49 -0.01 0.00 0.01 0.00 0.00 72.50 69.08 3kbz s THR 171 CO 0.06 0.41 -0.08 -0.32 -0.69 0.00 0.00 174.62 174.00 3kbz s MET 172 N 0.56 0.63 -0.19 4.92 -2.45 -0.63 -0.67 119.30 121.47 3kbz s MET 172 Ca 0.08 -0.36 -0.02 0.00 -1.25 0.00 0.00 55.69 54.15 3kbz s MET 172 Cb -0.12 -0.59 -0.00 0.00 1.25 0.00 0.00 34.83 35.37 3kbz s MET 172 CO 0.00 0.16 -0.10 -1.17 1.05 0.00 0.00 175.02 174.95 3kbz s LEU 173 N -0.40 2.67 -0.26 4.11 0.20 0.52 0.05 118.68 125.57 3kbz s LEU 173 Ca 0.01 -0.43 -0.08 0.00 0.69 0.00 0.00 54.13 54.32 3kbz s LEU 173 Cb -0.04 -1.64 -0.03 0.00 -0.43 0.00 0.00 46.19 44.04 3kbz s LEU 173 CO -0.00 0.03 0.11 -0.69 -0.29 0.00 0.00 176.35 175.51 3kbz s VAL 174 N 1.13 4.58 -0.16 1.68 1.01 0.51 -0.71 120.40 128.45 3kbz s VAL 174 Ca 0.01 -0.11 0.01 0.00 0.00 0.00 0.00 61.98 61.89 3kbz s VAL 174 Cb -0.14 -3.17 0.01 0.00 0.00 0.00 0.00 36.38 33.07 3kbz s VAL 174 CO -0.03 0.29 -0.18 -0.22 0.00 0.00 0.00 175.10 174.96 3kbz s LEU 175 N 1.65 2.27 -0.08 3.92 2.96 -0.45 -1.33 118.68 127.62 3kbz s LEU 175 Ca 0.06 -0.57 0.02 0.00 -0.22 0.00 0.00 54.13 53.43 3kbz s LEU 175 Cb -0.15 -1.51 -0.02 0.00 0.50 0.00 0.00 46.19 45.01 3kbz s LEU 175 CO 0.06 0.05 -0.12 0.00 -1.32 0.00 0.00 176.35 175.02 3kbz s ALA 176 N 0.98 2.71 0.30 5.97 0.00 0.16 -1.44 121.76 130.44 3kbz s ALA 176 Ca -0.03 -0.93 -0.00 0.00 0.00 0.00 0.00 51.96 51.00 3kbz s ALA 176 Cb -0.15 -1.10 0.00 0.00 0.00 0.00 0.00 23.12 21.87 3kbz s ALA 176 CO -0.04 0.45 0.39 -1.33 0.00 0.00 0.00 175.76 175.23 3kbz n MET 177 N 2.73 0.57 -0.23 0.00 2.81 -0.48 -1.42 117.12 121.09 3kbz n MET 177 Ca -0.18 -2.49 0.10 0.00 -1.81 0.00 0.00 57.70 53.33 3kbz n MET 177 Cb 0.52 2.33 0.37 0.00 -0.71 0.00 0.00 33.22 35.74 3kbz n MET 177 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 3kbz h ASP 178 N 1.71 0.65 0.18 7.83 5.19 -1.95 0.01 116.42 130.04 3kbz h ASP 178 Ca -0.23 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.21 3kbz h ASP 178 Cb 1.03 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 40.43 3kbz h ASP 178 CO 0.31 0.36 0.00 0.00 -3.12 0.00 0.00 179.24 176.80 3kbz n GLY 180 N 0.22 0.41 3.40 0.00 0.00 -0.01 -4.92 105.19 104.30 3kbz n GLY 180 Ca 0.11 -2.28 -0.34 0.00 0.00 0.00 0.00 46.02 43.52 3kbz n GLY 180 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kbz s VAL 181 N -0.13 3.44 -0.03 1.61 1.01 -1.26 -1.38 120.40 123.66 3kbz s VAL 181 Ca 0.00 -0.51 0.04 0.00 0.00 0.00 0.00 61.98 61.52 3kbz s VAL 181 Cb 0.00 -2.50 -0.01 0.00 0.00 0.00 0.00 36.38 33.88 3kbz s VAL 181 CO 0.00 0.49 -0.16 0.20 0.00 0.00 0.00 175.10 175.63 3kbz s ASN 182 N 0.61 1.96 -0.19 3.32 -0.87 -0.52 -0.62 114.94 118.62 3kbz s ASN 182 Ca -0.05 -0.31 -0.06 0.00 -1.57 0.00 0.00 52.86 50.88 3kbz s ASN 182 Cb -0.15 -0.42 -0.03 0.00 -0.02 0.00 0.00 41.25 40.63 3kbz s ASN 182 CO 0.03 0.16 0.02 0.00 -2.57 0.00 0.00 177.10 174.73 3kbz s PHE 184 N 0.83 2.67 -0.17 0.00 0.40 0.11 -1.36 117.98 120.47 3kbz s PHE 184 Ca 0.01 -0.66 -0.11 0.00 -0.60 0.00 0.00 56.93 55.58 3kbz s PHE 184 Cb -0.14 -1.73 -0.05 0.00 0.51 0.00 0.00 43.02 41.61 3kbz s PHE 184 CO 0.02 -0.18 0.18 1.41 0.70 0.00 0.00 175.22 177.35 3kbz s MET 185 N 0.06 4.06 -0.22 0.44 1.75 0.18 -0.36 119.30 125.21 3kbz s MET 185 Ca -0.07 -0.10 -0.28 0.00 -1.25 0.00 0.00 55.69 53.99 3kbz s MET 185 Cb -0.15 -3.37 0.00 0.00 2.84 0.00 0.00 34.83 34.15 3kbz s MET 185 CO 0.05 0.39 0.98 -1.17 -0.65 0.00 0.00 175.02 174.62 3kbz s LEU 186 N 0.07 4.11 -0.52 4.11 2.96 0.16 0.44 118.68 130.01 3kbz s LEU 186 Ca 0.12 1.31 -0.19 0.00 -0.22 0.00 0.00 54.13 55.14 3kbz s LEU 186 Cb -0.12 -3.45 0.06 0.00 0.50 0.00 0.00 46.19 43.18 3kbz s LEU 186 CO 0.01 -0.61 0.66 -0.62 -1.32 0.00 0.00 176.35 174.47 3kbz s ASP 187 N 1.22 6.23 0.52 3.68 -1.08 0.43 -4.66 116.67 123.00 3kbz s ASP 187 Ca 0.42 -0.93 0.23 0.00 -0.52 0.00 0.00 52.55 51.74 3kbz s ASP 187 Cb -0.15 -2.30 1.33 0.00 -1.46 0.00 0.00 42.92 40.34 3kbz s ASP 187 CO 0.07 -0.94 2.01 -0.65 0.52 0.00 0.00 175.17 176.18 3kbz h PRO 188 N 9.04 0.05 -0.13 4.34 0.11 -1.94 0.69 132.00 144.16 3kbz h PRO 188 Ca -0.28 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.79 3kbz h PRO 188 Cb 1.09 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 3kbz h PRO 188 CO 0.99 0.04 -0.12 0.00 -0.21 0.00 0.00 178.00 178.69 3kbz h ALA 189 N 1.76 1.56 0.00 -0.75 0.00 -1.97 -3.27 119.26 116.59 3kbz h ALA 189 Ca 0.23 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3kbz h ALA 189 Cb 0.84 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3kbz h ALA 189 CO -0.01 0.32 0.00 0.44 0.00 0.00 0.00 179.25 180.00 3kbz n ILE 190 N -4.30 0.41 -3.67 0.00 -5.35 -0.98 -5.03 119.36 100.44 3kbz n ILE 190 Ca -0.01 -0.53 -0.23 0.00 -0.27 0.00 0.00 62.75 61.71 3kbz n ILE 190 Cb 0.25 0.92 0.03 0.00 -1.74 0.00 0.00 39.64 39.11 3kbz n ILE 190 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3kbz n GLY 191 N -0.21 -0.50 2.94 3.28 0.00 0.20 -5.00 105.19 105.91 3kbz n GLY 191 Ca 0.00 0.23 -0.16 0.00 0.00 0.00 0.00 46.02 46.09 3kbz n GLY 191 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3kbz s GLU 192 N -5.87 0.46 -0.40 1.61 2.56 -1.15 -4.96 118.70 110.94 3kbz s GLU 192 Ca 0.14 -0.16 -0.22 0.00 0.00 0.00 0.00 54.97 54.72 3kbz s GLU 192 Cb -0.04 -0.47 0.02 0.00 2.00 0.00 0.00 34.13 35.64 3kbz s GLU 192 CO 0.82 0.07 0.74 -0.06 -0.56 0.00 0.00 175.26 176.27 3kbz s PHE 193 N 0.08 3.07 -0.16 5.30 0.08 -1.26 -0.43 117.98 124.66 3kbz s PHE 193 Ca -0.01 0.29 -0.13 0.00 0.12 0.00 0.00 56.93 57.20 3kbz s PHE 193 Cb -0.04 -3.45 -0.05 0.00 -0.57 0.00 0.00 43.02 38.91 3kbz s PHE 193 CO -0.00 -0.83 0.28 0.42 -0.10 0.00 0.00 175.22 174.99 3kbz s ILE 194 N 3.07 5.32 -0.19 0.64 -1.09 0.17 -1.08 121.20 128.03 3kbz s ILE 194 Ca 0.28 0.51 -0.29 0.00 -2.23 0.00 0.00 60.65 58.93 3kbz s ILE 194 Cb -0.13 -3.62 -0.03 0.00 -1.58 0.00 0.00 42.46 37.11 3kbz s ILE 194 CO 0.19 0.40 1.55 -0.22 -1.23 0.00 0.00 174.94 175.63 3kbz s LEU 195 N 0.44 4.00 -0.00 2.97 2.96 -0.55 0.51 118.68 129.01 3kbz s LEU 195 Ca 0.16 1.70 0.03 0.00 -0.22 0.00 0.00 54.13 55.80 3kbz s LEU 195 Cb -0.13 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 42.99 3kbz s LEU 195 CO 0.03 -1.13 0.12 1.33 -1.32 0.00 0.00 176.35 175.39 3kbz n VAL 196 N 6.11 0.00 -3.49 1.68 0.24 -0.46 -4.74 118.33 117.66 3kbz n VAL 196 Ca 0.18 -0.36 -0.19 0.00 -2.04 0.00 0.00 64.34 61.93 3kbz n VAL 196 Cb 0.45 0.89 -0.13 0.00 -1.47 0.00 0.00 33.84 33.58 3kbz n VAL 196 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 3kbz s ASP 197 N -1.51 1.64 0.02 -1.34 1.01 -1.11 -5.02 116.67 110.36 3kbz s ASP 197 Ca 0.01 -0.41 -0.13 0.00 0.71 0.00 0.00 52.55 52.72 3kbz s ASP 197 Cb 0.02 0.32 -0.06 0.00 1.01 0.00 0.00 42.92 44.21 3kbz s ASP 197 CO 0.13 -0.35 0.39 -0.54 0.21 0.00 0.00 175.17 175.02 3kbz s LYS 198 N 2.31 3.85 -1.18 8.23 1.02 -1.26 -1.23 119.74 131.48 3kbz s LYS 198 Ca 0.07 0.33 -0.31 0.00 0.02 0.00 0.00 55.97 56.07 3kbz s LYS 198 Cb -0.15 -3.16 0.04 0.00 -0.52 0.00 0.00 37.83 34.04 3kbz s LYS 198 CO -0.17 0.66 0.69 -3.47 -0.92 0.00 0.00 175.35 172.14 3kbz n ASP 199 N 1.59 -4.30 -4.76 2.83 4.64 -1.00 -4.86 116.55 110.68 3kbz n ASP 199 Ca -0.13 -1.25 -0.41 0.00 -1.38 0.00 0.00 54.79 51.62 3kbz n ASP 199 Cb 0.52 -1.80 -0.02 0.00 -1.04 0.00 0.00 41.12 38.78 3kbz n ASP 199 CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 3kbz s VAL 200 N -3.48 2.84 -0.04 5.18 1.01 0.20 -4.87 120.40 121.24 3kbz s VAL 200 Ca 0.46 0.80 0.03 0.00 0.00 0.00 0.00 61.98 63.26 3kbz s VAL 200 Cb -0.24 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 32.63 3kbz s VAL 200 CO 0.96 0.17 -0.13 -0.54 0.00 0.00 0.00 175.10 175.56 3kbz s LYS 201 N -1.30 1.45 0.45 2.72 -0.14 -1.26 -4.46 119.74 117.18 3kbz s LYS 201 Ca 0.51 -0.44 -0.21 0.00 -1.36 0.00 0.00 55.97 54.48 3kbz s LYS 201 Cb -0.39 -1.26 -0.10 0.00 -1.68 0.00 0.00 37.83 34.39 3kbz s LYS 201 CO 0.48 0.13 0.97 -1.50 -0.76 0.00 0.00 175.35 174.68 3kbz s ILE 202 N 0.28 4.26 0.47 2.17 2.07 0.07 -5.00 121.20 125.52 3kbz s ILE 202 Ca -0.07 1.40 -0.24 0.00 -1.41 0.00 0.00 60.65 60.33 3kbz s ILE 202 Cb -0.12 -3.57 -0.08 0.00 0.13 0.00 0.00 42.46 38.83 3kbz s ILE 202 CO 0.02 -0.31 1.25 1.17 -1.91 0.00 0.00 174.94 175.16 3kbz n LYS 203 N -0.74 1.75 -0.30 3.50 4.81 -1.26 -4.89 118.16 121.03 3kbz n LYS 203 Ca 0.08 0.63 -0.01 0.00 -0.87 0.00 0.00 58.31 58.13 3kbz n LYS 203 Cb 0.54 -2.40 0.11 0.00 0.02 0.00 0.00 35.03 33.29 3kbz n LYS 203 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 3kbz h LYS 204 N 1.73 0.97 -3.25 1.64 3.64 -1.95 -3.40 116.57 115.95 3kbz h LYS 204 Ca -0.49 -0.06 -0.19 0.00 -1.27 0.00 0.00 60.65 58.65 3kbz h LYS 204 Cb 1.31 -0.22 -0.27 0.00 -0.41 0.00 0.00 32.23 32.64 3kbz h LYS 204 CO 0.58 0.64 -0.50 0.21 -2.27 0.00 0.00 179.45 178.11 3kbz s LYS 205 N -6.09 0.21 0.06 1.90 2.20 -1.26 -1.94 119.74 114.82 3kbz s LYS 205 Ca -0.13 0.30 0.01 0.00 -0.36 0.00 0.00 55.97 55.79 3kbz s LYS 205 Cb 0.17 0.06 0.01 0.00 -1.51 0.00 0.00 37.83 36.56 3kbz s LYS 205 CO 0.79 -0.05 0.04 0.41 -0.36 0.00 0.00 175.35 176.18 3kbz n GLY 206 N 3.19 3.07 0.50 5.54 0.00 -1.26 -4.77 105.19 111.46 3kbz n GLY 206 Ca -0.15 -2.19 0.04 0.00 0.00 0.00 0.00 46.02 43.72 3kbz n GLY 206 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3kbz n LYS 207 N -0.63 0.44 -4.20 1.61 5.02 -1.26 -4.77 118.16 114.37 3kbz n LYS 207 Ca -0.00 -1.67 -0.18 0.00 -2.02 0.00 0.00 58.31 54.43 3kbz n LYS 207 Cb 0.07 -0.78 -0.15 0.00 -0.02 0.00 0.00 35.03 34.15 3kbz n LYS 207 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3kbz s ILE 208 N -0.96 0.52 0.00 -0.18 -1.09 -1.26 -0.36 121.20 117.87 3kbz s ILE 208 Ca 0.15 -0.20 0.08 0.00 -2.23 0.00 0.00 60.65 58.45 3kbz s ILE 208 Cb 0.14 -0.49 -0.02 0.00 -1.58 0.00 0.00 42.46 40.51 3kbz s ILE 208 CO -0.01 0.18 -0.26 -0.72 -1.23 0.00 0.00 174.94 172.90 3kbz s TYR 209 N 0.36 2.28 -0.07 3.97 -0.85 -0.80 -0.98 117.35 121.25 3kbz s TYR 209 Ca -0.04 -0.42 -0.00 0.00 -0.52 0.00 0.00 57.07 56.08 3kbz s TYR 209 Cb -0.08 -1.43 0.02 0.00 0.38 0.00 0.00 41.96 40.85 3kbz s TYR 209 CO -0.00 0.02 -0.03 0.45 -1.52 0.00 0.00 175.55 174.47 3kbz s SER 210 N -0.83 1.44 -0.20 -0.18 0.15 0.78 -3.06 113.70 111.79 3kbz s SER 210 Ca 0.10 -0.14 -0.36 0.00 0.70 0.00 0.00 55.95 56.25 3kbz s SER 210 Cb -0.10 -0.52 0.14 0.00 -1.71 0.00 0.00 66.02 63.83 3kbz s SER 210 CO 0.00 -0.12 1.23 -1.48 1.20 0.00 0.00 173.24 174.08 3kbz s LEU 211 N 1.47 -0.12 -0.65 3.45 2.34 -1.26 0.80 118.68 124.70 3kbz s LEU 211 Ca -0.02 -0.00 -0.27 0.00 0.06 0.00 0.00 54.13 53.89 3kbz s LEU 211 Cb -0.13 1.34 0.03 0.00 -0.56 0.00 0.00 46.19 46.87 3kbz s LEU 211 CO -0.03 -0.21 1.21 0.21 -1.06 0.00 0.00 176.35 176.48 3kbz s ASN 212 N -2.17 6.30 0.00 1.48 3.84 -1.26 -4.85 114.94 118.28 3kbz s ASN 212 Ca 0.10 -0.20 0.24 0.00 0.21 0.00 0.00 52.86 53.20 3kbz s ASN 212 Cb -0.01 -2.55 1.24 0.00 -0.55 0.00 0.00 41.25 39.39 3kbz s ASN 212 CO -0.04 -1.63 1.78 -0.62 -2.79 0.00 0.00 177.10 173.79 3kbz n GLU 213 N 8.81 0.43 0.17 0.43 1.02 -1.26 -2.91 120.64 127.32 3kbz n GLU 213 Ca 0.05 0.05 0.13 0.00 -0.02 0.00 0.00 57.16 57.37 3kbz n GLU 213 Cb 0.49 -1.50 0.58 0.00 -0.02 0.00 0.00 31.44 30.99 3kbz n GLU 213 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 3kbz h GLY 214 N 3.85 0.00 -1.77 0.62 0.00 -2.06 -1.40 103.07 102.32 3kbz h GLY 214 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3kbz h GLY 214 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.82 3kbz n TYR 215 N -2.40 0.59 -0.33 5.60 4.01 -1.15 -4.55 117.16 118.93 3kbz n TYR 215 Ca 0.01 -0.30 0.07 0.00 -0.16 0.00 0.00 57.90 57.52 3kbz n TYR 215 Cb 0.19 0.00 0.16 0.00 -0.31 0.00 0.00 39.34 39.37 3kbz n TYR 215 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3kbz h ALA 216 N 4.02 0.72 -0.96 -0.72 0.00 -1.48 0.18 119.26 121.02 3kbz h ALA 216 Ca 0.00 0.35 0.21 0.00 0.00 0.00 0.00 54.91 55.48 3kbz h ALA 216 Cb 0.69 0.67 -0.08 0.00 0.00 0.00 0.00 17.79 19.07 3kbz h ALA 216 CO 0.00 -0.42 0.62 -0.22 0.00 0.00 0.00 179.25 179.23 3kbz h LYS 217 N 0.01 0.47 -0.15 0.00 3.64 -1.85 -1.19 116.57 117.50 3kbz h LYS 217 Ca 0.47 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.82 3kbz h LYS 217 Cb 0.78 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.49 3kbz h LYS 217 CO -0.94 0.31 0.00 -0.25 -2.27 0.00 0.00 179.45 176.31 3kbz n ASP 218 N -4.59 2.82 -4.71 4.20 8.00 0.60 -5.00 116.55 117.87 3kbz n ASP 218 Ca 0.22 -1.90 -0.37 0.00 0.71 0.00 0.00 54.79 53.44 3kbz n ASP 218 Cb 0.71 -0.08 0.06 0.00 -0.02 0.00 0.00 41.12 41.79 3kbz n ASP 218 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3kbz n PHE 219 N 1.14 1.75 -2.53 1.24 3.72 -0.45 -3.63 117.46 118.71 3kbz n PHE 219 Ca 0.16 0.42 -0.37 0.00 -0.05 0.00 0.00 57.45 57.61 3kbz n PHE 219 Cb 0.54 -2.25 -0.04 0.00 -0.94 0.00 0.00 39.48 36.79 3kbz n PHE 219 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3kbz s ASP 220 N -1.31 6.88 0.36 4.37 2.15 -1.26 -4.84 116.67 123.01 3kbz s ASP 220 Ca 0.81 2.09 0.13 0.00 0.43 0.00 0.00 52.55 56.01 3kbz s ASP 220 Cb -0.39 -2.60 0.95 0.00 -0.30 0.00 0.00 42.92 40.59 3kbz s ASP 220 CO 0.42 -0.41 1.79 1.55 -0.17 0.00 0.00 175.17 178.35 3kbz h PRO 221 N 2.81 0.53 -0.62 4.34 0.13 -1.98 -0.68 132.00 136.53 3kbz h PRO 221 Ca -0.48 -0.03 -0.05 0.00 -0.87 0.00 0.00 66.00 64.57 3kbz h PRO 221 Cb 1.21 -0.12 -0.03 0.00 0.13 0.00 0.00 31.00 32.20 3kbz h PRO 221 CO 0.63 0.35 0.18 0.00 -0.23 0.00 0.00 178.00 178.94 3kbz h ALA 222 N 1.63 0.82 -0.48 -0.56 0.00 -1.92 -0.31 119.26 118.44 3kbz h ALA 222 Ca 0.56 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 55.18 3kbz h ALA 222 Cb 1.19 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 3kbz h ALA 222 CO -0.31 0.50 -0.02 0.28 0.00 0.00 0.00 179.25 179.70 3kbz h VAL 223 N 0.90 1.26 -0.52 0.00 2.07 -1.55 -0.45 116.25 117.96 3kbz h VAL 223 Ca 0.20 -1.10 0.02 0.00 0.82 0.00 0.00 66.70 66.64 3kbz h VAL 223 Cb 0.31 1.02 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 3kbz h VAL 223 CO -0.00 0.38 0.31 0.74 0.02 0.00 0.00 177.57 179.02 3kbz h THR 224 N 0.71 1.07 -0.31 2.57 2.02 -0.90 -1.47 112.91 116.59 3kbz h THR 224 Ca 0.13 -0.22 -0.11 0.00 0.77 0.00 0.00 66.41 66.99 3kbz h THR 224 Cb 0.54 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.32 3kbz h THR 224 CO 0.03 0.11 -0.23 -0.08 0.37 0.00 0.00 175.52 175.72 3kbz h GLU 225 N 0.63 0.71 -0.01 6.66 4.81 -0.90 -2.10 114.58 124.39 3kbz h GLU 225 Ca 0.20 -0.34 0.01 0.00 -0.13 0.00 0.00 59.36 59.10 3kbz h GLU 225 Cb 0.00 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 3kbz h GLU 225 CO -0.08 0.95 -0.06 -0.92 -0.73 0.00 0.00 179.01 178.17 3kbz h TYR 226 N 0.47 -0.16 -0.86 0.92 3.20 -0.85 -0.69 116.97 119.00 3kbz h TYR 226 Ca 0.06 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.94 3kbz h TYR 226 Cb 0.79 0.07 -0.04 0.00 1.54 0.00 0.00 36.73 39.08 3kbz h TYR 226 CO 0.07 -0.10 0.56 0.82 -1.64 0.00 0.00 178.16 177.87 3kbz h ILE 227 N -0.11 1.22 -0.61 1.81 1.08 -1.30 -1.00 117.51 118.60 3kbz h ILE 227 Ca 0.03 -0.41 0.01 0.00 -0.39 0.00 0.00 64.86 64.10 3kbz h ILE 227 Cb 0.14 -0.04 -0.03 0.00 -3.07 0.00 0.00 36.82 33.82 3kbz h ILE 227 CO -0.07 0.22 0.41 -0.61 -0.69 0.00 0.00 178.15 177.40 3kbz h GLN 228 N 1.17 0.80 0.00 2.37 5.75 -0.69 -1.11 115.11 123.38 3kbz h GLN 228 Ca 0.31 -0.05 -0.08 0.00 -0.15 0.00 0.00 58.65 58.69 3kbz h GLN 228 Cb -0.13 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 28.23 3kbz h GLN 228 CO -0.07 0.53 -0.39 0.00 -2.65 0.00 0.00 178.83 176.25 3kbz h ARG 229 N 0.82 0.00 -0.00 1.69 3.08 0.19 0.38 114.38 120.53 3kbz h ARG 229 Ca 0.23 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 60.08 3kbz h ARG 229 Cb -0.08 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 3kbz h ARG 229 CO -0.05 0.39 -0.87 0.87 -1.07 0.00 0.00 179.97 179.24 3kbz h LYS 230 N 0.00 0.21 0.20 0.04 1.79 -0.70 -2.87 116.57 115.24 3kbz h LYS 230 Ca -0.00 -0.23 -0.35 0.00 -2.18 0.00 0.00 60.65 57.89 3kbz h LYS 230 Cb 0.95 0.06 0.02 0.00 -1.58 0.00 0.00 32.23 31.68 3kbz h LYS 230 CO 0.05 0.95 -1.69 0.87 -1.08 0.00 0.00 179.45 178.55 3kbz h LYS 231 N 0.12 0.42 -2.76 3.15 1.57 -1.25 -1.47 116.57 116.36 3kbz h LYS 231 Ca -0.04 -0.73 -0.61 0.00 -1.87 0.00 0.00 60.65 57.40 3kbz h LYS 231 Cb 1.49 0.27 -0.41 0.00 0.08 0.00 0.00 32.23 33.66 3kbz h LYS 231 CO 0.13 1.35 -0.65 1.19 -0.57 0.00 0.00 179.45 180.90 3kbz n PHE 232 N -3.63 2.62 -1.70 -1.35 3.01 0.11 -4.73 117.46 111.80 3kbz n PHE 232 Ca -0.23 -4.12 -0.56 0.00 1.01 0.00 0.00 57.45 53.55 3kbz n PHE 232 Cb 1.08 -0.48 -0.07 0.00 -0.01 0.00 0.00 39.48 40.00 3kbz n PHE 232 CO 0.00 0.00 0.00 -2.30 1.01 0.00 0.00 176.76 175.47 3kbz n PRO 233 N 1.83 1.22 -0.33 -1.08 -0.02 -1.08 -4.54 135.00 131.00 3kbz n PRO 233 Ca 0.23 0.45 0.01 0.00 -2.02 0.00 0.00 63.50 62.17 3kbz n PRO 233 Cb 0.39 -2.14 0.19 0.00 -0.02 0.00 0.00 33.50 31.92 3kbz n PRO 233 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3kbz h PRO 234 N 7.01 1.13 -0.80 0.52 0.11 -1.91 -2.18 132.00 135.88 3kbz h PRO 234 Ca -0.47 -0.07 -0.15 0.00 0.11 0.00 0.00 66.00 65.43 3kbz h PRO 234 Cb 1.32 -0.26 -0.09 0.00 0.11 0.00 0.00 31.00 32.08 3kbz h PRO 234 CO 0.94 0.75 0.19 -0.40 -0.21 0.00 0.00 178.00 179.27 3kbz n ASP 235 N -4.45 4.28 -1.78 -2.05 3.85 -1.26 -4.88 116.55 110.26 3kbz n ASP 235 Ca 0.13 -2.91 -0.17 0.00 -0.71 0.00 0.00 54.79 51.12 3kbz n ASP 235 Cb 0.11 -0.69 -0.05 0.00 -1.35 0.00 0.00 41.12 39.14 3kbz n ASP 235 CO 0.00 0.00 0.00 -3.20 -1.01 0.00 0.00 177.20 172.99 3kbz n ASN 236 N 0.02 -4.72 -4.85 -1.12 5.15 -0.82 -4.96 115.26 103.96 3kbz n ASN 236 Ca 0.31 0.32 -0.31 0.00 -0.60 0.00 0.00 54.58 54.30 3kbz n ASN 236 Cb 1.14 -4.16 0.04 0.00 -0.53 0.00 0.00 39.78 36.27 3kbz n ASN 236 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 3kbz s SER 237 N -2.34 5.64 0.30 1.20 0.15 -1.26 -4.99 113.70 112.40 3kbz s SER 237 Ca 0.00 1.40 -0.30 0.00 0.70 0.00 0.00 55.95 57.75 3kbz s SER 237 Cb 0.00 -2.31 -0.11 0.00 -1.71 0.00 0.00 66.02 61.89 3kbz s SER 237 CO 0.00 -1.25 1.56 0.00 1.20 0.00 0.00 173.24 174.75 3kbz s ALA 238 N -3.18 3.70 0.52 5.45 0.00 -1.26 -4.53 121.76 122.46 3kbz s ALA 238 Ca 0.57 1.54 -0.22 0.00 0.00 0.00 0.00 51.96 53.85 3kbz s ALA 238 Cb -0.12 -3.63 -0.06 0.00 0.00 0.00 0.00 23.12 19.31 3kbz s ALA 238 CO 0.54 -0.97 1.31 -2.14 0.00 0.00 0.00 175.76 174.50 3kbz s PRO 239 N -0.76 3.34 0.64 0.00 0.02 -1.26 -4.95 135.00 132.03 3kbz s PRO 239 Ca 0.61 2.12 -0.16 0.00 0.02 0.00 0.00 61.00 63.59 3kbz s PRO 239 Cb -0.47 -2.32 -0.01 0.00 0.02 0.00 0.00 34.50 31.72 3kbz s PRO 239 CO 0.50 -1.00 1.12 0.71 -0.33 0.00 0.00 177.00 178.00 3kbz s TYR 240 N -1.36 2.58 0.39 6.54 1.51 -0.55 -5.03 117.35 121.43 3kbz s TYR 240 Ca 0.69 1.55 -0.05 0.00 -1.01 0.00 0.00 57.07 58.25 3kbz s TYR 240 Cb -0.37 -3.23 -0.05 0.00 -0.11 0.00 0.00 41.96 38.20 3kbz s TYR 240 CO 0.45 -1.76 0.68 0.20 -1.11 0.00 0.00 175.55 174.01 3kbz s GLY 241 N -2.35 1.66 -0.06 0.71 0.00 0.52 -4.84 107.32 102.96 3kbz s GLY 241 Ca 0.69 -0.52 0.03 0.00 0.00 0.00 0.00 44.72 44.92 3kbz s GLY 241 CO 0.39 -0.38 -0.14 0.00 0.00 0.00 0.00 173.10 172.97 3kbz s ALA 242 N -2.41 2.68 -0.11 3.20 0.00 -1.26 -1.90 121.76 121.95 3kbz s ALA 242 Ca 0.46 -0.97 -0.07 0.00 0.00 0.00 0.00 51.96 51.38 3kbz s ALA 242 Cb -0.10 -1.00 0.04 0.00 0.00 0.00 0.00 23.12 22.06 3kbz s ALA 242 CO 0.36 0.54 0.28 1.03 0.00 0.00 0.00 175.76 177.97 3kbz s ARG 243 N -0.67 0.26 -0.29 0.00 1.81 -1.17 -5.00 118.95 113.89 3kbz s ARG 243 Ca 0.10 0.54 0.02 0.00 -1.72 0.00 0.00 55.73 54.67 3kbz s ARG 243 Cb -0.11 -0.05 0.16 0.00 -0.45 0.00 0.00 34.95 34.50 3kbz s ARG 243 CO 0.01 -0.13 0.40 -0.47 -0.68 0.00 0.00 175.30 174.43 3kbz s TYR 244 N 1.04 -0.98 0.11 -0.53 5.04 -1.26 -4.21 117.35 116.55 3kbz s TYR 244 Ca -0.07 0.32 -0.09 0.00 -2.44 0.00 0.00 57.07 54.78 3kbz s TYR 244 Cb -0.08 -0.16 -0.15 0.00 0.35 0.00 0.00 41.96 41.91 3kbz s TYR 244 CO -0.07 -0.97 1.26 0.28 -1.34 0.00 0.00 175.55 174.71 3kbz h VAL 245 N 6.17 1.33 0.00 3.14 2.07 -1.97 -3.48 116.25 123.51 3kbz h VAL 245 Ca -0.09 -2.28 0.00 0.00 0.82 0.00 0.00 66.70 65.15 3kbz h VAL 245 Cb 1.12 2.32 0.00 0.00 -1.52 0.00 0.00 31.29 33.21 3kbz h VAL 245 CO 0.27 0.70 0.00 0.61 0.02 0.00 0.00 177.57 179.16 3kbz n GLY 246 N 0.95 0.34 3.23 2.17 0.00 -1.26 -5.02 105.19 105.59 3kbz n GLY 246 Ca -0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 3kbz n GLY 246 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3kbz s SER 247 N -2.36 3.86 0.20 1.61 0.01 -1.26 -4.93 113.70 110.84 3kbz s SER 247 Ca 0.00 -0.54 -0.10 0.00 1.31 0.00 0.00 55.95 56.62 3kbz s SER 247 Cb 0.00 -1.63 0.26 0.00 0.21 0.00 0.00 66.02 64.86 3kbz s SER 247 CO 0.00 -0.02 1.74 -0.03 0.41 0.00 0.00 173.24 175.34 3kbz h MET 248 N 8.04 0.38 -0.87 12.44 4.05 -1.92 -1.07 114.93 135.97 3kbz h MET 248 Ca -0.42 -0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 58.97 3kbz h MET 248 Cb 1.15 -0.09 -0.04 0.00 -0.80 0.00 0.00 31.60 31.82 3kbz h MET 248 CO 0.61 0.25 0.52 0.28 0.23 0.00 0.00 176.91 178.81 3kbz h VAL 249 N 0.39 1.24 -0.09 -5.77 2.07 -1.94 0.24 116.25 112.39 3kbz h VAL 249 Ca 0.30 -0.53 -0.03 0.00 0.82 0.00 0.00 66.70 67.26 3kbz h VAL 249 Cb 0.36 0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.14 3kbz h VAL 249 CO -0.30 0.25 -0.06 0.00 0.02 0.00 0.00 177.57 177.48 3kbz h ALA 250 N 1.37 0.13 -0.54 1.67 0.00 -1.72 -0.90 119.26 119.27 3kbz h ALA 250 Ca 0.31 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 3kbz h ALA 250 Cb -0.05 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3kbz h ALA 250 CO -0.06 -0.08 0.19 -0.44 0.00 0.00 0.00 179.25 178.86 3kbz h ASP 251 N -0.18 0.77 -0.55 0.00 3.32 -0.96 -2.00 116.42 116.81 3kbz h ASP 251 Ca 0.02 -0.19 -0.09 0.00 0.02 0.00 0.00 57.03 56.79 3kbz h ASP 251 Cb 0.53 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 3kbz h ASP 251 CO 0.02 0.75 -0.02 0.58 -1.72 0.00 0.00 179.24 178.85 3kbz h VAL 252 N 0.74 1.27 -0.65 -1.35 2.07 -0.54 -2.11 116.25 115.67 3kbz h VAL 252 Ca 0.18 -1.15 -0.04 0.00 0.82 0.00 0.00 66.70 66.51 3kbz h VAL 252 Cb 0.24 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 30.89 3kbz h VAL 252 CO -0.01 0.41 0.25 -0.74 0.02 0.00 0.00 177.57 177.50 3kbz h HIS 253 N 0.87 1.01 -0.88 1.57 -0.00 -1.01 -0.66 115.15 116.04 3kbz h HIS 253 Ca 0.15 -0.08 -0.02 0.00 -0.00 0.00 0.00 60.37 60.42 3kbz h HIS 253 Cb 0.56 -0.30 -0.04 0.00 -0.00 0.00 0.00 27.41 27.63 3kbz h HIS 253 CO 0.04 0.79 0.46 -0.09 -0.00 0.00 0.00 177.93 179.13 3kbz h ARG 254 N 0.93 1.25 -0.30 5.26 2.43 -1.26 -0.54 114.38 122.15 3kbz h ARG 254 Ca 0.22 -0.16 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 3kbz h ARG 254 Cb 0.22 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 3kbz h ARG 254 CO -0.02 0.93 0.20 1.15 -1.51 0.00 0.00 179.97 180.72 3kbz h THR 255 N 1.25 1.08 -0.34 0.20 2.02 -0.75 0.24 112.91 116.60 3kbz h THR 255 Ca 0.31 -0.14 -0.00 0.00 0.77 0.00 0.00 66.41 67.35 3kbz h THR 255 Cb 0.07 0.64 -0.02 0.00 -1.74 0.00 0.00 68.15 67.10 3kbz h THR 255 CO -0.05 0.07 0.21 0.25 0.37 0.00 0.00 175.52 176.38 3kbz h LEU 256 N 0.40 0.41 -0.09 2.58 5.85 -0.65 0.86 115.31 124.67 3kbz h LEU 256 Ca 0.11 -0.05 -0.08 0.00 0.84 0.00 0.00 57.88 58.70 3kbz h LEU 256 Cb -0.05 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 40.88 3kbz h LEU 256 CO -0.02 0.33 -0.24 0.58 -0.34 0.00 0.00 178.44 178.75 3kbz h VAL 257 N 0.44 1.41 0.00 1.05 2.07 -0.89 -3.36 116.25 116.97 3kbz h VAL 257 Ca 0.12 -1.59 0.00 0.00 0.82 0.00 0.00 66.70 66.06 3kbz h VAL 257 Cb 0.00 2.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.99 3kbz h VAL 257 CO -0.02 0.45 -1.40 -1.22 0.02 0.00 0.00 177.57 175.40 3kbz n TYR 258 N -4.49 0.00 0.00 1.57 4.01 0.83 -4.92 117.16 114.15 3kbz n TYR 258 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 3kbz n TYR 258 Cb 0.45 -0.20 0.00 0.00 -0.31 0.00 0.00 39.34 39.27 3kbz n TYR 258 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3kbz n GLY 259 N 1.40 -0.84 0.00 2.72 0.00 0.30 -4.73 105.19 104.04 3kbz n GLY 259 Ca 0.01 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.34 3kbz n GLY 259 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kbz n GLY 260 N -0.86 0.11 2.98 -0.02 0.00 -1.26 -4.55 105.19 101.59 3kbz n GLY 260 Ca 0.00 -2.09 -0.11 0.00 0.00 0.00 0.00 46.02 43.82 3kbz n GLY 260 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3kbz s ILE 261 N 0.00 0.04 -0.07 -0.61 2.07 -0.15 -0.26 121.20 122.22 3kbz s ILE 261 Ca 0.00 -0.34 0.05 0.00 -1.41 0.00 0.00 60.65 58.95 3kbz s ILE 261 Cb 0.00 -0.19 -0.01 0.00 0.13 0.00 0.00 42.46 42.39 3kbz s ILE 261 CO 0.00 -0.19 -0.24 0.12 -1.91 0.00 0.00 174.94 172.72 3kbz s PHE 262 N -0.58 2.41 -0.00 3.50 5.36 0.54 -0.16 117.98 129.05 3kbz s PHE 262 Ca -0.06 -0.82 0.03 0.00 -0.96 0.00 0.00 56.93 55.12 3kbz s PHE 262 Cb -0.04 -1.59 -0.01 0.00 -0.34 0.00 0.00 43.02 41.04 3kbz s PHE 262 CO 0.00 -0.29 -0.09 -0.51 -1.46 0.00 0.00 175.22 172.88 3kbz s LEU 263 N 0.04 2.03 -0.44 6.12 1.02 0.24 -1.41 118.68 126.28 3kbz s LEU 263 Ca -0.09 -0.18 0.07 0.00 0.02 0.00 0.00 54.13 53.94 3kbz s LEU 263 Cb -0.15 -0.45 0.23 0.00 0.02 0.00 0.00 46.19 45.84 3kbz s LEU 263 CO 0.05 0.10 0.65 0.00 0.02 0.00 0.00 176.35 177.17 3kbz n TYR 264 N 2.79 -1.95 -1.59 0.29 4.19 -0.51 -4.30 117.16 116.08 3kbz n TYR 264 Ca -0.14 -2.61 -0.29 0.00 3.31 0.00 0.00 57.90 58.18 3kbz n TYR 264 Cb 0.57 0.65 0.13 0.00 0.49 0.00 0.00 39.34 41.17 3kbz n TYR 264 CO 0.00 0.00 0.00 -1.25 0.91 0.00 0.00 176.86 176.52 3kbz s PRO 265 N -0.08 1.30 -0.18 2.98 0.04 -1.26 -2.35 135.00 135.45 3kbz s PRO 265 Ca 0.33 0.27 -0.19 0.00 0.04 0.00 0.00 61.00 61.45 3kbz s PRO 265 Cb 0.15 -1.86 -0.03 0.00 0.04 0.00 0.00 34.50 32.80 3kbz s PRO 265 CO -0.16 -2.09 0.54 0.00 0.04 0.00 0.00 177.00 175.33 3kbz s ALA 266 N -3.32 3.53 0.00 8.56 0.00 -1.26 -4.61 121.76 124.65 3kbz s ALA 266 Ca 0.63 -0.33 0.00 0.00 0.00 0.00 0.00 51.96 52.27 3kbz s ALA 266 Cb -0.14 -2.83 0.00 0.00 0.00 0.00 0.00 23.12 20.15 3kbz s ALA 266 CO 0.53 -0.39 0.00 0.27 0.00 0.00 0.00 175.76 176.16 3kbz n ASN 267 N 4.65 0.00 -0.03 0.00 0.23 -1.18 -4.61 115.26 114.33 3kbz n ASN 267 Ca -0.04 0.00 0.02 0.00 -0.53 0.00 0.00 54.58 54.02 3kbz n ASN 267 Cb 0.50 0.00 -0.11 0.00 -2.08 0.00 0.00 39.78 38.09 3kbz n ASN 267 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 3kbz n LYS 268 N 0.00 0.97 -0.01 -3.83 5.02 -1.24 -4.39 118.16 114.69 3kbz n LYS 268 Ca 0.00 -0.08 0.09 0.00 -2.02 0.00 0.00 58.31 56.29 3kbz n LYS 268 Cb 0.00 -1.36 -0.14 0.00 -0.02 0.00 0.00 35.03 33.52 3kbz n LYS 268 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 3kbz n LYS 269 N -2.22 0.55 -3.04 1.97 -0.00 -1.26 -4.53 118.16 109.63 3kbz n LYS 269 Ca -0.11 -0.16 -0.29 0.00 -0.00 0.00 0.00 58.31 57.76 3kbz n LYS 269 Cb 0.62 -1.42 -0.04 0.00 -0.00 0.00 0.00 35.03 34.19 3kbz n LYS 269 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 3kbz n SER 270 N -2.10 4.63 0.27 -5.58 7.64 -1.26 -4.88 113.62 112.35 3kbz n SER 270 Ca -0.03 -3.62 0.12 0.00 1.01 0.00 0.00 58.87 56.36 3kbz n SER 270 Cb 0.46 -0.67 0.65 0.00 -1.01 0.00 0.00 64.21 63.64 3kbz n SER 270 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3kbz h PRO 271 N 3.50 0.00 -0.24 1.43 0.13 -1.80 0.26 132.00 135.28 3kbz h PRO 271 Ca 0.19 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.28 3kbz h PRO 271 Cb 0.53 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.64 3kbz h PRO 271 CO 0.88 0.00 -0.02 0.09 -0.23 0.00 0.00 178.00 178.72 3kbz n ASN 272 N -2.58 3.34 -0.48 1.44 4.13 -1.26 -4.76 115.26 115.09 3kbz n ASN 272 Ca -0.02 -3.20 0.03 0.00 1.68 0.00 0.00 54.58 53.08 3kbz n ASN 272 Cb 0.34 -0.55 -0.01 0.00 -1.54 0.00 0.00 39.78 38.03 3kbz n ASN 272 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3kbz n GLY 273 N -0.79 -1.85 0.02 7.41 0.00 0.92 -1.24 105.19 109.66 3kbz n GLY 273 Ca 0.23 -1.31 -0.03 0.00 0.00 0.00 0.00 46.02 44.91 3kbz n GLY 273 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3kbz n LYS 274 N -1.45 1.58 -2.11 1.61 4.81 -1.26 -4.63 118.16 116.72 3kbz n LYS 274 Ca 0.00 0.02 -0.35 0.00 -0.87 0.00 0.00 58.31 57.11 3kbz n LYS 274 Cb 0.11 -1.11 0.02 0.00 0.02 0.00 0.00 35.03 34.08 3kbz n LYS 274 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 3kbz s LEU 275 N -4.85 3.66 0.07 3.14 1.43 -1.26 -4.80 118.68 116.07 3kbz s LEU 275 Ca -0.05 2.18 -0.26 0.00 -1.03 0.00 0.00 54.13 54.98 3kbz s LEU 275 Cb 0.02 -4.58 -0.06 0.00 0.03 0.00 0.00 46.19 41.60 3kbz s LEU 275 CO 0.14 -1.37 0.80 -0.13 0.23 0.00 0.00 176.35 176.02 3kbz s ARG 276 N -3.45 4.54 0.01 1.70 3.00 -1.26 -0.84 118.95 122.65 3kbz s ARG 276 Ca 0.72 1.14 -0.24 0.00 0.00 0.00 0.00 55.73 57.35 3kbz s ARG 276 Cb -0.24 -3.36 -0.18 0.00 0.00 0.00 0.00 34.95 31.17 3kbz s ARG 276 CO 0.31 0.29 1.38 1.25 0.00 0.00 0.00 175.30 178.53 3kbz h LEU 277 N 5.55 0.06 -0.58 2.53 5.85 -1.50 0.79 115.31 128.02 3kbz h LEU 277 Ca -0.44 -0.38 -0.09 0.00 0.84 0.00 0.00 57.88 57.82 3kbz h LEU 277 Cb 1.21 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.20 3kbz h LEU 277 CO 0.71 0.43 0.03 -0.07 -0.34 0.00 0.00 178.44 179.19 3kbz h LEU 278 N -0.30 0.98 -2.99 2.25 4.07 -1.79 -0.36 115.31 117.17 3kbz h LEU 278 Ca 0.01 -0.29 0.00 0.00 0.08 0.00 0.00 57.88 57.67 3kbz h LEU 278 Cb 0.40 -0.26 0.00 0.00 1.08 0.00 0.00 40.66 41.88 3kbz h LEU 278 CO 0.00 1.03 0.00 0.00 -1.08 0.00 0.00 178.44 178.40 3kbz n TYR 279 N -4.25 0.05 0.09 1.13 0.18 -1.26 -4.54 117.16 108.57 3kbz n TYR 279 Ca 0.02 -0.58 0.00 0.00 1.88 0.00 0.00 57.90 59.23 3kbz n TYR 279 Cb 0.32 -0.07 0.00 0.00 -0.38 0.00 0.00 39.34 39.22 3kbz n TYR 279 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 3kbz n GLU 280 N -0.55 0.00 0.13 -3.48 1.02 -1.01 -4.18 120.64 112.56 3kbz n GLU 280 Ca 0.04 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.06 3kbz n GLU 280 Cb 0.33 -0.25 -0.08 0.00 -0.02 0.00 0.00 31.44 31.42 3kbz n GLU 280 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3kbz h ASN 282 N -0.84 -0.01 -0.50 0.00 -0.26 -1.30 0.55 115.58 113.22 3kbz h ASN 282 Ca -0.04 0.04 0.04 0.00 -0.56 0.00 0.00 56.30 55.79 3kbz h ASN 282 Cb 0.51 0.06 -0.04 0.00 -1.06 0.00 0.00 38.32 37.78 3kbz h ASN 282 CO 0.06 0.03 0.25 -0.65 -1.06 0.00 0.00 177.43 176.06 3kbz h PRO 283 N 0.12 0.47 -0.13 0.81 0.11 -1.80 0.80 132.00 132.37 3kbz h PRO 283 Ca 0.10 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 66.07 3kbz h PRO 283 Cb 0.11 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 3kbz h PRO 283 CO -0.15 0.31 -0.43 0.52 -0.21 0.00 0.00 178.00 178.04 3kbz h MET 284 N 0.49 0.32 -0.48 1.05 2.86 -1.44 -1.83 114.93 115.89 3kbz h MET 284 Ca 0.22 -0.16 -0.12 0.00 -2.06 0.00 0.00 59.70 57.58 3kbz h MET 284 Cb 0.14 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.78 3kbz h MET 284 CO -0.16 0.70 -0.16 0.00 1.06 0.00 0.00 176.91 178.35 3kbz h ALA 285 N 1.28 0.80 -0.51 6.32 0.00 -0.34 -1.31 119.26 125.50 3kbz h ALA 285 Ca 0.02 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 54.51 3kbz h ALA 285 Cb 0.88 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 3kbz h ALA 285 CO 0.07 0.66 0.09 -0.92 0.00 0.00 0.00 179.25 179.15 3kbz h TYR 286 N 0.83 0.89 -0.65 0.00 3.20 -0.58 -0.98 116.97 119.68 3kbz h TYR 286 Ca 0.12 -0.12 -0.05 0.00 3.14 0.00 0.00 58.73 61.82 3kbz h TYR 286 Cb 0.71 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 38.71 3kbz h TYR 286 CO 0.04 0.80 0.21 0.28 -1.64 0.00 0.00 178.16 177.86 3kbz h VAL 287 N 0.72 1.25 -0.05 1.81 2.07 -1.20 -1.89 116.25 118.97 3kbz h VAL 287 Ca 0.16 -0.84 -0.00 0.00 0.82 0.00 0.00 66.70 66.83 3kbz h VAL 287 Cb 0.38 0.57 -0.00 0.00 -1.52 0.00 0.00 31.29 30.72 3kbz h VAL 287 CO 0.01 0.32 0.02 0.24 0.02 0.00 0.00 177.57 178.18 3kbz h MET 288 N 0.94 0.07 -0.57 1.57 2.86 -0.95 -2.00 114.93 116.85 3kbz h MET 288 Ca 0.21 -0.01 -0.05 0.00 -2.06 0.00 0.00 59.70 57.78 3kbz h MET 288 Cb 0.28 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.90 3kbz h MET 288 CO -0.01 0.22 0.14 0.93 1.06 0.00 0.00 176.91 179.25 3kbz h GLU 289 N -0.09 0.87 0.00 1.72 5.08 -1.12 0.72 114.58 121.77 3kbz h GLU 289 Ca 0.02 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.18 3kbz h GLU 289 Cb 0.17 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.29 3kbz h GLU 289 CO -0.00 0.78 -0.07 0.87 -1.00 0.00 0.00 179.01 179.59 3kbz h LYS 290 N 0.84 0.00 -0.33 2.33 1.79 -1.22 -1.61 116.57 118.36 3kbz h LYS 290 Ca 0.18 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.65 3kbz h LYS 290 Cb 0.30 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.95 3kbz h LYS 290 CO -0.00 0.07 0.00 0.00 -1.08 0.00 0.00 179.45 178.44 3kbz n ALA 291 N -2.17 2.45 -0.66 3.86 0.00 -0.52 -4.42 120.51 119.05 3kbz n ALA 291 Ca -0.01 -0.81 0.00 0.00 0.00 0.00 0.00 53.44 52.62 3kbz n ALA 291 Cb 0.27 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.75 3kbz n ALA 291 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kbz n GLY 292 N 1.35 0.63 0.54 0.00 0.00 -0.60 -0.75 105.19 106.34 3kbz n GLY 292 Ca 0.18 -0.36 -0.03 0.00 0.00 0.00 0.00 46.02 45.81 3kbz n GLY 292 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kbz n GLY 293 N -2.66 2.26 3.23 -0.02 0.00 0.24 -4.50 105.19 103.74 3kbz n GLY 293 Ca 0.00 -2.16 -0.15 0.00 0.00 0.00 0.00 46.02 43.72 3kbz n GLY 293 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3kbz s MET 294 N -2.35 0.99 -0.23 1.61 1.00 -0.71 -3.78 119.30 115.84 3kbz s MET 294 Ca 0.07 -1.35 -0.03 0.00 0.00 0.00 0.00 55.69 54.39 3kbz s MET 294 Cb -0.01 -0.62 0.12 0.00 0.00 0.00 0.00 34.83 34.32 3kbz s MET 294 CO 0.05 0.09 0.32 0.00 0.00 0.00 0.00 175.02 175.48 3kbz s ALA 295 N -2.96 -0.80 0.20 3.03 0.00 -1.26 -1.65 121.76 118.32 3kbz s ALA 295 Ca 0.13 0.62 0.09 0.00 0.00 0.00 0.00 51.96 52.80 3kbz s ALA 295 Cb 0.00 -1.58 -0.04 0.00 0.00 0.00 0.00 23.12 21.50 3kbz s ALA 295 CO 0.01 -1.28 -0.17 -0.08 0.00 0.00 0.00 175.76 174.23 3kbz s THR 296 N 2.47 1.92 -1.44 0.00 -1.32 0.07 -1.63 115.64 115.71 3kbz s THR 296 Ca 0.11 -2.10 0.22 0.00 -1.21 0.00 0.00 61.69 58.71 3kbz s THR 296 Cb -0.15 -1.99 -0.09 0.00 -1.51 0.00 0.00 72.50 68.75 3kbz s THR 296 CO -0.16 -0.41 1.06 0.35 -2.21 0.00 0.00 174.62 173.25 3kbz n THR 297 N -0.08 0.00 0.00 5.08 -2.24 -0.01 -0.38 114.28 116.66 3kbz n THR 297 Ca -0.10 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 3kbz n THR 297 Cb 0.59 0.99 0.00 0.00 -2.10 0.00 0.00 70.33 69.80 3kbz n THR 297 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kbz n GLY 298 N 1.46 3.07 0.09 3.38 0.00 -1.26 -4.71 105.19 107.22 3kbz n GLY 298 Ca 0.07 -1.05 -0.08 0.00 0.00 0.00 0.00 46.02 44.95 3kbz n GLY 298 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3kbz n LYS 299 N 0.00 0.68 -3.84 1.61 5.02 -1.26 -4.96 118.16 115.41 3kbz n LYS 299 Ca 0.00 0.02 -0.08 0.00 -2.02 0.00 0.00 58.31 56.23 3kbz n LYS 299 Cb 0.00 -1.56 -0.03 0.00 -0.02 0.00 0.00 35.03 33.42 3kbz n LYS 299 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 3kbz s GLU 300 N -2.58 1.70 0.17 1.97 -1.05 -1.26 -5.13 118.70 112.52 3kbz s GLU 300 Ca -0.09 -0.98 -0.31 0.00 -0.15 0.00 0.00 54.97 53.44 3kbz s GLU 300 Cb 0.07 0.59 -0.08 0.00 -0.44 0.00 0.00 34.13 34.26 3kbz s GLU 300 CO 0.83 -0.77 1.35 0.00 0.95 0.00 0.00 175.26 177.62 3kbz s ALA 301 N -3.92 3.55 0.28 -0.84 0.00 -1.26 -0.83 121.76 118.75 3kbz s ALA 301 Ca 0.12 1.12 0.02 0.00 0.00 0.00 0.00 51.96 53.22 3kbz s ALA 301 Cb -0.05 -3.51 0.67 0.00 0.00 0.00 0.00 23.12 20.24 3kbz s ALA 301 CO 0.05 -0.58 1.69 0.28 0.00 0.00 0.00 175.76 177.21 3kbz h VAL 302 N 3.95 0.47 0.00 0.00 2.07 -1.61 0.69 116.25 121.82 3kbz h VAL 302 Ca -0.44 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 66.96 3kbz h VAL 302 Cb 1.21 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 3kbz h VAL 302 CO 0.81 0.07 0.00 -0.07 0.02 0.00 0.00 177.57 178.40 3kbz h LEU 303 N 0.36 0.00 -0.41 2.57 3.38 -1.91 -2.56 115.31 116.75 3kbz h LEU 303 Ca 0.53 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.50 3kbz h LEU 303 Cb 0.99 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.74 3kbz h LEU 303 CO -0.53 0.00 -0.54 0.47 0.09 0.00 0.00 178.44 177.93 3kbz n ASP 304 N -2.42 1.17 -4.72 -0.43 8.00 0.23 -0.89 116.55 117.50 3kbz n ASP 304 Ca 0.00 -0.94 -0.42 0.00 0.71 0.00 0.00 54.79 54.14 3kbz n ASP 304 Cb 0.15 0.45 -0.03 0.00 -0.02 0.00 0.00 41.12 41.66 3kbz n ASP 304 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3kbz s VAL 305 N -2.72 3.30 -0.46 2.53 1.01 -0.97 -4.95 120.40 118.14 3kbz s VAL 305 Ca 0.16 0.94 -0.19 0.00 0.00 0.00 0.00 61.98 62.90 3kbz s VAL 305 Cb 0.18 -3.60 0.04 0.00 0.00 0.00 0.00 36.38 32.99 3kbz s VAL 305 CO 0.65 0.08 0.54 -0.63 0.00 0.00 0.00 175.10 175.74 3kbz s ILE 306 N 1.02 4.97 0.50 2.22 1.01 -1.26 -4.35 121.20 125.31 3kbz s ILE 306 Ca 0.64 -0.34 -0.20 0.00 0.00 0.00 0.00 60.65 60.75 3kbz s ILE 306 Cb -0.37 -4.17 -0.07 0.00 0.01 0.00 0.00 42.46 37.86 3kbz s ILE 306 CO 0.31 -0.60 1.09 -2.16 0.00 0.00 0.00 174.94 173.58 3kbz s PRO 307 N 2.43 3.62 0.00 2.79 0.04 -1.26 -4.96 135.00 137.65 3kbz s PRO 307 Ca 0.15 1.53 0.00 0.00 0.04 0.00 0.00 61.00 62.72 3kbz s PRO 307 Cb -0.18 -2.12 0.00 0.00 0.04 0.00 0.00 34.50 32.25 3kbz s PRO 307 CO 0.14 -0.61 0.00 0.25 0.04 0.00 0.00 177.00 176.81 3kbz n THR 308 N -1.00 0.00 -3.76 1.26 -2.24 -1.26 -4.80 114.28 102.48 3kbz n THR 308 Ca 0.10 -0.40 -0.14 0.00 -2.27 0.00 0.00 64.05 61.33 3kbz n THR 308 Cb 0.51 0.96 -0.15 0.00 -2.10 0.00 0.00 70.33 69.56 3kbz n THR 308 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3kbz s ASP 309 N -0.92 -0.05 0.66 3.42 3.68 -1.26 -5.05 116.67 117.16 3kbz s ASP 309 Ca 0.00 0.21 0.44 0.00 2.13 0.00 0.00 52.55 55.33 3kbz s ASP 309 Cb 0.00 0.10 2.39 0.00 -1.45 0.00 0.00 42.92 43.96 3kbz s ASP 309 CO 0.00 -0.14 2.37 0.16 0.13 0.00 0.00 175.17 177.68 3kbz h ILE 310 N 6.13 0.04 -0.20 4.11 3.07 -1.93 -1.90 117.51 126.83 3kbz h ILE 310 Ca -0.44 -0.01 0.00 0.00 1.55 0.00 0.00 64.86 65.97 3kbz h ILE 310 Cb 1.13 1.01 0.00 0.00 -0.27 0.00 0.00 36.82 38.69 3kbz h ILE 310 CO 0.44 0.00 0.00 1.41 -1.05 0.00 0.00 178.15 178.95 3kbz n HIS 311 N -3.14 0.59 -2.09 0.16 8.25 -1.26 -4.50 115.22 113.23 3kbz n HIS 311 Ca -0.03 -0.80 -0.37 0.00 -0.26 0.00 0.00 57.72 56.26 3kbz n HIS 311 Cb 0.07 -0.21 0.01 0.00 1.12 0.00 0.00 29.99 30.99 3kbz n HIS 311 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 3kbz s GLN 312 N -2.35 3.39 0.55 -0.41 -2.07 -0.72 -4.83 119.66 113.22 3kbz s GLN 312 Ca 0.33 1.88 -0.03 0.00 -1.82 0.00 0.00 55.36 55.72 3kbz s GLN 312 Cb 0.26 -2.22 0.01 0.00 -1.09 0.00 0.00 33.01 29.97 3kbz s GLN 312 CO 0.08 -0.88 0.82 1.03 -1.32 0.00 0.00 175.29 175.02 3kbz s ARG 313 N -2.95 2.83 -0.21 9.60 0.52 -1.26 -1.41 118.95 126.07 3kbz s ARG 313 Ca 0.70 -0.29 -0.18 0.00 -0.52 0.00 0.00 55.73 55.44 3kbz s ARG 313 Cb -0.31 -2.38 0.06 0.00 0.52 0.00 0.00 34.95 32.83 3kbz s ARG 313 CO 0.37 -0.62 0.56 0.00 0.02 0.00 0.00 175.30 175.62 3kbz s ALA 314 N -2.85 -1.40 0.58 2.13 0.00 -0.02 -4.65 121.76 115.55 3kbz s ALA 314 Ca 0.53 1.68 -0.17 0.00 0.00 0.00 0.00 51.96 54.01 3kbz s ALA 314 Cb -0.10 -0.99 -0.04 0.00 0.00 0.00 0.00 23.12 21.99 3kbz s ALA 314 CO 0.42 -0.28 1.06 -2.14 0.00 0.00 0.00 175.76 174.82 3kbz s PRO 315 N 0.62 3.38 -0.15 0.00 0.02 -1.18 -4.18 135.00 133.51 3kbz s PRO 315 Ca -0.03 1.25 -0.11 0.00 0.02 0.00 0.00 61.00 62.13 3kbz s PRO 315 Cb -0.05 -2.04 0.05 0.00 0.02 0.00 0.00 34.50 32.48 3kbz s PRO 315 CO -0.04 -0.76 0.39 0.54 -0.33 0.00 0.00 177.00 176.80 3kbz s VAL 316 N -2.35 -0.01 -0.12 3.83 0.11 -0.99 -4.27 120.40 116.59 3kbz s VAL 316 Ca 0.65 0.05 -0.02 0.00 -2.93 0.00 0.00 61.98 59.73 3kbz s VAL 316 Cb -0.16 -0.56 0.04 0.00 -1.53 0.00 0.00 36.38 34.16 3kbz s VAL 316 CO 0.34 0.02 -0.00 -0.63 -3.33 0.00 0.00 175.10 171.50 3kbz s ILE 317 N 0.81 0.56 0.18 7.04 1.09 0.49 -1.42 121.20 129.95 3kbz s ILE 317 Ca -0.05 -0.21 -0.01 0.00 -1.10 0.00 0.00 60.65 59.28 3kbz s ILE 317 Cb -0.06 -0.82 -0.04 0.00 -1.06 0.00 0.00 42.46 40.48 3kbz s ILE 317 CO -0.06 0.11 0.10 -1.48 -0.10 0.00 0.00 174.94 173.51 3kbz s LEU 318 N 1.88 1.39 0.00 2.97 0.05 -0.50 -0.75 118.68 123.72 3kbz s LEU 318 Ca 0.03 -1.32 0.00 0.00 0.05 0.00 0.00 54.13 52.88 3kbz s LEU 318 Cb -0.14 0.34 0.00 0.00 -2.05 0.00 0.00 46.19 44.34 3kbz s LEU 318 CO -0.07 -0.80 0.00 0.61 -0.55 0.00 0.00 176.35 175.55 3kbz n GLY 319 N -0.21 0.68 3.65 -3.48 0.00 -0.66 -0.34 105.19 104.84 3kbz n GLY 319 Ca -0.01 -1.86 -0.46 0.00 0.00 0.00 0.00 46.02 43.70 3kbz n GLY 319 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3kbz n SER 320 N 0.00 2.42 -0.08 1.61 7.64 0.64 -1.73 113.62 124.12 3kbz n SER 320 Ca 0.00 1.14 -0.08 0.00 1.01 0.00 0.00 58.87 60.94 3kbz n SER 320 Cb 0.00 -1.37 -0.01 0.00 -1.01 0.00 0.00 64.21 61.82 3kbz n SER 320 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3kbz h PRO 321 N 4.12 -0.23 -0.68 1.43 0.13 -1.76 -0.64 132.00 134.37 3kbz h PRO 321 Ca -0.45 0.02 0.08 0.00 -0.87 0.00 0.00 66.00 64.78 3kbz h PRO 321 Cb 1.29 0.05 -0.04 0.00 0.13 0.00 0.00 31.00 32.43 3kbz h PRO 321 CO 0.75 -0.15 0.45 -0.44 -0.23 0.00 0.00 178.00 178.38 3kbz h ASP 322 N -0.24 0.55 -0.22 1.44 5.19 -1.73 0.23 116.42 121.64 3kbz h ASP 322 Ca 0.16 0.01 -0.18 0.00 -0.62 0.00 0.00 57.03 56.40 3kbz h ASP 322 Cb 0.48 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 39.89 3kbz h ASP 322 CO -0.45 0.34 -0.56 0.44 -3.12 0.00 0.00 179.24 175.89 3kbz h ASP 323 N 0.62 0.88 -0.20 6.45 3.45 -1.46 -1.93 116.42 124.22 3kbz h ASP 323 Ca 0.31 -0.57 -0.10 0.00 0.43 0.00 0.00 57.03 57.10 3kbz h ASP 323 Cb 0.39 -0.25 -0.00 0.00 -0.56 0.00 0.00 39.33 38.91 3kbz h ASP 323 CO -0.10 1.29 -0.26 0.58 -1.57 0.00 0.00 179.24 179.18 3kbz h VAL 324 N 0.50 1.33 -0.65 -1.35 2.07 -0.43 -2.20 116.25 115.52 3kbz h VAL 324 Ca -0.01 -1.45 0.09 0.00 0.82 0.00 0.00 66.70 66.14 3kbz h VAL 324 Cb 1.18 1.79 -0.07 0.00 -1.52 0.00 0.00 31.29 32.68 3kbz h VAL 324 CO 0.12 0.45 0.29 -0.07 0.02 0.00 0.00 177.57 178.38 3kbz h LEU 325 N 0.21 0.36 -0.87 2.57 4.07 -0.61 0.79 115.31 121.83 3kbz h LEU 325 Ca 0.03 0.06 -0.00 0.00 0.08 0.00 0.00 57.88 58.05 3kbz h LEU 325 Cb 0.83 0.01 -0.04 0.00 1.08 0.00 0.00 40.66 42.53 3kbz h LEU 325 CO 0.06 0.21 0.54 -0.08 -1.08 0.00 0.00 178.44 178.10 3kbz h GLU 326 N 0.52 1.17 -0.22 1.13 4.81 -1.23 -0.12 114.58 120.65 3kbz h GLU 326 Ca 0.32 -0.09 -0.01 0.00 -0.13 0.00 0.00 59.36 59.45 3kbz h GLU 326 Cb 0.34 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 3kbz h GLU 326 CO -0.27 0.81 0.11 0.35 -0.73 0.00 0.00 179.01 179.28 3kbz h PHE 327 N 1.19 0.31 -0.24 0.92 3.57 -0.50 -2.21 116.94 119.97 3kbz h PHE 327 Ca 0.31 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.85 3kbz h PHE 327 Cb -0.08 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.55 3kbz h PHE 327 CO -0.00 0.29 0.16 -0.07 -2.23 0.00 0.00 178.31 176.46 3kbz h LEU 328 N 0.23 0.10 -0.15 0.59 3.38 -0.25 0.20 115.31 119.41 3kbz h LEU 328 Ca 0.08 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 3kbz h LEU 328 Cb 0.10 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3kbz h LEU 328 CO -0.01 0.07 0.02 0.50 0.09 0.00 0.00 178.44 179.11 3kbz h LYS 329 N 0.12 0.25 -0.47 1.13 3.64 -0.45 0.51 116.57 121.30 3kbz h LYS 329 Ca 0.11 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 3kbz h LYS 329 Cb 0.28 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.05 3kbz h LYS 329 CO -0.01 0.44 0.20 0.28 -2.27 0.00 0.00 179.45 178.08 3kbz h VAL 330 N 0.03 1.20 -0.57 2.00 2.07 -0.76 -2.24 116.25 117.98 3kbz h VAL 330 Ca 0.05 -0.60 0.04 0.00 0.82 0.00 0.00 66.70 67.00 3kbz h VAL 330 Cb 0.31 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 30.76 3kbz h VAL 330 CO 0.00 0.23 0.32 0.22 0.02 0.00 0.00 177.57 178.36 3kbz h TYR 331 N 0.61 0.58 -0.09 1.57 3.20 -0.45 -1.99 116.97 120.40 3kbz h TYR 331 Ca 0.16 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.98 3kbz h TYR 331 Cb 0.17 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.25 3kbz h TYR 331 CO -0.00 0.30 -0.25 0.93 -1.64 0.00 0.00 178.16 177.50 3kbz h GLU 332 N 0.61 0.16 0.00 1.82 5.08 -0.67 -2.32 114.58 119.26 3kbz h GLU 332 Ca 0.25 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.50 3kbz h GLU 332 Cb 0.11 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 3kbz h GLU 332 CO -0.15 0.40 -0.27 -0.22 -1.00 0.00 0.00 179.01 177.78 3kbz h LYS 333 N 0.15 0.00 -0.49 2.33 3.64 -0.76 -2.19 116.57 119.25 3kbz h LYS 333 Ca 0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 3kbz h LYS 333 Cb 0.52 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.34 3kbz h LYS 333 CO 0.04 0.27 0.00 0.72 -2.27 0.00 0.00 179.45 178.20 3kbz n HIS 334 N -4.13 0.64 1.09 1.91 8.25 -0.91 -5.12 115.22 116.95 3kbz n HIS 334 Ca -0.02 -0.32 0.12 0.00 -0.26 0.00 0.00 57.72 57.24 3kbz n HIS 334 Cb 0.32 0.00 0.17 0.00 1.12 0.00 0.00 29.99 31.61 3kbz n HIS 334 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43