#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d4s h VAL 33 N 0.00 0.99 -0.12 5.87 2.07 -2.00 -2.36 116.25 120.71 3d4s h VAL 33 Ca 0.00 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.15 3d4s h VAL 33 Cb 0.00 -0.11 -0.00 0.00 -1.52 0.00 0.00 31.29 29.66 3d4s h VAL 33 CO 0.00 0.18 -0.02 0.58 0.02 0.00 0.00 177.57 178.33 3d4s h VAL 34 N 1.01 1.28 -0.86 2.57 2.07 -2.02 -1.69 116.25 118.61 3d4s h VAL 34 Ca 0.45 -0.94 0.22 0.00 0.82 0.00 0.00 66.70 67.24 3d4s h VAL 34 Cb 0.36 1.68 -0.05 0.00 -1.52 0.00 0.00 31.29 31.75 3d4s h VAL 34 CO -0.20 0.27 0.59 1.23 0.02 0.00 0.00 177.57 179.48 3d4s h GLY 35 N -0.09 0.48 0.80 2.17 0.00 -1.88 -0.45 103.07 104.10 3d4s h GLY 35 Ca 0.03 -0.10 -0.32 0.00 0.00 0.00 0.00 47.33 46.94 3d4s h GLY 35 CO 0.01 -0.00 -1.85 -0.13 0.00 0.00 0.00 176.54 174.57 3d4s n MET 36 N -4.41 0.67 -0.05 4.80 0.00 -1.12 -3.71 117.12 113.30 3d4s n MET 36 Ca 0.18 0.27 -0.00 0.00 0.00 0.00 0.00 57.70 58.15 3d4s n MET 36 Cb 0.78 -1.75 0.29 0.00 0.00 0.00 0.00 33.22 32.54 3d4s n MET 36 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 175.97 176.75 3d4s h GLY 37 N 2.81 0.69 0.78 -5.12 0.00 -0.27 -0.56 103.07 101.40 3d4s h GLY 37 Ca -0.35 -0.36 -0.08 0.00 0.00 0.00 0.00 47.33 46.55 3d4s h GLY 37 CO 0.08 0.34 -0.19 -2.22 0.00 0.00 0.00 176.54 174.55 3d4s h ILE 38 N 0.63 1.35 -0.14 2.60 2.04 -1.29 -2.38 117.51 120.32 3d4s h ILE 38 Ca 0.15 -1.38 0.03 0.00 1.00 0.00 0.00 64.86 64.66 3d4s h ILE 38 Cb 0.21 1.87 -0.03 0.00 -0.74 0.00 0.00 36.82 38.13 3d4s h ILE 38 CO -0.01 0.41 -0.03 0.58 0.00 0.00 0.00 178.15 179.10 3d4s h VAL 39 N 0.05 0.86 -0.15 1.67 2.07 -1.55 -0.69 116.25 118.51 3d4s h VAL 39 Ca 0.02 -0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.51 3d4s h VAL 39 Cb 0.74 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 3d4s h VAL 39 CO 0.05 0.00 -0.02 0.24 0.02 0.00 0.00 177.57 177.85 3d4s h MET 40 N 0.00 0.22 -0.12 1.57 2.86 -1.15 -1.45 114.93 116.86 3d4s h MET 40 Ca 0.07 -0.03 -0.18 0.00 -2.06 0.00 0.00 59.70 57.50 3d4s h MET 40 Cb 0.10 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 31.72 3d4s h MET 40 CO -0.15 0.27 -0.66 0.77 1.06 0.00 0.00 176.91 178.20 3d4s h SER 41 N 0.22 0.56 0.79 1.22 0.02 -0.87 -1.79 113.55 113.70 3d4s h SER 41 Ca 0.05 -0.34 -0.07 0.00 -0.84 0.00 0.00 61.79 60.59 3d4s h SER 41 Cb 0.19 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 3d4s h SER 41 CO 0.01 1.07 -0.33 -0.07 -1.14 0.00 0.00 176.83 176.37 3d4s h LEU 42 N 0.35 0.00 0.10 5.07 3.38 -0.54 -1.97 115.31 121.70 3d4s h LEU 42 Ca -0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3d4s h LEU 42 Cb 1.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.98 3d4s h LEU 42 CO 0.12 0.33 -0.05 0.40 0.09 0.00 0.00 178.44 179.33 3d4s h ILE 43 N 0.00 1.10 -0.52 1.22 2.04 -1.10 -2.12 117.51 118.13 3d4s h ILE 43 Ca -0.00 -1.25 0.09 0.00 1.00 0.00 0.00 64.86 64.70 3d4s h ILE 43 Cb 0.81 1.83 -0.08 0.00 -0.74 0.00 0.00 36.82 38.65 3d4s h ILE 43 CO 0.04 0.28 0.08 0.58 0.00 0.00 0.00 178.15 179.13 3d4s h VAL 44 N -0.77 0.67 -0.39 1.67 2.07 -1.26 -1.64 116.25 116.60 3d4s h VAL 44 Ca -0.01 -0.07 -0.05 0.00 0.82 0.00 0.00 66.70 67.38 3d4s h VAL 44 Cb 0.57 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 3d4s h VAL 44 CO 0.02 0.04 0.04 -0.07 0.02 0.00 0.00 177.57 177.62 3d4s h LEU 45 N 0.21 0.65 -1.34 2.57 3.38 -1.45 -2.41 115.31 116.92 3d4s h LEU 45 Ca 0.26 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3d4s h LEU 45 Cb 0.37 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 3d4s h LEU 45 CO -0.37 0.77 0.24 0.00 0.09 0.00 0.00 178.44 179.17 3d4s h ALA 46 N 0.90 1.49 -0.02 1.53 0.00 -0.93 0.83 119.26 123.06 3d4s h ALA 46 Ca 0.12 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3d4s h ALA 46 Cb 0.41 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3d4s h ALA 46 CO 0.01 0.41 -0.06 0.82 0.00 0.00 0.00 179.25 180.43 3d4s h ILE 47 N 0.69 1.46 -0.09 0.00 2.04 -1.26 -2.39 117.51 117.97 3d4s h ILE 47 Ca 0.17 -1.46 -0.01 0.00 1.00 0.00 0.00 64.86 64.56 3d4s h ILE 47 Cb 0.08 2.39 -0.00 0.00 -0.74 0.00 0.00 36.82 38.54 3d4s h ILE 47 CO -0.02 0.39 0.01 0.58 0.00 0.00 0.00 178.15 179.11 3d4s h VAL 48 N -0.48 1.22 0.38 1.67 2.07 -1.30 -2.16 116.25 117.65 3d4s h VAL 48 Ca -0.00 -0.69 -0.00 0.00 0.82 0.00 0.00 66.70 66.82 3d4s h VAL 48 Cb 0.67 1.51 -0.02 0.00 -1.52 0.00 0.00 31.29 31.93 3d4s h VAL 48 CO 0.01 0.20 -0.38 0.15 0.02 0.00 0.00 177.57 177.57 3d4s h PHE 49 N -0.09 -1.03 -0.45 1.57 3.57 -0.95 -1.71 116.94 117.87 3d4s h PHE 49 Ca 0.03 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.53 3d4s h PHE 49 Cb 0.30 0.40 -0.02 0.00 2.79 0.00 0.00 35.95 39.42 3d4s h PHE 49 CO 0.02 -0.53 0.28 0.78 -2.23 0.00 0.00 178.31 176.63 3d4s h GLY 50 N -0.78 0.64 1.32 2.40 0.00 -1.50 -2.22 103.07 102.94 3d4s h GLY 50 Ca -0.03 -0.26 -0.18 0.00 0.00 0.00 0.00 47.33 46.86 3d4s h GLY 50 CO -0.06 0.25 -0.56 3.43 0.00 0.00 0.00 176.54 179.60 3d4s h ASN 51 N 0.60 0.79 -0.71 0.19 2.35 -1.40 -1.86 115.58 115.53 3d4s h ASN 51 Ca 0.16 -0.43 -0.03 0.00 -0.55 0.00 0.00 56.30 55.45 3d4s h ASN 51 Cb -0.02 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.09 3d4s h ASN 51 CO -0.03 1.19 0.33 0.58 -1.65 0.00 0.00 177.43 177.85 3d4s h VAL 52 N 0.54 1.24 -0.94 2.81 2.07 -1.29 -0.44 116.25 120.24 3d4s h VAL 52 Ca 0.01 -0.69 -0.00 0.00 0.82 0.00 0.00 66.70 66.84 3d4s h VAL 52 Cb 1.14 0.37 -0.05 0.00 -1.52 0.00 0.00 31.29 31.23 3d4s h VAL 52 CO 0.12 0.28 0.58 0.25 0.02 0.00 0.00 177.57 178.82 3d4s h LEU 53 N 1.00 1.12 -0.18 2.57 5.85 -1.30 0.08 115.31 124.45 3d4s h LEU 53 Ca 0.24 -0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.85 3d4s h LEU 53 Cb 0.14 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 40.89 3d4s h LEU 53 CO -0.03 0.84 -0.12 0.58 -0.34 0.00 0.00 178.44 179.38 3d4s h VAL 54 N 1.29 1.32 -0.33 1.05 2.07 -0.91 -2.74 116.25 118.00 3d4s h VAL 54 Ca 0.34 -1.21 -0.02 0.00 0.82 0.00 0.00 66.70 66.63 3d4s h VAL 54 Cb -0.08 1.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 3d4s h VAL 54 CO -0.07 0.36 0.15 0.40 0.02 0.00 0.00 177.57 178.43 3d4s h ILE 55 N 0.07 1.17 -0.67 4.57 2.04 -0.86 -2.82 117.51 121.01 3d4s h ILE 55 Ca 0.04 -0.51 -0.00 0.00 1.00 0.00 0.00 64.86 65.38 3d4s h ILE 55 Cb 0.62 0.89 -0.03 0.00 -0.74 0.00 0.00 36.82 37.56 3d4s h ILE 55 CO 0.03 0.18 0.40 0.74 0.00 0.00 0.00 178.15 179.51 3d4s h THR 56 N 0.40 1.20 -0.60 -0.27 2.02 -1.05 -2.05 112.91 112.55 3d4s h THR 56 Ca 0.11 -0.44 -0.00 0.00 0.77 0.00 0.00 66.41 66.85 3d4s h THR 56 Cb 0.15 0.27 -0.03 0.00 -1.74 0.00 0.00 68.15 66.80 3d4s h THR 56 CO -0.01 0.20 0.36 0.00 0.37 0.00 0.00 175.52 176.44 3d4s h ALA 57 N 1.21 0.76 0.00 6.16 0.00 -1.42 -0.91 119.26 125.06 3d4s h ALA 57 Ca 0.24 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 3d4s h ALA 57 Cb -0.02 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 3d4s h ALA 57 CO -0.04 0.24 -0.30 0.82 0.00 0.00 0.00 179.25 179.96 3d4s h ILE 58 N 0.81 0.67 0.00 0.00 2.04 -1.39 -2.24 117.51 117.40 3d4s h ILE 58 Ca 0.21 -1.40 0.00 0.00 1.00 0.00 0.00 64.86 64.68 3d4s h ILE 58 Cb -0.02 1.92 0.00 0.00 -0.74 0.00 0.00 36.82 37.98 3d4s h ILE 58 CO -0.04 0.30 -0.68 0.00 0.00 0.00 0.00 178.15 177.72 3d4s n ALA 59 N -2.24 3.20 -0.09 1.87 0.00 -0.78 -4.47 120.51 118.00 3d4s n ALA 59 Ca 0.00 -0.31 -0.17 0.00 0.00 0.00 0.00 53.44 52.96 3d4s n ALA 59 Cb 0.50 -1.11 -0.07 0.00 0.00 0.00 0.00 19.45 18.77 3d4s n ALA 59 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3d4s n LYS 60 N -1.91 0.40 -3.21 0.00 4.81 -0.38 -4.96 118.16 112.91 3d4s n LYS 60 Ca 0.04 0.15 -0.39 0.00 -0.87 0.00 0.00 58.31 57.23 3d4s n LYS 60 Cb 0.41 -1.22 -0.07 0.00 0.02 0.00 0.00 35.03 34.18 3d4s n LYS 60 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 3d4s s PHE 61 N -2.34 3.36 0.36 5.64 0.40 -0.85 -4.97 117.98 119.58 3d4s s PHE 61 Ca -0.25 0.81 0.15 0.00 -0.60 0.00 0.00 56.93 57.03 3d4s s PHE 61 Cb 0.09 -2.71 0.78 0.00 0.51 0.00 0.00 43.02 41.68 3d4s s PHE 61 CO 0.35 -0.14 1.84 0.93 0.70 0.00 0.00 175.22 178.90 3d4s h GLU 62 N 7.51 0.00 -0.21 0.44 3.07 -1.89 -2.95 114.58 120.55 3d4s h GLU 62 Ca -0.33 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.50 3d4s h GLU 62 Cb 1.15 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.05 3d4s h GLU 62 CO 0.75 0.35 -0.02 -0.09 -1.40 0.00 0.00 179.01 178.60 3d4s h ARG 63 N 0.00 0.32 -0.13 2.33 2.43 -1.95 -2.22 114.38 115.16 3d4s h ARG 63 Ca -0.00 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 3d4s h ARG 63 Cb 0.66 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.15 3d4s h ARG 63 CO 0.05 0.37 0.00 1.28 -1.51 0.00 0.00 179.97 180.15 3d4s n LEU 64 N -4.34 1.69 -3.79 3.80 4.77 -1.11 -4.63 117.00 113.39 3d4s n LEU 64 Ca 0.00 -0.67 -0.42 0.00 -0.03 0.00 0.00 56.01 54.89 3d4s n LEU 64 Cb 0.21 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 3d4s n LEU 64 CO 0.37 0.34 2.12 0.00 -1.33 0.00 0.00 177.39 178.89 3d4s n GLN 65 N 0.33 3.67 -4.36 3.23 6.02 -0.83 -4.69 117.38 120.75 3d4s n GLN 65 Ca 0.17 -3.39 -0.25 0.00 -0.01 0.00 0.00 57.00 53.52 3d4s n GLN 65 Cb 0.35 -2.92 -0.09 0.00 1.02 0.00 0.00 30.24 28.60 3d4s n GLN 65 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 3d4s s THR 66 N 0.50 2.98 0.28 5.09 -4.23 -1.26 -5.05 115.64 113.95 3d4s s THR 66 Ca 0.43 -1.98 0.02 0.00 -1.18 0.00 0.00 61.69 58.98 3d4s s THR 66 Cb 0.11 -2.53 0.27 0.00 1.34 0.00 0.00 72.50 71.70 3d4s s THR 66 CO -0.02 -0.27 1.78 0.58 -0.54 0.00 0.00 174.62 176.15 3d4s h VAL 67 N 2.42 0.74 -0.40 2.29 2.07 -1.93 -1.76 116.25 119.69 3d4s h VAL 67 Ca -0.44 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 66.82 3d4s h VAL 67 Cb 1.23 -0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 3d4s h VAL 67 CO 0.57 0.13 0.22 0.74 0.02 0.00 0.00 177.57 179.25 3d4s h THR 68 N 0.73 1.15 0.00 2.57 2.02 -1.96 -2.66 112.91 114.75 3d4s h THR 68 Ca 0.52 -0.37 0.00 0.00 0.77 0.00 0.00 66.41 67.33 3d4s h THR 68 Cb 0.75 0.67 0.00 0.00 -1.74 0.00 0.00 68.15 67.83 3d4s h THR 68 CO -0.36 0.15 0.00 0.59 0.37 0.00 0.00 175.52 176.27 3d4s n ASN 69 N -4.74 0.50 -0.02 4.18 3.02 -0.70 -2.04 115.26 115.45 3d4s n ASN 69 Ca 0.00 0.62 -0.16 0.00 -0.03 0.00 0.00 54.58 55.01 3d4s n ASN 69 Cb 0.08 -0.72 -0.05 0.00 -0.61 0.00 0.00 39.78 38.47 3d4s n ASN 69 CO 0.00 0.00 0.00 1.88 -2.62 0.00 0.00 177.26 176.52 3d4s h TYR 70 N 0.00 1.01 -0.10 3.10 -1.99 -1.08 -1.02 116.97 116.89 3d4s h TYR 70 Ca 0.00 -0.44 -0.18 0.00 2.00 0.00 0.00 58.73 60.12 3d4s h TYR 70 Cb 0.36 -0.16 -0.01 0.00 2.00 0.00 0.00 36.73 38.92 3d4s h TYR 70 CO 0.00 1.26 -0.68 0.74 -0.00 0.00 0.00 178.16 179.48 3d4s h PHE 71 N 0.53 0.58 -0.40 4.88 0.04 -1.41 -2.44 116.94 118.72 3d4s h PHE 71 Ca -0.04 -0.24 -0.05 0.00 2.80 0.00 0.00 57.97 60.44 3d4s h PHE 71 Cb 1.36 -0.09 -0.02 0.00 2.20 0.00 0.00 35.95 39.40 3d4s h PHE 71 CO 0.08 0.99 0.03 0.82 -0.60 0.00 0.00 178.31 179.63 3d4s h ILE 72 N 0.31 1.20 -0.15 -0.55 2.04 -1.35 0.57 117.51 119.60 3d4s h ILE 72 Ca -0.02 -0.79 -0.01 0.00 1.00 0.00 0.00 64.86 65.03 3d4s h ILE 72 Cb 1.25 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 38.19 3d4s h ILE 72 CO 0.12 0.28 0.03 0.74 0.00 0.00 0.00 178.15 179.32 3d4s h THR 73 N 0.59 1.20 -1.00 -0.27 2.02 -1.03 0.24 112.91 114.66 3d4s h THR 73 Ca 0.13 -0.63 0.07 0.00 0.77 0.00 0.00 66.41 66.75 3d4s h THR 73 Cb 0.32 1.35 -0.07 0.00 -1.74 0.00 0.00 68.15 68.01 3d4s h THR 73 CO 0.01 0.19 0.65 -1.28 0.37 0.00 0.00 175.52 175.45 3d4s h SER 74 N 0.04 1.02 -0.33 4.18 0.87 -0.99 0.86 113.55 119.19 3d4s h SER 74 Ca 0.05 0.01 -0.15 0.00 -1.23 0.00 0.00 61.79 60.47 3d4s h SER 74 Cb 0.26 -0.20 -0.00 0.00 -0.44 0.00 0.00 62.40 62.02 3d4s h SER 74 CO 0.00 0.64 -0.37 0.25 -0.53 0.00 0.00 176.83 176.82 3d4s h LEU 75 N 1.15 0.90 -0.84 2.23 5.85 -0.66 -2.68 115.31 121.27 3d4s h LEU 75 Ca 0.44 -0.48 -0.12 0.00 0.84 0.00 0.00 57.88 58.56 3d4s h LEU 75 Cb 0.21 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 3d4s h LEU 75 CO -0.19 1.20 -0.41 0.00 -0.34 0.00 0.00 178.44 178.71 3d4s h ALA 76 N 0.73 1.01 -0.22 1.25 0.00 0.16 -2.65 119.26 119.53 3d4s h ALA 76 Ca 0.05 -0.42 -0.14 0.00 0.00 0.00 0.00 54.91 54.39 3d4s h ALA 76 Cb 0.97 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 3d4s h ALA 76 CO 0.09 0.61 -0.44 0.00 0.00 0.00 0.00 179.25 179.51 3d4s h ALA 78 N 1.06 1.00 -0.00 0.00 0.00 -1.34 -0.46 119.26 119.51 3d4s h ALA 78 Ca 0.03 -0.22 -0.16 0.00 0.00 0.00 0.00 54.91 54.56 3d4s h ALA 78 Cb 0.95 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 3d4s h ALA 78 CO 0.08 0.67 -0.74 -0.44 0.00 0.00 0.00 179.25 178.83 3d4s h ASP 79 N 1.13 0.05 -0.35 0.00 3.32 -1.30 -2.36 116.42 116.91 3d4s h ASP 79 Ca 0.25 -0.03 -0.16 0.00 0.02 0.00 0.00 57.03 57.10 3d4s h ASP 79 Cb 0.29 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 3d4s h ASP 79 CO -0.01 0.77 -0.41 0.25 -1.72 0.00 0.00 179.24 178.12 3d4s h LEU 80 N 0.02 0.98 -0.99 1.55 5.85 -0.35 -0.99 115.31 121.38 3d4s h LEU 80 Ca -0.01 -0.46 -0.11 0.00 0.84 0.00 0.00 57.88 58.14 3d4s h LEU 80 Cb 1.30 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 42.04 3d4s h LEU 80 CO 0.10 1.25 -0.50 0.58 -0.34 0.00 0.00 178.44 179.54 3d4s h VAL 81 N 0.74 1.36 -0.24 1.05 2.07 -1.11 -1.47 116.25 118.65 3d4s h VAL 81 Ca 0.05 -1.70 -0.06 0.00 0.82 0.00 0.00 66.70 65.81 3d4s h VAL 81 Cb 1.00 1.91 -0.01 0.00 -1.52 0.00 0.00 31.29 32.67 3d4s h VAL 81 CO 0.10 0.49 -0.09 -0.03 0.02 0.00 0.00 177.57 178.06 3d4s h MET 82 N 0.02 0.48 0.00 1.57 1.85 -1.20 -0.01 114.93 117.64 3d4s h MET 82 Ca -0.00 -0.20 -0.07 0.00 -0.61 0.00 0.00 59.70 58.82 3d4s h MET 82 Cb 0.88 -0.02 -0.01 0.00 0.43 0.00 0.00 31.60 32.88 3d4s h MET 82 CO 0.07 0.73 -0.35 0.78 -0.40 0.00 0.00 176.91 177.74 3d4s h GLY 83 N 0.20 0.00 0.19 1.39 0.00 -1.03 0.56 103.07 104.38 3d4s h GLY 83 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 47.00 3d4s h GLY 83 CO 0.03 0.00 -2.29 1.04 0.00 0.00 0.00 176.54 175.32 3d4s n LEU 84 N -3.36 2.77 -0.05 3.11 4.77 -0.57 -4.43 117.00 119.24 3d4s n LEU 84 Ca 0.01 0.02 0.04 0.00 -0.03 0.00 0.00 56.01 56.05 3d4s n LEU 84 Cb 0.56 -0.97 -0.03 0.00 -2.33 0.00 0.00 43.42 40.64 3d4s n LEU 84 CO 0.37 0.87 0.04 0.00 -1.33 0.00 0.00 177.39 177.33 3d4s n ALA 85 N -3.25 2.90 -0.01 -1.18 0.00 -0.03 -4.71 120.51 114.24 3d4s n ALA 85 Ca -0.42 -0.26 -0.03 0.00 0.00 0.00 0.00 53.44 52.73 3d4s n ALA 85 Cb 0.99 -0.27 -0.01 0.00 0.00 0.00 0.00 19.45 20.16 3d4s n ALA 85 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3d4s n VAL 86 N -0.94 0.99 -0.20 0.00 0.31 -0.96 -4.68 118.33 112.86 3d4s n VAL 86 Ca 0.02 0.27 -0.02 0.00 -0.01 0.00 0.00 64.34 64.60 3d4s n VAL 86 Cb 0.13 -1.73 0.08 0.00 -0.91 0.00 0.00 33.84 31.41 3d4s n VAL 86 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 3d4s h VAL 87 N -0.32 0.90 -0.84 2.52 2.07 -1.17 -1.71 116.25 117.71 3d4s h VAL 87 Ca 0.00 -0.18 0.07 0.00 0.82 0.00 0.00 66.70 67.41 3d4s h VAL 87 Cb 0.32 0.33 -0.06 0.00 -1.52 0.00 0.00 31.29 30.36 3d4s h VAL 87 CO 0.00 0.10 0.51 -0.65 0.02 0.00 0.00 177.57 177.54 3d4s h PRO 88 N 0.52 0.87 0.00 1.57 0.11 -1.81 0.89 132.00 134.15 3d4s h PRO 88 Ca 0.27 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 66.23 3d4s h PRO 88 Cb 0.23 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.13 3d4s h PRO 88 CO -0.21 0.58 -0.46 0.74 -0.21 0.00 0.00 178.00 178.44 3d4s h PHE 89 N 0.90 0.00 -0.28 0.65 0.04 -1.80 -2.48 116.94 113.96 3d4s h PHE 89 Ca 0.38 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.97 3d4s h PHE 89 Cb 0.23 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.38 3d4s h PHE 89 CO -0.04 0.46 -0.50 0.78 -0.60 0.00 0.00 178.31 178.41 3d4s h GLY 90 N 3.05 0.92 1.47 -1.45 0.00 -0.62 -1.82 103.07 104.61 3d4s h GLY 90 Ca -0.00 -1.06 -0.10 0.00 0.00 0.00 0.00 47.33 46.17 3d4s h GLY 90 CO 0.06 0.95 -0.19 0.00 0.00 0.00 0.00 176.54 177.36 3d4s h ALA 91 N 0.67 1.04 -0.43 3.60 0.00 -0.80 -2.53 119.26 120.81 3d4s h ALA 91 Ca 0.02 -0.34 -0.12 0.00 0.00 0.00 0.00 54.91 54.47 3d4s h ALA 91 Cb 1.11 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 3d4s h ALA 91 CO 0.11 0.58 -0.19 0.00 0.00 0.00 0.00 179.25 179.75 3d4s h ALA 92 N 1.23 0.60 -0.31 0.00 0.00 -1.38 -2.56 119.26 116.84 3d4s h ALA 92 Ca 0.09 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.59 3d4s h ALA 92 Cb 0.64 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 3d4s h ALA 92 CO 0.05 0.56 0.04 1.25 0.00 0.00 0.00 179.25 181.14 3d4s h HIS 93 N 0.71 0.47 0.04 0.00 6.17 -1.15 -2.59 115.15 118.81 3d4s h HIS 93 Ca 0.10 -0.03 -0.00 0.00 0.71 0.00 0.00 60.37 61.14 3d4s h HIS 93 Cb 0.76 -0.14 0.00 0.00 2.52 0.00 0.00 27.41 30.54 3d4s h HIS 93 CO 0.06 0.45 -0.02 0.82 0.71 0.00 0.00 177.93 179.94 3d4s h ILE 94 N 0.46 1.05 -0.44 6.26 2.04 -1.39 -2.67 117.51 122.82 3d4s h ILE 94 Ca 0.10 -1.62 -0.07 0.00 1.00 0.00 0.00 64.86 64.27 3d4s h ILE 94 Cb 0.24 1.92 -0.02 0.00 -0.74 0.00 0.00 36.82 38.22 3d4s h ILE 94 CO 0.00 0.33 -0.00 -0.07 0.00 0.00 0.00 178.15 178.41 3d4s h LEU 95 N -0.95 0.69 0.00 1.44 3.38 -1.53 -2.77 115.31 115.57 3d4s h LEU 95 Ca -0.01 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.81 3d4s h LEU 95 Cb 0.59 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.16 3d4s h LEU 95 CO 0.01 0.76 -0.54 0.24 0.09 0.00 0.00 178.44 179.00 3d4s h MET 96 N 0.68 0.00 -2.18 1.13 2.86 -1.64 -3.48 114.93 112.30 3d4s h MET 96 Ca 0.14 0.00 -0.42 0.00 -2.06 0.00 0.00 59.70 57.36 3d4s h MET 96 Cb 0.42 0.00 -0.08 0.00 0.06 0.00 0.00 31.60 32.00 3d4s h MET 96 CO 0.02 0.00 -0.47 1.63 1.06 0.00 0.00 176.91 179.15 3d4s n LYS 97 N -2.35 -1.59 -3.72 1.72 5.02 -1.01 -4.95 118.16 111.27 3d4s n LYS 97 Ca 0.03 1.10 -0.09 0.00 -2.02 0.00 0.00 58.31 57.33 3d4s n LYS 97 Cb 0.47 -5.65 -0.02 0.00 -0.02 0.00 0.00 35.03 29.81 3d4s n LYS 97 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3d4s s MET 98 N -4.51 1.62 -0.39 1.97 0.23 -1.18 -5.03 119.30 112.02 3d4s s MET 98 Ca 0.00 -0.82 -0.04 0.00 -1.03 0.00 0.00 55.69 53.80 3d4s s MET 98 Cb 0.00 0.60 0.09 0.00 -1.53 0.00 0.00 34.83 33.99 3d4s s MET 98 CO 0.00 -0.73 0.17 -0.46 -2.03 0.00 0.00 175.02 171.97 3d4s s TRP 99 N -3.87 3.46 -0.44 3.16 -0.11 -0.44 -4.35 118.94 116.36 3d4s s TRP 99 Ca 0.08 -2.09 0.04 0.00 1.22 0.00 0.00 56.10 55.35 3d4s s TRP 99 Cb -0.04 -2.90 0.65 0.00 -1.50 0.00 0.00 33.47 29.68 3d4s s TRP 99 CO 0.00 -0.90 1.90 0.25 -4.62 0.00 0.00 176.95 173.58 3d4s n THR 100 N 4.67 3.15 0.13 5.86 -2.24 -1.26 -3.92 114.28 120.67 3d4s n THR 100 Ca -0.07 -1.87 0.03 0.00 -2.27 0.00 0.00 64.05 59.88 3d4s n THR 100 Cb 0.42 -0.48 0.05 0.00 -2.10 0.00 0.00 70.33 68.21 3d4s n THR 100 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3d4s n PHE 101 N -1.11 0.09 0.00 4.78 3.01 -1.26 -5.12 117.46 117.86 3d4s n PHE 101 Ca 0.58 -0.18 0.00 0.00 1.01 0.00 0.00 57.45 58.86 3d4s n PHE 101 Cb 1.65 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 41.10 3d4s n PHE 101 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3d4s n GLY 102 N 0.25 -1.29 0.24 1.37 0.00 -1.26 -4.13 105.19 100.37 3d4s n GLY 102 Ca 0.05 -1.60 0.13 0.00 0.00 0.00 0.00 46.02 44.59 3d4s n GLY 102 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3d4s h ASN 103 N 0.00 0.00 0.25 1.61 2.35 -1.93 -2.86 115.58 115.00 3d4s h ASN 103 Ca 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 3d4s h ASN 103 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 3d4s h ASN 103 CO 0.00 0.14 -0.12 0.15 -1.65 0.00 0.00 177.43 175.95 3d4s h PHE 104 N 0.00 -0.31 0.00 1.19 3.57 -1.99 -3.28 116.94 116.12 3d4s h PHE 104 Ca -0.00 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.43 3d4s h PHE 104 Cb 0.65 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.48 3d4s h PHE 104 CO 0.00 0.02 -0.27 2.35 -2.23 0.00 0.00 178.31 178.17 3d4s h TRP 105 N -0.97 0.00 -0.60 0.41 2.91 -1.72 -2.35 115.95 113.63 3d4s h TRP 105 Ca -0.03 0.00 0.08 0.00 1.13 0.00 0.00 58.89 60.07 3d4s h TRP 105 Cb 0.47 0.00 -0.06 0.00 -0.51 0.00 0.00 29.16 29.05 3d4s h TRP 105 CO 0.05 0.27 0.26 0.00 -1.03 0.00 0.00 178.44 177.99 3d4s h GLU 107 N 0.47 0.56 -0.47 0.00 5.08 -1.58 -2.64 114.58 116.00 3d4s h GLU 107 Ca 0.29 -0.84 -0.11 0.00 -1.00 0.00 0.00 59.36 57.71 3d4s h GLU 107 Cb 0.31 0.29 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 3d4s h GLU 107 CO -0.26 1.39 -0.13 0.35 -1.00 0.00 0.00 179.01 179.36 3d4s h PHE 108 N 0.21 0.97 -0.53 4.33 3.57 -1.24 -0.12 116.94 124.12 3d4s h PHE 108 Ca -0.21 -0.20 -0.08 0.00 3.53 0.00 0.00 57.97 61.02 3d4s h PHE 108 Cb 2.02 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 40.50 3d4s h PHE 108 CO 0.11 0.95 0.04 2.35 -2.23 0.00 0.00 178.31 179.53 3d4s h TRP 109 N 0.78 0.98 -0.51 0.41 7.01 -0.22 -1.75 115.95 122.66 3d4s h TRP 109 Ca 0.12 -0.16 -0.13 0.00 2.11 0.00 0.00 58.89 60.84 3d4s h TRP 109 Cb 0.66 -0.26 -0.01 0.00 -2.10 0.00 0.00 29.16 27.44 3d4s h TRP 109 CO 0.04 0.90 -0.17 1.15 -2.79 0.00 0.00 178.44 177.56 3d4s h THR 110 N 0.79 1.27 -0.63 2.65 2.02 -1.26 -1.89 112.91 115.86 3d4s h THR 110 Ca 0.15 -1.34 -0.06 0.00 0.77 0.00 0.00 66.41 65.93 3d4s h THR 110 Cb 0.48 1.06 -0.03 0.00 -1.74 0.00 0.00 68.15 67.93 3d4s h THR 110 CO 0.02 0.47 0.14 0.28 0.37 0.00 0.00 175.52 176.80 3d4s h SER 111 N 0.88 0.97 -0.60 4.18 0.02 -0.92 -0.79 113.55 117.27 3d4s h SER 111 Ca 0.12 -0.24 -0.10 0.00 -0.84 0.00 0.00 61.79 60.73 3d4s h SER 111 Cb 0.75 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 63.01 3d4s h SER 111 CO 0.06 0.96 -0.01 0.40 -1.14 0.00 0.00 176.83 177.10 3d4s h ILE 112 N 0.93 1.27 0.03 3.27 2.04 -1.26 0.62 117.51 124.41 3d4s h ILE 112 Ca 0.20 -1.17 -0.00 0.00 1.00 0.00 0.00 64.86 64.89 3d4s h ILE 112 Cb 0.37 0.81 0.00 0.00 -0.74 0.00 0.00 36.82 37.26 3d4s h ILE 112 CO 0.00 0.42 -0.02 -0.78 0.00 0.00 0.00 178.15 177.78 3d4s h ASP 113 N 0.98 -0.04 -0.65 1.72 1.82 -1.14 -1.41 116.42 117.70 3d4s h ASP 113 Ca 0.17 -0.07 -0.06 0.00 -0.39 0.00 0.00 57.03 56.69 3d4s h ASP 113 Cb 0.57 0.01 -0.03 0.00 0.68 0.00 0.00 39.33 40.56 3d4s h ASP 113 CO 0.03 0.04 0.20 0.58 -1.61 0.00 0.00 179.24 178.48 3d4s h VAL 114 N -0.11 1.25 0.63 2.25 2.07 -1.06 -3.07 116.25 118.21 3d4s h VAL 114 Ca -0.00 -0.88 -0.03 0.00 0.82 0.00 0.00 66.70 66.61 3d4s h VAL 114 Cb 0.10 0.52 -0.00 0.00 -1.52 0.00 0.00 31.29 30.39 3d4s h VAL 114 CO 0.01 0.34 -0.38 0.25 0.02 0.00 0.00 177.57 177.81 3d4s h LEU 115 N 1.00 -0.96 -0.74 2.57 5.85 -0.62 -2.34 115.31 120.08 3d4s h LEU 115 Ca 0.22 0.05 0.10 0.00 0.84 0.00 0.00 57.88 59.09 3d4s h LEU 115 Cb 0.30 0.28 -0.07 0.00 0.37 0.00 0.00 40.66 41.54 3d4s h LEU 115 CO -0.01 -0.60 0.38 0.00 -0.34 0.00 0.00 178.44 177.87 3d4s h VAL 117 N 0.63 1.25 -0.34 0.00 2.07 -1.56 -0.76 116.25 117.55 3d4s h VAL 117 Ca 0.36 -0.88 -0.02 0.00 0.82 0.00 0.00 66.70 66.99 3d4s h VAL 117 Cb 0.38 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 3d4s h VAL 117 CO -0.27 0.29 0.14 0.74 0.02 0.00 0.00 177.57 178.48 3d4s h THR 118 N 0.33 1.18 -0.58 2.57 2.02 -0.90 -2.17 112.91 115.36 3d4s h THR 118 Ca 0.09 -0.56 -0.04 0.00 0.77 0.00 0.00 66.41 66.67 3d4s h THR 118 Cb 0.39 0.92 -0.03 0.00 -1.74 0.00 0.00 68.15 67.70 3d4s h THR 118 CO 0.01 0.20 0.18 0.00 0.37 0.00 0.00 175.52 176.28 3d4s h ALA 119 N 0.98 1.23 0.07 6.16 0.00 -0.32 -2.26 119.26 125.13 3d4s h ALA 119 Ca 0.11 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 3d4s h ALA 119 Cb 0.18 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3d4s h ALA 119 CO -0.01 0.54 -0.04 0.77 0.00 0.00 0.00 179.25 180.52 3d4s h SER 120 N 0.85 -0.08 -0.47 0.00 0.02 -0.98 -1.84 113.55 111.04 3d4s h SER 120 Ca 0.19 -0.37 -0.05 0.00 -0.84 0.00 0.00 61.79 60.72 3d4s h SER 120 Cb 0.24 0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.78 3d4s h SER 120 CO -0.01 0.34 0.14 -0.29 -1.14 0.00 0.00 176.83 175.87 3d4s h ILE 121 N -0.53 1.22 -0.02 3.27 6.09 -1.39 -1.12 117.51 125.03 3d4s h ILE 121 Ca -0.01 -0.78 -0.16 0.00 -1.37 0.00 0.00 64.86 62.54 3d4s h ILE 121 Cb 0.45 0.67 -0.02 0.00 0.47 0.00 0.00 36.82 38.39 3d4s h ILE 121 CO 0.02 0.29 -0.71 -0.50 -3.07 0.00 0.00 178.15 174.18 3d4s h TRP 122 N 0.78 0.19 -0.28 2.19 4.06 -1.47 -1.55 115.95 119.87 3d4s h TRP 122 Ca 0.17 -0.08 -0.06 0.00 2.06 0.00 0.00 58.89 60.98 3d4s h TRP 122 Cb 0.28 -0.03 -0.01 0.00 -1.00 0.00 0.00 29.16 28.40 3d4s h TRP 122 CO 0.02 0.79 -0.05 1.15 -3.56 0.00 0.00 178.44 176.79 3d4s h THR 123 N 0.09 1.28 -0.65 1.49 2.02 -0.96 -0.79 112.91 115.40 3d4s h THR 123 Ca -0.02 -1.06 -0.03 0.00 0.77 0.00 0.00 66.41 66.08 3d4s h THR 123 Cb 1.25 1.41 -0.03 0.00 -1.74 0.00 0.00 68.15 69.04 3d4s h THR 123 CO 0.10 0.34 0.29 -0.07 0.37 0.00 0.00 175.52 176.54 3d4s h LEU 124 N 0.28 0.85 -0.43 2.58 3.38 -1.18 0.62 115.31 121.41 3d4s h LEU 124 Ca 0.07 -0.10 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 3d4s h LEU 124 Cb 0.52 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 3d4s h LEU 124 CO 0.02 0.74 0.09 0.00 0.09 0.00 0.00 178.44 179.39 3d4s h VAL 126 N 0.57 1.26 -0.37 0.00 2.07 -0.67 -1.26 116.25 117.85 3d4s h VAL 126 Ca 0.13 -0.78 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 3d4s h VAL 126 Cb 0.34 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 3d4s h VAL 126 CO 0.00 0.32 0.21 0.40 0.02 0.00 0.00 177.57 178.53 3d4s h ILE 127 N 1.15 1.14 -0.73 4.57 2.04 -0.62 0.21 117.51 125.26 3d4s h ILE 127 Ca 0.27 -0.34 0.01 0.00 1.00 0.00 0.00 64.86 65.80 3d4s h ILE 127 Cb 0.18 0.70 -0.04 0.00 -0.74 0.00 0.00 36.82 36.92 3d4s h ILE 127 CO -0.03 0.14 0.48 0.00 0.00 0.00 0.00 178.15 178.75 3d4s h ALA 128 N 1.07 0.93 -0.30 1.87 0.00 -0.81 0.18 119.26 122.20 3d4s h ALA 128 Ca 0.13 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 3d4s h ALA 128 Cb 0.04 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 3d4s h ALA 128 CO -0.02 0.34 -0.21 0.28 0.00 0.00 0.00 179.25 179.64 3d4s h VAL 129 N 0.99 1.30 -0.37 0.00 2.07 -1.02 -2.20 116.25 117.02 3d4s h VAL 129 Ca 0.27 -1.35 0.03 0.00 0.82 0.00 0.00 66.70 66.46 3d4s h VAL 129 Cb -0.11 1.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 3d4s h VAL 129 CO -0.06 0.43 0.19 -0.78 0.02 0.00 0.00 177.57 177.37 3d4s h ASP 130 N 0.43 0.29 0.55 0.57 -0.00 -0.25 -2.15 116.42 115.86 3d4s h ASP 130 Ca 0.06 0.02 -0.05 0.00 -0.00 0.00 0.00 57.03 57.06 3d4s h ASP 130 Cb 0.76 -0.04 -0.01 0.00 -0.00 0.00 0.00 39.33 40.04 3d4s h ASP 130 CO 0.06 0.21 -0.23 0.03 -0.00 0.00 0.00 179.24 179.31 3d4s h ARG 131 N 0.39 0.00 -0.00 0.28 2.47 -0.96 -2.14 114.38 114.42 3d4s h ARG 131 Ca 0.15 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.87 3d4s h ARG 131 Cb 0.05 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.37 3d4s h ARG 131 CO -0.10 0.23 -0.00 -0.92 0.56 0.00 0.00 179.97 179.73 3d4s h TYR 132 N 0.00 0.00 0.00 3.04 3.20 -0.78 -2.51 116.97 119.92 3d4s h TYR 132 Ca -0.00 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 3d4s h TYR 132 Cb 0.57 -0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.83 3d4s h TYR 132 CO 0.00 0.53 -0.08 0.74 -1.64 0.00 0.00 178.16 177.71 3d4s h PHE 133 N -0.52 0.00 -0.00 -3.82 0.04 -1.36 -2.19 116.94 109.08 3d4s h PHE 133 Ca 0.00 0.00 -0.16 0.00 2.80 0.00 0.00 57.97 60.61 3d4s h PHE 133 Cb 0.53 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.69 3d4s h PHE 133 CO 0.11 0.08 -0.63 0.00 -0.60 0.00 0.00 178.31 177.27 3d4s h ALA 134 N 1.92 0.08 0.00 2.45 0.00 -1.38 -3.21 119.26 119.12 3d4s h ALA 134 Ca -0.00 -0.58 -0.12 0.00 0.00 0.00 0.00 54.91 54.21 3d4s h ALA 134 Cb 0.52 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 3d4s h ALA 134 CO 0.01 0.37 -0.61 0.97 0.00 0.00 0.00 179.25 180.00 3d4s h ILE 135 N -0.07 0.88 0.00 0.00 2.10 -1.37 -3.22 117.51 115.82 3d4s h ILE 135 Ca -0.08 -2.26 -0.08 0.00 1.08 0.00 0.00 64.86 63.52 3d4s h ILE 135 Cb 1.34 2.41 -0.01 0.00 -1.09 0.00 0.00 36.82 39.47 3d4s h ILE 135 CO 0.12 0.50 -0.38 0.71 -1.08 0.00 0.00 178.15 178.02 3d4s h THR 136 N 0.00 0.74 -3.87 2.19 1.35 -1.52 -3.45 112.91 108.34 3d4s h THR 136 Ca -0.02 -1.74 -0.49 0.00 -0.55 0.00 0.00 66.41 63.61 3d4s h THR 136 Cb 1.42 2.14 0.03 0.00 -1.73 0.00 0.00 68.15 70.01 3d4s h THR 136 CO 0.07 0.37 0.22 -0.94 -0.25 0.00 0.00 175.52 174.99 3d4s s SER 137 N -6.37 6.37 0.55 5.36 1.04 -1.21 -4.98 113.70 114.46 3d4s s SER 137 Ca 0.03 1.18 0.22 0.00 0.48 0.00 0.00 55.95 57.86 3d4s s SER 137 Cb 0.09 -2.35 1.50 0.00 0.10 0.00 0.00 66.02 65.35 3d4s s SER 137 CO 0.70 -0.60 2.19 1.55 0.98 0.00 0.00 173.24 178.07 3d4s h PRO 138 N 0.48 0.00 -4.68 4.02 0.13 -1.87 -3.18 132.00 126.89 3d4s h PRO 138 Ca -0.46 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 63.98 3d4s h PRO 138 Cb 1.19 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.28 3d4s h PRO 138 CO 0.62 0.00 2.73 1.19 -0.23 0.00 0.00 178.00 182.32 3d4s n PHE 139 N -4.24 3.80 -2.05 1.56 3.72 -1.26 -4.93 117.46 114.04 3d4s n PHE 139 Ca -0.03 -2.82 -0.41 0.00 -0.05 0.00 0.00 57.45 54.13 3d4s n PHE 139 Cb 0.09 -2.54 -0.03 0.00 -0.94 0.00 0.00 39.48 36.06 3d4s n PHE 139 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 3d4s s LYS 140 N 3.73 4.29 0.00 -1.08 2.20 -1.20 -2.43 119.74 125.25 3d4s s LYS 140 Ca 0.50 2.25 0.00 0.00 -0.36 0.00 0.00 55.97 58.36 3d4s s LYS 140 Cb 0.10 -3.14 0.00 0.00 -1.51 0.00 0.00 37.83 33.29 3d4s s LYS 140 CO -0.02 -0.40 0.00 0.66 -0.36 0.00 0.00 175.35 175.23 3d4s n TYR 141 N 2.63 0.00 -4.30 4.03 4.01 -1.22 -4.97 117.16 117.33 3d4s n TYR 141 Ca 0.08 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.48 3d4s n TYR 141 Cb 0.41 -0.58 -0.12 0.00 -0.31 0.00 0.00 39.34 38.74 3d4s n TYR 141 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 3d4s s GLN 142 N -0.44 3.70 0.30 -0.72 -0.21 -1.02 -5.00 119.66 116.27 3d4s s GLN 142 Ca 0.00 -0.50 -0.29 0.00 0.02 0.00 0.00 55.36 54.59 3d4s s GLN 142 Cb 0.00 -2.97 -0.10 0.00 1.00 0.00 0.00 33.01 30.94 3d4s s GLN 142 CO 0.00 0.21 1.27 0.45 -2.12 0.00 0.00 175.29 175.11 3d4s s SER 143 N 0.46 6.88 0.41 5.90 0.15 -1.26 -4.50 113.70 121.74 3d4s s SER 143 Ca -0.02 2.57 0.22 0.00 0.70 0.00 0.00 55.95 59.42 3d4s s SER 143 Cb -0.14 -2.64 0.50 0.00 -1.71 0.00 0.00 66.02 62.03 3d4s s SER 143 CO 0.02 -0.47 1.65 -0.07 1.20 0.00 0.00 173.24 175.58 3d4s h LEU 144 N 3.80 0.00 -9.86 3.45 3.38 -1.88 -3.45 115.31 110.76 3d4s h LEU 144 Ca -0.48 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.01 3d4s h LEU 144 Cb 1.22 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.97 3d4s h LEU 144 CO 0.68 0.17 0.38 -0.76 0.09 0.00 0.00 178.44 179.00 3d4s s LEU 145 N -6.37 4.41 0.63 1.67 1.43 -1.26 -5.07 118.68 114.12 3d4s s LEU 145 Ca 0.04 1.98 -0.05 0.00 -1.03 0.00 0.00 54.13 55.07 3d4s s LEU 145 Cb 0.07 -3.89 0.03 0.00 0.03 0.00 0.00 46.19 42.43 3d4s s LEU 145 CO 0.67 -0.11 0.93 0.42 0.23 0.00 0.00 176.35 178.49 3d4s s THR 146 N -1.45 2.96 0.16 5.49 -4.23 -1.26 -4.89 115.64 112.42 3d4s s THR 146 Ca 0.49 -0.20 -0.14 0.00 -1.18 0.00 0.00 61.69 60.66 3d4s s THR 146 Cb -0.23 -3.21 0.04 0.00 1.34 0.00 0.00 72.50 70.44 3d4s s THR 146 CO 0.29 -0.21 1.71 0.11 -0.54 0.00 0.00 174.62 175.98 3d4s h LYS 147 N -0.32 0.76 0.00 3.99 1.57 -1.99 -0.16 116.57 120.43 3d4s h LYS 147 Ca -0.45 -0.14 -0.05 0.00 -1.87 0.00 0.00 60.65 58.15 3d4s h LYS 147 Cb 1.29 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.47 3d4s h LYS 147 CO 0.60 0.67 -0.23 -0.91 -0.57 0.00 0.00 179.45 179.01 3d4s h ASN 148 N 0.69 0.00 0.41 0.86 2.35 -2.00 -2.53 115.58 115.35 3d4s h ASN 148 Ca 0.17 0.00 -0.31 0.00 -0.55 0.00 0.00 56.30 55.61 3d4s h ASN 148 Cb 0.19 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.57 3d4s h ASN 148 CO -0.01 0.23 -1.51 0.50 -1.65 0.00 0.00 177.43 174.99 3d4s h LYS 149 N 0.00 0.33 -0.59 0.81 1.63 -1.88 -3.26 116.57 113.61 3d4s h LYS 149 Ca -0.00 -0.57 -0.01 0.00 -0.85 0.00 0.00 60.65 59.21 3d4s h LYS 149 Cb 0.52 0.21 -0.03 0.00 -0.60 0.00 0.00 32.23 32.33 3d4s h LYS 149 CO 0.03 1.23 0.32 0.00 -3.45 0.00 0.00 179.45 177.58 3d4s h ALA 150 N 0.38 1.44 -0.17 5.00 0.00 -0.84 -2.14 119.26 122.93 3d4s h ALA 150 Ca -0.24 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.47 3d4s h ALA 150 Cb 2.05 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.59 3d4s h ALA 150 CO 0.19 0.46 -0.33 0.00 0.00 0.00 0.00 179.25 179.57 3d4s h ARG 151 N 0.83 0.35 -0.40 0.00 3.08 -1.56 -2.52 114.38 114.17 3d4s h ARG 151 Ca 0.21 -0.15 -0.16 0.00 0.07 0.00 0.00 59.98 59.96 3d4s h ARG 151 Cb 0.03 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 3d4s h ARG 151 CO -0.03 0.64 -0.36 0.28 -1.07 0.00 0.00 179.97 179.43 3d4s h VAL 152 N 0.30 1.27 0.39 2.04 2.07 -1.46 -0.69 116.25 120.18 3d4s h VAL 152 Ca 0.04 -1.54 -0.01 0.00 0.82 0.00 0.00 66.70 66.01 3d4s h VAL 152 Cb 0.73 1.35 -0.01 0.00 -1.52 0.00 0.00 31.29 31.84 3d4s h VAL 152 CO 0.06 0.52 -0.25 0.40 0.02 0.00 0.00 177.57 178.31 3d4s h ILE 153 N 0.78 0.47 -0.32 4.57 1.08 -1.28 -0.83 117.51 121.99 3d4s h ILE 153 Ca 0.07 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.60 3d4s h ILE 153 Cb 0.96 0.47 -0.06 0.00 -3.07 0.00 0.00 36.82 35.12 3d4s h ILE 153 CO 0.09 0.00 -0.10 0.40 -0.69 0.00 0.00 178.15 177.85 3d4s h ILE 154 N -0.62 0.63 -0.55 -0.67 2.04 -1.43 -0.07 117.51 116.84 3d4s h ILE 154 Ca -0.04 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.89 3d4s h ILE 154 Cb 0.52 0.63 -0.06 0.00 -0.74 0.00 0.00 36.82 37.17 3d4s h ILE 154 CO 0.03 0.00 0.23 0.25 0.00 0.00 0.00 178.15 178.66 3d4s h LEU 155 N -0.04 0.27 -0.83 1.44 5.85 -0.90 -1.81 115.31 119.29 3d4s h LEU 155 Ca 0.16 0.06 -0.12 0.00 0.84 0.00 0.00 57.88 58.81 3d4s h LEU 155 Cb 0.27 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 3d4s h LEU 155 CO -0.35 0.18 -0.51 0.24 -0.34 0.00 0.00 178.44 177.67 3d4s h MET 156 N 0.43 0.20 0.00 1.25 2.86 -0.71 -1.10 114.93 117.85 3d4s h MET 156 Ca 0.26 -0.11 -0.05 0.00 -2.06 0.00 0.00 59.70 57.74 3d4s h MET 156 Cb 0.26 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.92 3d4s h MET 156 CO -0.24 0.66 -0.25 0.28 1.06 0.00 0.00 176.91 178.42 3d4s h VAL 157 N 0.16 1.10 0.02 -2.22 2.07 -0.29 -0.26 116.25 116.84 3d4s h VAL 157 Ca 0.00 -0.87 -0.28 0.00 0.82 0.00 0.00 66.70 66.37 3d4s h VAL 157 Cb 0.95 1.48 -0.04 0.00 -1.52 0.00 0.00 31.29 32.16 3d4s h VAL 157 CO 0.08 0.24 -1.58 -0.50 0.02 0.00 0.00 177.57 175.83 3d4s h TRP 158 N 0.00 0.08 0.04 1.57 4.06 -1.11 -3.03 115.95 117.57 3d4s h TRP 158 Ca -0.00 -0.06 -0.00 0.00 2.06 0.00 0.00 58.89 60.89 3d4s h TRP 158 Cb 0.46 -0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.62 3d4s h TRP 158 CO 0.00 1.10 -0.02 0.82 -3.56 0.00 0.00 178.44 176.78 3d4s h ILE 159 N 0.01 1.31 -0.50 1.49 2.04 -0.98 -0.32 117.51 120.57 3d4s h ILE 159 Ca -0.24 -1.25 -0.05 0.00 1.00 0.00 0.00 64.86 64.32 3d4s h ILE 159 Cb 1.97 2.13 -0.02 0.00 -0.74 0.00 0.00 36.82 40.16 3d4s h ILE 159 CO 0.10 0.31 0.13 0.58 0.00 0.00 0.00 178.15 179.27 3d4s h VAL 160 N -0.62 1.24 0.00 1.67 2.07 -1.23 -1.25 116.25 118.12 3d4s h VAL 160 Ca -0.01 -0.82 -0.06 0.00 0.82 0.00 0.00 66.70 66.64 3d4s h VAL 160 Cb 0.55 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 3d4s h VAL 160 CO 0.01 0.30 -0.28 0.28 0.02 0.00 0.00 177.57 177.90 3d4s h SER 161 N 0.68 0.00 0.02 0.57 0.02 -1.61 -0.81 113.55 112.42 3d4s h SER 161 Ca 0.16 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.11 3d4s h SER 161 Cb 0.31 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.85 3d4s h SER 161 CO -0.00 0.28 -0.01 1.23 -1.14 0.00 0.00 176.83 177.19 3d4s h GLY 162 N 1.23 -0.03 0.88 -3.77 0.00 -0.49 -1.94 103.07 98.95 3d4s h GLY 162 Ca -0.00 0.01 -0.02 0.00 0.00 0.00 0.00 47.33 47.32 3d4s h GLY 162 CO 0.04 -0.01 0.07 1.41 0.00 0.00 0.00 176.54 178.05 3d4s h LEU 163 N -0.35 0.31 -0.87 3.11 4.07 -1.01 -0.79 115.31 119.79 3d4s h LEU 163 Ca -0.00 -0.20 0.00 0.00 0.08 0.00 0.00 57.88 57.76 3d4s h LEU 163 Cb 0.33 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 41.99 3d4s h LEU 163 CO 0.00 0.43 0.00 0.71 -1.08 0.00 0.00 178.44 178.50 3d4s h THR 164 N 0.18 0.00 0.00 0.22 1.35 -1.19 -2.79 112.91 110.68 3d4s h THR 164 Ca 0.07 -0.33 -0.15 0.00 -0.55 0.00 0.00 66.41 65.45 3d4s h THR 164 Cb 0.22 1.15 -0.02 0.00 -1.73 0.00 0.00 68.15 67.77 3d4s h THR 164 CO -0.00 0.00 -1.47 -1.20 -0.25 0.00 0.00 175.52 172.60 3d4s n SER 165 N -2.48 1.94 0.32 5.36 7.64 -0.73 -4.58 113.62 121.08 3d4s n SER 165 Ca 0.02 0.34 -0.14 0.00 1.01 0.00 0.00 58.87 60.10 3d4s n SER 165 Cb 0.26 -0.77 -0.07 0.00 -1.01 0.00 0.00 64.21 62.62 3d4s n SER 165 CO 0.00 0.00 0.00 -0.26 -3.01 0.00 0.00 175.04 171.77 3d4s h PHE 166 N -1.00 -0.78 -0.56 1.43 0.04 -1.27 -3.33 116.94 111.48 3d4s h PHE 166 Ca -0.22 -0.02 0.11 0.00 2.80 0.00 0.00 57.97 60.64 3d4s h PHE 166 Cb 1.18 0.26 -0.11 0.00 2.20 0.00 0.00 35.95 39.48 3d4s h PHE 166 CO -0.31 -0.45 -0.24 1.25 -0.60 0.00 0.00 178.31 177.96 3d4s h LEU 167 N -1.16 -0.83 -1.51 1.54 5.85 -1.63 0.21 115.31 117.79 3d4s h LEU 167 Ca -0.09 0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.83 3d4s h LEU 167 Cb 0.68 0.46 0.00 0.00 0.37 0.00 0.00 40.66 42.16 3d4s h LEU 167 CO 0.14 -0.26 0.00 -0.65 -0.34 0.00 0.00 178.44 177.33 3d4s h PRO 168 N -0.10 0.00 0.07 5.25 0.11 -1.73 -0.16 132.00 135.44 3d4s h PRO 168 Ca 0.25 0.00 -0.35 0.00 0.11 0.00 0.00 66.00 66.02 3d4s h PRO 168 Cb 0.50 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.58 3d4s h PRO 168 CO -0.62 0.00 -1.94 -0.89 -0.21 0.00 0.00 178.00 174.34 3d4s n ILE 169 N -2.56 1.67 0.15 4.15 5.41 -0.21 -1.74 119.36 126.24 3d4s n ILE 169 Ca -0.00 -0.49 0.01 0.00 1.00 0.00 0.00 62.75 63.27 3d4s n ILE 169 Cb 0.15 -1.77 0.22 0.00 -0.71 0.00 0.00 39.64 37.53 3d4s n ILE 169 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 3d4s h GLN 170 N -0.25 0.00 -0.57 0.38 1.08 -0.50 -3.13 115.11 112.13 3d4s h GLN 170 Ca -0.45 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.75 3d4s h GLN 170 Cb 1.83 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.26 3d4s h GLN 170 CO -0.04 0.54 0.00 -1.33 -0.95 0.00 0.00 178.83 177.06 3d4s n MET 171 N -3.76 2.31 -2.18 1.46 2.81 -0.09 -4.97 117.12 112.71 3d4s n MET 171 Ca -0.01 -2.04 -0.20 0.00 -1.81 0.00 0.00 57.70 53.64 3d4s n MET 171 Cb 0.58 -1.44 -0.03 0.00 -0.71 0.00 0.00 33.22 31.61 3d4s n MET 171 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 3d4s n HIS 172 N 1.16 -0.77 0.37 2.03 8.25 -1.18 -4.89 115.22 120.20 3d4s n HIS 172 Ca 0.19 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.78 3d4s n HIS 172 Cb 0.48 -3.74 0.28 0.00 1.12 0.00 0.00 29.99 28.13 3d4s n HIS 172 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 3d4s h TRP 173 N 0.00 0.00 0.04 4.41 6.55 -1.63 -3.26 115.95 122.07 3d4s h TRP 173 Ca -0.46 0.00 -0.25 0.00 0.95 0.00 0.00 58.89 59.13 3d4s h TRP 173 Cb 1.34 0.00 0.01 0.00 -0.86 0.00 0.00 29.16 29.65 3d4s h TRP 173 CO 0.57 0.00 -1.05 0.10 -1.05 0.00 0.00 178.44 177.01 3d4s h TYR 174 N 0.00 0.71 -2.01 0.49 -0.00 -1.81 -3.45 116.97 110.91 3d4s h TYR 174 Ca 0.00 -0.42 -0.63 0.00 0.00 0.00 0.00 58.73 57.68 3d4s h TYR 174 Cb 0.88 -0.07 0.10 0.00 0.00 0.00 0.00 36.73 37.64 3d4s h TYR 174 CO 0.00 1.26 0.04 0.54 -0.00 0.00 0.00 178.16 180.00 3d4s n ARG 175 N -3.73 1.01 -2.57 0.10 1.74 -1.23 0.40 116.66 112.38 3d4s n ARG 175 Ca -0.09 0.36 -0.29 0.00 -0.77 0.00 0.00 57.85 57.06 3d4s n ARG 175 Cb 0.90 -1.69 -0.01 0.00 -1.02 0.00 0.00 32.46 30.64 3d4s n ARG 175 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3d4s s ALA 176 N -0.78 3.33 -1.67 7.54 0.00 -1.26 -4.14 121.76 124.78 3d4s s ALA 176 Ca 0.64 -0.34 0.21 0.00 0.00 0.00 0.00 51.96 52.48 3d4s s ALA 176 Cb -0.80 -2.71 -0.07 0.00 0.00 0.00 0.00 23.12 19.54 3d4s s ALA 176 CO 0.57 -0.31 0.99 0.25 0.00 0.00 0.00 175.76 177.27 3d4s n THR 177 N -2.06 0.00 -1.56 0.00 -2.24 -1.26 -4.66 114.28 102.51 3d4s n THR 177 Ca 0.02 -0.20 -0.31 0.00 -2.27 0.00 0.00 64.05 61.29 3d4s n THR 177 Cb 0.55 1.18 0.07 0.00 -2.10 0.00 0.00 70.33 70.02 3d4s n THR 177 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 3d4s s HIS 178 N -2.53 2.99 0.13 4.78 -3.43 -1.26 -4.91 115.29 111.06 3d4s s HIS 178 Ca 0.15 1.31 -0.18 0.00 -0.80 0.00 0.00 55.06 55.54 3d4s s HIS 178 Cb 0.17 -2.98 -0.03 0.00 -1.43 0.00 0.00 32.58 28.30 3d4s s HIS 178 CO 0.63 -1.47 1.74 0.37 -2.00 0.00 0.00 174.74 174.01 3d4s h GLN 179 N -0.88 0.42 -0.74 -0.38 5.75 -2.00 -2.87 115.11 114.41 3d4s h GLN 179 Ca -0.45 -0.04 0.10 0.00 -0.15 0.00 0.00 58.65 58.11 3d4s h GLN 179 Cb 1.23 -0.09 -0.05 0.00 1.07 0.00 0.00 27.48 29.65 3d4s h GLN 179 CO 0.58 0.35 0.49 1.49 -2.65 0.00 0.00 178.83 179.08 3d4s h GLU 180 N 0.39 0.60 0.01 1.69 4.81 -2.00 -2.21 114.58 117.87 3d4s h GLU 180 Ca 0.11 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 3d4s h GLU 180 Cb 0.04 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.28 3d4s h GLU 180 CO -0.02 0.40 -0.01 0.00 -0.73 0.00 0.00 179.01 178.65 3d4s h ALA 181 N 1.63 -0.02 -0.40 2.92 0.00 -1.90 -3.17 119.26 118.32 3d4s h ALA 181 Ca 0.34 -0.28 0.05 0.00 0.00 0.00 0.00 54.91 55.02 3d4s h ALA 181 Cb 0.51 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 3d4s h ALA 181 CO -0.12 -0.22 0.27 0.82 0.00 0.00 0.00 179.25 180.00 3d4s h ILE 182 N -0.59 0.99 -0.32 0.00 2.04 -1.27 -0.92 117.51 117.43 3d4s h ILE 182 Ca -0.00 -0.12 -0.09 0.00 1.00 0.00 0.00 64.86 65.64 3d4s h ILE 182 Cb 0.57 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 37.23 3d4s h ILE 182 CO 0.00 0.07 -0.18 0.78 0.00 0.00 0.00 178.15 178.82 3d4s h ASN 183 N 0.36 0.58 0.48 1.72 2.35 -1.47 -2.65 115.58 116.95 3d4s h ASN 183 Ca 0.17 -0.18 -0.20 0.00 -0.55 0.00 0.00 56.30 55.54 3d4s h ASN 183 Cb 0.23 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.44 3d4s h ASN 183 CO -0.04 0.77 -0.87 0.00 -1.65 0.00 0.00 177.43 175.65 3d4s h TYR 185 N 0.16 0.84 -0.23 0.00 0.05 -1.34 -3.23 116.97 113.21 3d4s h TYR 185 Ca -0.05 -0.29 -0.19 0.00 0.05 0.00 0.00 58.73 58.24 3d4s h TYR 185 Cb 1.48 -0.16 0.00 0.00 1.01 0.00 0.00 36.73 39.07 3d4s h TYR 185 CO 0.04 1.06 -0.62 0.00 -1.05 0.00 0.00 178.16 177.59 3d4s h ALA 186 N 0.88 0.46 -2.30 3.88 0.00 -1.53 -3.43 119.26 117.22 3d4s h ALA 186 Ca 0.01 -0.54 -0.55 0.00 0.00 0.00 0.00 54.91 53.83 3d4s h ALA 186 Cb 1.10 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 3d4s h ALA 186 CO 0.11 0.69 0.67 -2.00 0.00 0.00 0.00 179.25 178.71 3d4s s GLU 187 N -3.99 4.37 0.27 0.00 2.56 -0.96 -4.95 118.70 116.00 3d4s s GLU 187 Ca -0.10 1.60 0.02 0.00 0.00 0.00 0.00 54.97 56.49 3d4s s GLU 187 Cb 0.10 -3.56 0.38 0.00 2.00 0.00 0.00 34.13 33.05 3d4s s GLU 187 CO 0.89 -0.42 1.71 0.93 -0.56 0.00 0.00 175.26 177.81 3d4s h GLU 188 N 7.38 0.52 0.00 4.30 5.08 -1.84 -3.07 114.58 126.93 3d4s h GLU 188 Ca -0.33 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 57.83 3d4s h GLU 188 Cb 1.16 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.38 3d4s h GLU 188 CO 0.88 0.73 0.00 0.25 -1.00 0.00 0.00 179.01 179.86 3d4s n THR 189 N -4.12 0.00 -4.98 1.13 -2.24 -1.25 -4.47 114.28 98.35 3d4s n THR 189 Ca -0.00 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.45 3d4s n THR 189 Cb 0.41 -0.41 -0.16 0.00 -2.10 0.00 0.00 70.33 68.07 3d4s n THR 189 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d4s s ASP 192 N -3.68 7.45 -1.15 0.00 1.01 -1.26 -4.96 116.67 114.08 3d4s s ASP 192 Ca 0.28 1.80 -0.17 0.00 0.71 0.00 0.00 52.55 55.17 3d4s s ASP 192 Cb 0.35 -2.59 0.12 0.00 1.01 0.00 0.00 42.92 41.81 3d4s s ASP 192 CO -0.02 -0.12 1.45 0.12 0.21 0.00 0.00 175.17 176.81 3d4s s PHE 193 N 0.15 3.10 -0.08 4.23 5.36 -1.26 -4.97 117.98 124.52 3d4s s PHE 193 Ca 0.48 -1.67 -0.23 0.00 -0.96 0.00 0.00 56.93 54.55 3d4s s PHE 193 Cb -0.24 -4.47 -0.04 0.00 -0.34 0.00 0.00 43.02 37.93 3d4s s PHE 193 CO 0.30 -1.60 0.68 -0.06 -1.46 0.00 0.00 175.22 173.08 3d4s s PHE 194 N 2.95 3.56 0.15 10.12 0.08 -1.26 -5.07 117.98 128.51 3d4s s PHE 194 Ca 0.44 1.20 0.05 0.00 0.12 0.00 0.00 56.93 58.73 3d4s s PHE 194 Cb -0.01 -2.78 -0.04 0.00 -0.57 0.00 0.00 43.02 39.61 3d4s s PHE 194 CO -0.01 0.08 -0.11 0.95 -0.10 0.00 0.00 175.22 176.03 3d4s s THR 195 N 0.86 1.21 0.56 0.64 -4.23 -1.26 -4.22 115.64 109.21 3d4s s THR 195 Ca 0.36 -2.01 -0.13 0.00 -1.18 0.00 0.00 61.69 58.73 3d4s s THR 195 Cb -0.17 -1.79 -0.06 0.00 1.34 0.00 0.00 72.50 71.82 3d4s s THR 195 CO 0.17 -0.69 0.98 0.54 -0.54 0.00 0.00 174.62 175.08 3d4s s ASN 196 N -3.05 6.40 0.44 3.99 2.20 0.16 -4.53 114.94 120.56 3d4s s ASN 196 Ca 0.15 1.43 0.11 0.00 -0.94 0.00 0.00 52.86 53.62 3d4s s ASN 196 Cb 0.01 -2.46 1.00 0.00 -2.00 0.00 0.00 41.25 37.80 3d4s s ASN 196 CO 0.01 -0.71 2.05 1.56 -2.94 0.00 0.00 177.10 177.07 3d4s h GLN 197 N 0.30 0.38 -0.15 3.55 4.20 -1.94 -2.58 115.11 118.86 3d4s h GLN 197 Ca -0.45 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.21 3d4s h GLN 197 Cb 1.19 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.88 3d4s h GLN 197 CO 0.62 0.25 -0.01 0.00 -0.67 0.00 0.00 178.83 179.02 3d4s h ALA 198 N 1.78 0.20 -0.06 3.87 0.00 -1.95 -3.01 119.26 120.10 3d4s h ALA 198 Ca 0.16 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 3d4s h ALA 198 Cb 0.15 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 3d4s h ALA 198 CO -0.04 -0.08 0.02 -0.92 0.00 0.00 0.00 179.25 178.23 3d4s h TYR 199 N 0.00 0.09 -0.72 0.00 3.20 -1.82 -1.08 116.97 116.63 3d4s h TYR 199 Ca 0.04 -0.01 0.17 0.00 3.14 0.00 0.00 58.73 62.07 3d4s h TYR 199 Cb 0.39 -0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.60 3d4s h TYR 199 CO 0.04 0.26 0.50 0.00 -1.64 0.00 0.00 178.16 177.31 3d4s h ALA 200 N 0.82 2.33 0.00 1.82 0.00 -1.52 0.82 119.26 123.52 3d4s h ALA 200 Ca 0.02 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 3d4s h ALA 200 Cb 0.21 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3d4s h ALA 200 CO -0.00 -0.53 -0.73 0.82 0.00 0.00 0.00 179.25 178.81 3d4s h ILE 201 N 0.24 0.58 -0.48 0.00 2.04 -1.46 -3.29 117.51 115.14 3d4s h ILE 201 Ca 0.35 -1.64 0.07 0.00 1.00 0.00 0.00 64.86 64.64 3d4s h ILE 201 Cb 1.04 1.30 -0.06 0.00 -0.74 0.00 0.00 36.82 38.36 3d4s h ILE 201 CO -0.08 0.20 0.15 0.00 0.00 0.00 0.00 178.15 178.42 3d4s h ALA 202 N -0.68 0.57 -0.28 1.87 0.00 -1.04 -1.77 119.26 117.94 3d4s h ALA 202 Ca -0.15 0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 3d4s h ALA 202 Cb 0.85 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 3d4s h ALA 202 CO -0.09 -0.24 -0.04 1.03 0.00 0.00 0.00 179.25 179.91 3d4s h SER 203 N 0.32 0.52 -0.88 0.00 0.87 -1.06 -2.24 113.55 111.08 3d4s h SER 203 Ca 0.23 -0.34 0.04 0.00 -1.23 0.00 0.00 61.79 60.49 3d4s h SER 203 Cb 0.25 -0.14 -0.05 0.00 -0.44 0.00 0.00 62.40 62.02 3d4s h SER 203 CO -0.25 0.74 0.56 0.28 -0.53 0.00 0.00 176.83 177.63 3d4s h SER 204 N 0.29 0.92 0.19 6.23 0.02 -1.56 0.30 113.55 119.94 3d4s h SER 204 Ca 0.07 -0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.01 3d4s h SER 204 Cb 0.50 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.84 3d4s h SER 204 CO 0.02 0.63 -0.09 0.40 -1.14 0.00 0.00 176.83 176.65 3d4s h ILE 205 N 1.08 0.89 -0.33 3.27 2.04 -1.32 -0.15 117.51 123.00 3d4s h ILE 205 Ca 0.36 -0.92 -0.07 0.00 1.00 0.00 0.00 64.86 65.23 3d4s h ILE 205 Cb 0.04 1.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 3d4s h ILE 205 CO -0.13 0.19 -0.08 0.58 0.00 0.00 0.00 178.15 178.72 3d4s h VAL 206 N -0.74 1.28 0.13 1.67 2.07 -1.35 0.17 116.25 119.47 3d4s h VAL 206 Ca -0.03 -1.13 -0.27 0.00 0.82 0.00 0.00 66.70 66.09 3d4s h VAL 206 Cb 0.51 1.33 0.01 0.00 -1.52 0.00 0.00 31.29 31.62 3d4s h VAL 206 CO 0.04 0.37 -1.23 0.28 0.02 0.00 0.00 177.57 177.05 3d4s h SER 207 N 0.42 0.45 0.00 0.57 0.02 -0.54 -3.42 113.55 111.04 3d4s h SER 207 Ca 0.08 -0.47 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 3d4s h SER 207 Cb 0.57 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.97 3d4s h SER 207 CO 0.03 1.36 -0.55 0.33 -1.14 0.00 0.00 176.83 176.86 3d4s n PHE 208 N -3.55 -0.09 -0.17 3.45 7.35 -0.46 -4.64 117.46 119.35 3d4s n PHE 208 Ca -0.09 0.02 -0.09 0.00 -0.76 0.00 0.00 57.45 56.54 3d4s n PHE 208 Cb 1.01 0.05 0.01 0.00 0.35 0.00 0.00 39.48 40.90 3d4s n PHE 208 CO 0.00 0.00 0.00 1.88 -0.76 0.00 0.00 176.76 177.88 3d4s h TYR 209 N 0.00 0.76 0.55 -5.13 -1.99 -0.93 -2.05 116.97 108.18 3d4s h TYR 209 Ca 0.00 -0.07 -0.03 0.00 2.00 0.00 0.00 58.73 60.64 3d4s h TYR 209 Cb 0.55 -0.22 0.00 0.00 2.00 0.00 0.00 36.73 39.07 3d4s h TYR 209 CO 0.00 0.66 -0.27 0.28 -0.00 0.00 0.00 178.16 178.82 3d4s h VAL 210 N 0.65 0.44 0.00 -2.88 2.07 -0.93 -0.95 116.25 114.65 3d4s h VAL 210 Ca 0.16 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.66 3d4s h VAL 210 Cb 0.24 0.44 -0.00 0.00 -1.52 0.00 0.00 31.29 30.44 3d4s h VAL 210 CO -0.01 0.00 -0.10 1.55 0.02 0.00 0.00 177.57 179.03 3d4s h PRO 211 N -0.75 0.00 0.30 1.57 0.13 -1.80 -2.80 132.00 128.65 3d4s h PRO 211 Ca -0.07 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.04 3d4s h PRO 211 Cb 0.58 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.72 3d4s h PRO 211 CO 0.12 0.10 -0.14 1.25 -0.23 0.00 0.00 178.00 179.09 3d4s h LEU 212 N 0.00 -0.34 -0.69 1.56 5.85 -1.07 -1.55 115.31 119.07 3d4s h LEU 212 Ca -0.00 -0.20 0.06 0.00 0.84 0.00 0.00 57.88 58.58 3d4s h LEU 212 Cb 0.41 0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.48 3d4s h LEU 212 CO 0.01 0.09 0.39 0.58 -0.34 0.00 0.00 178.44 179.18 3d4s h VAL 213 N -0.86 0.99 -0.02 1.05 2.07 -1.17 -0.02 116.25 118.29 3d4s h VAL 213 Ca -0.04 -0.25 -0.00 0.00 0.82 0.00 0.00 66.70 67.23 3d4s h VAL 213 Cb 0.52 0.19 -0.00 0.00 -1.52 0.00 0.00 31.29 30.48 3d4s h VAL 213 CO 0.07 0.13 0.00 0.40 0.02 0.00 0.00 177.57 178.20 3d4s h ILE 214 N 0.73 1.19 -0.05 4.57 2.04 -1.58 -0.99 117.51 123.42 3d4s h ILE 214 Ca 0.31 -0.55 0.04 0.00 1.00 0.00 0.00 64.86 65.65 3d4s h ILE 214 Cb 0.17 1.53 -0.05 0.00 -0.74 0.00 0.00 36.82 37.73 3d4s h ILE 214 CO -0.17 0.15 -0.31 -0.03 0.00 0.00 0.00 178.15 177.78 3d4s h MET 215 N -0.20 -0.41 -0.75 2.37 4.05 -0.84 0.51 114.93 119.66 3d4s h MET 215 Ca 0.01 0.03 -0.00 0.00 -0.28 0.00 0.00 59.70 59.45 3d4s h MET 215 Cb 0.23 0.09 -0.04 0.00 -0.80 0.00 0.00 31.60 31.09 3d4s h MET 215 CO 0.00 -0.28 0.46 0.28 0.23 0.00 0.00 176.91 177.61 3d4s h VAL 216 N -0.43 1.20 -0.03 -5.77 2.07 -1.02 0.14 116.25 112.42 3d4s h VAL 216 Ca 0.08 -0.42 -0.05 0.00 0.82 0.00 0.00 66.70 67.12 3d4s h VAL 216 Cb 0.54 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 3d4s h VAL 216 CO -0.30 0.21 -0.19 0.15 0.02 0.00 0.00 177.57 177.47 3d4s h PHE 217 N 1.02 0.24 -0.39 1.57 3.57 -0.64 -2.95 116.94 119.36 3d4s h PHE 217 Ca 0.27 -0.11 -0.15 0.00 3.53 0.00 0.00 57.97 61.51 3d4s h PHE 217 Cb -0.07 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 3d4s h PHE 217 CO 0.00 0.84 -0.34 0.28 -2.23 0.00 0.00 178.31 176.86 3d4s h VAL 218 N -0.42 1.27 0.00 1.41 2.07 0.11 -3.16 116.25 117.53 3d4s h VAL 218 Ca -0.02 -1.51 0.00 0.00 0.82 0.00 0.00 66.70 66.00 3d4s h VAL 218 Cb 0.87 1.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.97 3d4s h VAL 218 CO 0.04 0.51 -0.12 0.00 0.02 0.00 0.00 177.57 178.01 3d4s n TYR 219 N -4.07 0.38 0.04 1.57 9.36 0.48 -2.76 117.16 122.16 3d4s n TYR 219 Ca -0.01 0.11 -0.13 0.00 3.32 0.00 0.00 57.90 61.19 3d4s n TYR 219 Cb 0.52 -0.64 -0.02 0.00 -0.63 0.00 0.00 39.34 38.56 3d4s n TYR 219 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 3d4s h SER 220 N 0.00 0.62 -0.46 2.98 4.64 -1.49 -2.99 113.55 116.84 3d4s h SER 220 Ca 0.00 -0.43 -0.05 0.00 -0.47 0.00 0.00 61.79 60.83 3d4s h SER 220 Cb 0.61 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.49 3d4s h SER 220 CO 0.00 1.21 0.11 0.03 -0.87 0.00 0.00 176.83 177.30 3d4s h ARG 221 N 0.32 0.81 -0.69 4.77 2.47 -1.51 -2.61 114.38 117.95 3d4s h ARG 221 Ca -0.06 -0.17 0.00 0.00 -1.26 0.00 0.00 59.98 58.50 3d4s h ARG 221 Cb 1.43 -0.12 -0.03 0.00 -1.65 0.00 0.00 29.97 29.60 3d4s h ARG 221 CO 0.15 0.74 0.44 0.28 0.56 0.00 0.00 179.97 182.15 3d4s h VAL 222 N 0.78 1.19 -0.07 2.04 2.07 -1.38 0.30 116.25 121.17 3d4s h VAL 222 Ca 0.17 -0.37 -0.08 0.00 0.82 0.00 0.00 66.70 67.24 3d4s h VAL 222 Cb 0.32 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 3d4s h VAL 222 CO 0.00 0.18 -0.33 -0.26 0.02 0.00 0.00 177.57 177.19 3d4s h PHE 223 N 0.94 0.15 0.04 1.57 -1.00 -1.39 -1.98 116.94 115.28 3d4s h PHE 223 Ca 0.25 -0.03 -0.24 0.00 2.81 0.00 0.00 57.97 60.76 3d4s h PHE 223 Cb -0.08 -0.04 0.00 0.00 3.61 0.00 0.00 35.95 39.45 3d4s h PHE 223 CO -0.02 0.45 -1.04 1.96 -1.61 0.00 0.00 178.31 178.05 3d4s h GLN 224 N 0.12 0.38 -0.13 1.51 4.20 -0.96 -2.67 115.11 117.56 3d4s h GLN 224 Ca 0.02 -0.47 -0.13 0.00 0.06 0.00 0.00 58.65 58.13 3d4s h GLN 224 Cb 0.64 0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.56 3d4s h GLN 224 CO 0.05 1.15 -0.47 0.93 -0.67 0.00 0.00 178.83 179.82 3d4s h GLU 225 N 0.19 0.33 -0.25 1.46 4.39 -0.30 -1.52 114.58 118.88 3d4s h GLU 225 Ca -0.10 -0.18 -0.05 0.00 0.34 0.00 0.00 59.36 59.36 3d4s h GLU 225 Cb 1.70 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 30.35 3d4s h GLU 225 CO 0.18 0.74 -0.05 0.00 -1.16 0.00 0.00 179.01 178.72 3d4s h ALA 226 N 1.24 0.34 0.00 3.43 0.00 -1.40 0.17 119.26 123.04 3d4s h ALA 226 Ca 0.02 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3d4s h ALA 226 Cb 0.93 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.63 3d4s h ALA 226 CO 0.08 0.13 0.00 -0.22 0.00 0.00 0.00 179.25 179.24 3d4s h LYS 227 N 0.22 0.00 0.00 0.00 3.64 -1.41 -3.21 116.57 115.81 3d4s h LYS 227 Ca 0.06 0.00 -0.24 0.00 -1.27 0.00 0.00 60.65 59.21 3d4s h LYS 227 Cb 0.51 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.29 3d4s h LYS 227 CO 0.02 0.00 -1.58 -2.13 -2.27 0.00 0.00 179.45 173.50 3d4s n ARG 228 N -2.82 0.55 0.06 1.90 0.63 -0.58 -4.58 116.66 111.82 3d4s n ARG 228 Ca 0.02 0.38 0.10 0.00 -0.92 0.00 0.00 57.85 57.42 3d4s n ARG 228 Cb 0.32 -1.58 0.41 0.00 0.45 0.00 0.00 32.46 32.06 3d4s n ARG 228 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 3d4s n GLN 229 N -4.40 0.10 -2.32 -0.14 6.02 0.03 -4.78 117.38 111.89 3d4s n GLN 229 Ca -0.33 0.31 -0.42 0.00 -0.01 0.00 0.00 57.00 56.55 3d4s n GLN 229 Cb 0.66 -1.68 -0.03 0.00 1.02 0.00 0.00 30.24 30.21 3d4s n GLN 229 CO 0.00 0.00 0.00 -0.48 -1.01 0.00 0.00 177.06 175.57 3d4s s LEU 230 N -3.73 4.34 0.00 1.08 2.34 -1.21 -5.01 118.68 116.50 3d4s s LEU 230 Ca 0.06 2.09 0.00 0.00 0.06 0.00 0.00 54.13 56.34 3d4s s LEU 230 Cb 0.10 -3.57 0.00 0.00 -0.56 0.00 0.00 46.19 42.16 3d4s s LEU 230 CO 0.35 -0.59 0.00 -0.46 -1.06 0.00 0.00 176.35 174.59 3d4s n ASN 1002N 4.46 1.22 0.24 1.48 0.23 -1.26 -4.99 115.26 116.64 3d4s n ASN 1002Ca 0.11 -0.15 0.14 0.00 -0.53 0.00 0.00 54.58 54.15 3d4s n ASN 1002Cb 0.45 0.00 0.41 0.00 -2.08 0.00 0.00 39.78 38.55 3d4s n ASN 1002CO 0.00 0.00 0.00 -0.29 -0.93 0.00 0.00 177.26 176.04 3d4s h ILE 1003N 0.09 0.00 -0.03 1.53 2.10 -1.94 -2.06 117.51 117.20 3d4s h ILE 1003Ca 0.00 -0.76 -0.10 0.00 1.08 0.00 0.00 64.86 65.09 3d4s h ILE 1003Cb 0.00 1.75 -0.01 0.00 -1.09 0.00 0.00 36.82 37.47 3d4s h ILE 1003CO 0.00 0.00 -0.44 -0.26 -1.08 0.00 0.00 178.15 176.37 3d4s h PHE 1004N 0.00 0.07 0.09 2.19 0.04 -1.99 -1.08 116.94 116.26 3d4s h PHE 1004Ca 0.00 -0.02 -0.35 0.00 2.80 0.00 0.00 57.97 60.40 3d4s h PHE 1004Cb 0.77 -0.01 -0.03 0.00 2.20 0.00 0.00 35.95 38.88 3d4s h PHE 1004CO 0.00 0.49 -1.94 0.39 -0.60 0.00 0.00 178.31 176.65 3d4s n GLU 1005N -4.01 0.73 0.00 1.51 1.02 -1.18 -3.28 120.64 115.42 3d4s n GLU 1005Ca -0.02 0.27 -0.09 0.00 -0.02 0.00 0.00 57.16 57.30 3d4s n GLU 1005Cb 0.47 -1.73 -0.03 0.00 -0.02 0.00 0.00 31.44 30.13 3d4s n GLU 1005CO 0.00 0.00 0.00 1.98 1.18 0.00 0.00 177.13 180.29 3d4s h MET 1006N 0.05 -0.16 -0.32 3.49 4.05 -1.23 -0.13 114.93 120.69 3d4s h MET 1006Ca -0.39 0.01 -0.14 0.00 -0.28 0.00 0.00 59.70 58.90 3d4s h MET 1006Cb 2.03 0.04 -0.00 0.00 -0.80 0.00 0.00 31.60 32.86 3d4s h MET 1006CO 0.08 -0.10 -0.34 -0.07 0.23 0.00 0.00 176.91 176.71 3d4s h LEU 1007N -0.16 0.84 -0.63 3.39 3.38 -1.40 -2.94 115.31 117.79 3d4s h LEU 1007Ca 0.09 -0.48 0.08 0.00 0.09 0.00 0.00 57.88 57.66 3d4s h LEU 1007Cb 0.29 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 40.73 3d4s h LEU 1007CO -0.21 1.15 0.29 -0.09 0.09 0.00 0.00 178.44 179.67 3d4s h ARG 1008N 0.56 0.50 0.26 1.13 1.12 -1.47 0.00 114.38 116.47 3d4s h ARG 1008Ca 0.05 -0.03 -0.01 0.00 -1.11 0.00 0.00 59.98 58.88 3d4s h ARG 1008Cb 0.92 -0.11 0.00 0.00 -0.01 0.00 0.00 29.97 30.77 3d4s h ARG 1008CO 0.08 0.33 -0.14 0.82 -3.11 0.00 0.00 179.97 177.95 3d4s h ILE 1009N 0.52 0.00 0.00 1.20 2.04 -0.99 -0.99 117.51 119.29 3d4s h ILE 1009Ca 0.31 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.17 3d4s h ILE 1009Cb 0.31 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.39 3d4s h ILE 1009CO -0.25 0.00 0.00 -0.90 0.00 0.00 0.00 178.15 177.00 3d4s n ASP 1010N -3.10 0.00 -0.08 1.72 3.85 -1.12 -3.12 116.55 114.70 3d4s n ASP 1010Ca -0.05 -0.11 -0.07 0.00 -0.71 0.00 0.00 54.79 53.86 3d4s n ASP 1010Cb 0.15 -0.26 -0.13 0.00 -1.35 0.00 0.00 41.12 39.53 3d4s n ASP 1010CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.20 177.40 3d4s n GLU 1011N -1.26 1.39 -0.18 0.11 4.07 -0.02 -4.99 120.64 119.75 3d4s n GLU 1011Ca 0.12 -0.01 0.02 0.00 -0.06 0.00 0.00 57.16 57.23 3d4s n GLU 1011Cb 0.18 -1.41 -0.01 0.00 -0.06 0.00 0.00 31.44 30.15 3d4s n GLU 1011CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3d4s n GLY 1012N 2.01 -2.21 2.99 8.31 0.00 -0.38 -4.46 105.19 111.46 3d4s n GLY 1012Ca -0.25 -1.48 -0.13 0.00 0.00 0.00 0.00 46.02 44.15 3d4s n GLY 1012CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3d4s s LEU 1013N 0.00 0.21 -0.04 0.99 0.20 -1.26 -4.23 118.68 114.55 3d4s s LEU 1013Ca 0.00 0.48 0.01 0.00 0.69 0.00 0.00 54.13 55.31 3d4s s LEU 1013Cb 0.00 0.60 0.02 0.00 -0.43 0.00 0.00 46.19 46.38 3d4s s LEU 1013CO 0.00 -0.19 -0.03 -0.13 -0.29 0.00 0.00 176.35 175.70 3d4s s ARG 1014N 1.70 0.67 0.16 1.98 0.52 -0.99 -5.02 118.95 117.97 3d4s s ARG 1014Ca -0.05 -0.05 0.27 0.00 -0.52 0.00 0.00 55.73 55.37 3d4s s ARG 1014Cb -0.11 -0.73 0.87 0.00 0.52 0.00 0.00 34.95 35.50 3d4s s ARG 1014CO -0.08 -0.09 1.78 1.28 0.02 0.00 0.00 175.30 178.21 3d4s n LEU 1015N 4.06 0.65 -4.61 2.53 4.77 -1.26 -1.19 117.00 121.94 3d4s n LEU 1015Ca -0.26 0.54 -0.25 0.00 -0.03 0.00 0.00 56.01 56.02 3d4s n LEU 1015Cb 0.51 -0.35 -0.08 0.00 -2.33 0.00 0.00 43.42 41.17 3d4s n LEU 1015CO 0.23 -0.14 -0.36 -0.54 -1.33 0.00 0.00 177.39 175.25 3d4s s LYS 1016N -3.08 2.20 0.03 3.23 1.02 -1.26 -1.83 119.74 120.05 3d4s s LYS 1016Ca 0.11 -1.36 -0.30 0.00 0.02 0.00 0.00 55.97 54.44 3d4s s LYS 1016Cb 0.14 -2.16 -0.07 0.00 -0.52 0.00 0.00 37.83 35.22 3d4s s LYS 1016CO 0.59 0.39 1.57 0.42 -0.92 0.00 0.00 175.35 177.41 3d4s s ILE 1017N -2.08 3.32 0.28 2.17 1.01 -1.13 -4.67 121.20 120.09 3d4s s ILE 1017Ca 0.29 0.71 0.03 0.00 0.00 0.00 0.00 60.65 61.68 3d4s s ILE 1017Cb -0.07 -3.46 -0.06 0.00 0.01 0.00 0.00 42.46 38.88 3d4s s ILE 1017CO 0.18 -0.01 0.04 -0.72 0.00 0.00 0.00 174.94 174.43 3d4s s TYR 1018N 2.72 1.75 -0.18 3.97 -0.85 -0.28 -4.98 117.35 119.51 3d4s s TYR 1018Ca 0.71 -0.99 -0.07 0.00 -0.52 0.00 0.00 57.07 56.20 3d4s s TYR 1018Cb -0.36 -1.08 -0.04 0.00 0.38 0.00 0.00 41.96 40.86 3d4s s TYR 1018CO 0.30 -0.07 0.06 0.15 -1.52 0.00 0.00 175.55 174.47 3d4s s LYS 1019N -3.91 3.96 0.00 -3.49 1.02 -1.26 -0.19 119.74 115.87 3d4s s LYS 1019Ca 0.34 -0.35 0.00 0.00 0.02 0.00 0.00 55.97 55.98 3d4s s LYS 1019Cb 0.07 -3.20 0.00 0.00 -0.52 0.00 0.00 37.83 34.18 3d4s s LYS 1019CO 0.13 0.26 0.00 -0.40 -0.92 0.00 0.00 175.35 174.42 3d4s n ASP 1020N 3.56 -0.53 -0.05 2.83 3.85 -0.76 -4.81 116.55 120.64 3d4s n ASP 1020Ca -0.17 -0.57 0.00 0.00 -0.71 0.00 0.00 54.79 53.35 3d4s n ASP 1020Cb 0.52 0.00 0.30 0.00 -1.35 0.00 0.00 41.12 40.60 3d4s n ASP 1020CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.20 176.90 3d4s h THR 1021N -1.15 1.18 0.00 2.12 1.35 -1.99 -2.45 112.91 111.97 3d4s h THR 1021Ca 0.00 -0.59 0.00 0.00 -0.55 0.00 0.00 66.41 65.27 3d4s h THR 1021Cb 0.00 0.69 0.00 0.00 -1.73 0.00 0.00 68.15 67.11 3d4s h THR 1021CO 0.00 0.22 0.00 -0.33 -0.25 0.00 0.00 175.52 175.16 3d4s h GLU 1022N 0.63 0.00 0.00 4.72 5.08 -2.03 -3.47 114.58 119.50 3d4s h GLU 1022Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 3d4s h GLU 1022Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 3d4s h GLU 1022CO -0.01 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.41 3d4s n GLY 1023N 1.04 0.61 3.83 -3.84 0.00 -0.92 -5.10 105.19 100.80 3d4s n GLY 1023Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 3d4s n GLY 1023CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3d4s s TYR 1024N -2.00 3.40 -0.15 1.61 1.51 -1.26 -4.66 117.35 115.79 3d4s s TYR 1024Ca 0.00 1.46 -0.29 0.00 -1.01 0.00 0.00 57.07 57.23 3d4s s TYR 1024Cb 0.00 -2.72 -0.03 0.00 -0.11 0.00 0.00 41.96 39.10 3d4s s TYR 1024CO 0.00 0.03 1.56 0.71 -1.11 0.00 0.00 175.55 176.74 3d4s s TYR 1025N -2.00 2.21 0.17 2.71 1.51 -1.23 -1.83 117.35 118.88 3d4s s TYR 1025Ca 0.56 0.51 0.07 0.00 -1.01 0.00 0.00 57.07 57.20 3d4s s TYR 1025Cb -0.11 -3.87 -0.04 0.00 -0.11 0.00 0.00 41.96 37.83 3d4s s TYR 1025CO 0.16 -3.01 -0.14 0.99 -1.11 0.00 0.00 175.55 172.44 3d4s s THR 1026N 4.47 1.56 0.07 -0.71 2.01 0.74 -2.39 115.64 121.38 3d4s s THR 1026Ca 0.69 -2.01 -0.14 0.00 0.31 0.00 0.00 61.69 60.53 3d4s s THR 1026Cb -0.27 -1.85 0.02 0.00 0.01 0.00 0.00 72.50 70.42 3d4s s THR 1026CO 0.26 -0.52 0.33 -0.51 -0.69 0.00 0.00 174.62 173.49 3d4s s ILE 1027N -2.65 0.08 0.00 1.82 2.07 -0.96 -1.12 121.20 120.45 3d4s s ILE 1027Ca 0.17 -0.69 0.00 0.00 -1.41 0.00 0.00 60.65 58.72 3d4s s ILE 1027Cb -0.02 -1.06 0.00 0.00 0.13 0.00 0.00 42.46 41.51 3d4s s ILE 1027CO 0.05 -0.38 0.00 0.61 -1.91 0.00 0.00 174.94 173.31 3d4s n GLY 1028N 0.27 1.41 3.11 1.50 0.00 -0.34 -2.04 105.19 109.10 3d4s n GLY 1028Ca -0.17 -0.53 -0.42 0.00 0.00 0.00 0.00 46.02 44.89 3d4s n GLY 1028CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3d4s n ILE 1029N 0.00 4.68 -2.71 -0.61 5.41 -1.26 -2.34 119.36 122.52 3d4s n ILE 1029Ca 0.00 -5.62 -0.21 0.00 1.00 0.00 0.00 62.75 57.92 3d4s n ILE 1029Cb 0.00 -2.30 0.01 0.00 -0.71 0.00 0.00 39.64 36.64 3d4s n ILE 1029CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3d4s n GLY 1030N 1.90 -0.51 3.52 7.39 0.00 -1.25 -4.94 105.19 111.30 3d4s n GLY 1030Ca 0.25 0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.90 3d4s n GLY 1030CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3d4s s HIS 1031N -3.09 2.88 -0.15 1.61 5.04 -0.87 -4.93 115.29 115.78 3d4s s HIS 1031Ca 0.15 0.01 -0.29 0.00 -1.54 0.00 0.00 55.06 53.39 3d4s s HIS 1031Cb -0.07 -3.92 -0.03 0.00 0.04 0.00 0.00 32.58 28.60 3d4s s HIS 1031CO 0.19 -1.22 1.50 -1.17 -2.34 0.00 0.00 174.74 171.70 3d4s s LEU 1032N 3.65 4.13 -0.13 8.88 2.96 -1.26 -2.26 118.68 134.64 3d4s s LEU 1032Ca 0.29 1.82 -0.20 0.00 -0.22 0.00 0.00 54.13 55.82 3d4s s LEU 1032Cb -0.13 -3.53 -0.18 0.00 0.50 0.00 0.00 46.19 42.85 3d4s s LEU 1032CO 0.20 -0.98 0.51 -0.07 -1.32 0.00 0.00 176.35 174.69 3d4s h LEU 1033N 10.54 0.00 -7.00 -0.68 3.38 -1.84 -3.49 115.31 116.21 3d4s h LEU 1033Ca -0.33 -0.68 -0.04 0.00 0.09 0.00 0.00 57.88 56.92 3d4s h LEU 1033Cb 1.14 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.73 3d4s h LEU 1033CO 0.98 0.87 0.20 0.28 0.09 0.00 0.00 178.44 180.86 3d4s s THR 1034N -2.03 0.00 -2.60 0.22 -1.32 -1.24 -4.91 115.64 103.76 3d4s s THR 1034Ca -0.14 0.00 0.24 0.00 -1.21 0.00 0.00 61.69 60.58 3d4s s THR 1034Cb -0.02 -1.00 0.39 0.00 -1.51 0.00 0.00 72.50 70.36 3d4s s THR 1034CO 0.48 0.00 1.47 0.29 -2.21 0.00 0.00 174.62 174.65 3d4s n LYS 1035N 0.36 2.10 -2.63 7.08 5.02 -1.26 -3.50 118.16 125.32 3d4s n LYS 1035Ca -0.18 -1.63 -0.38 0.00 -2.02 0.00 0.00 58.31 54.09 3d4s n LYS 1035Cb 0.60 -1.46 -0.05 0.00 -0.02 0.00 0.00 35.03 34.10 3d4s n LYS 1035CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3d4s s SER 1036N -1.77 7.25 0.00 4.39 0.15 -1.26 -4.96 113.70 117.50 3d4s s SER 1036Ca 0.34 2.03 0.14 0.00 0.70 0.00 0.00 55.95 59.16 3d4s s SER 1036Cb 0.20 -2.60 0.83 0.00 -1.71 0.00 0.00 66.02 62.75 3d4s s SER 1036CO 0.30 -0.14 1.34 -2.65 1.20 0.00 0.00 173.24 173.29 3d4s n PRO 1037N 0.79 0.72 -3.05 5.44 -0.02 -1.26 -4.71 135.00 132.90 3d4s n PRO 1037Ca 0.01 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 61.09 3d4s n PRO 1037Cb 0.48 -1.30 -0.05 0.00 -0.02 0.00 0.00 33.50 32.61 3d4s n PRO 1037CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3d4s s SER 1038N -1.72 7.01 0.14 2.55 0.15 -1.26 -4.98 113.70 115.59 3d4s s SER 1038Ca 0.21 1.21 -0.06 0.00 0.70 0.00 0.00 55.95 58.01 3d4s s SER 1038Cb 0.10 -2.41 -0.04 0.00 -1.71 0.00 0.00 66.02 61.95 3d4s s SER 1038CO 0.16 -0.09 1.37 0.25 1.20 0.00 0.00 173.24 176.13 3d4s h LEU 1039N 6.57 0.67 -1.04 3.45 5.85 -2.00 -3.05 115.31 125.76 3d4s h LEU 1039Ca -0.42 -0.45 -0.05 0.00 0.84 0.00 0.00 57.88 57.80 3d4s h LEU 1039Cb 1.20 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 42.02 3d4s h LEU 1039CO 0.74 1.22 -0.25 0.78 -0.34 0.00 0.00 178.44 180.60 3d4s h ASN 1040N 0.37 0.00 0.01 1.25 4.21 -1.98 -2.13 115.58 117.31 3d4s h ASN 1040Ca -0.05 0.00 -0.16 0.00 1.21 0.00 0.00 56.30 57.31 3d4s h ASN 1040Cb 1.38 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.57 3d4s h ASN 1040CO 0.14 0.25 -0.53 0.00 -1.29 0.00 0.00 177.43 176.01 3d4s h ALA 1041N 1.75 0.71 -0.43 -0.83 0.00 -1.95 0.12 119.26 118.64 3d4s h ALA 1041Ca -0.00 -0.50 -0.14 0.00 0.00 0.00 0.00 54.91 54.27 3d4s h ALA 1041Cb 0.79 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3d4s h ALA 1041CO 0.03 0.68 -0.27 0.00 0.00 0.00 0.00 179.25 179.70 3d4s h ALA 1042N 0.98 0.61 -0.15 0.00 0.00 -1.39 -1.58 119.26 117.74 3d4s h ALA 1042Ca 0.01 -0.41 -0.13 0.00 0.00 0.00 0.00 54.91 54.39 3d4s h ALA 1042Cb 1.06 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 3d4s h ALA 1042CO 0.10 0.63 -0.45 0.87 0.00 0.00 0.00 179.25 180.40 3d4s h LYS 1043N 0.77 0.36 -0.37 0.00 1.57 -1.26 -1.58 116.57 116.06 3d4s h LYS 1043Ca 0.09 -0.19 -0.06 0.00 -1.87 0.00 0.00 60.65 58.61 3d4s h LYS 1043Cb 0.85 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.15 3d4s h LYS 1043CO 0.07 0.74 -0.02 1.03 -0.57 0.00 0.00 179.45 180.71 3d4s h SER 1044N 0.29 0.65 1.03 0.86 0.87 -0.60 -0.08 113.55 116.58 3d4s h SER 1044Ca 0.02 -0.32 -0.03 0.00 -1.23 0.00 0.00 61.79 60.22 3d4s h SER 1044Cb 0.91 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 62.69 3d4s h SER 1044CO 0.08 0.82 -0.16 -0.33 -0.53 0.00 0.00 176.83 176.71 3d4s h GLU 1045N 0.47 0.00 0.19 2.24 4.39 -1.23 -1.91 114.58 118.74 3d4s h GLU 1045Ca 0.10 0.00 -0.32 0.00 0.34 0.00 0.00 59.36 59.48 3d4s h GLU 1045Cb 0.50 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 29.18 3d4s h GLU 1045CO 0.02 0.16 -1.36 1.25 -1.16 0.00 0.00 179.01 177.93 3d4s h LEU 1046N 0.00 0.86 -1.18 1.33 5.85 -1.02 -2.18 115.31 118.96 3d4s h LEU 1046Ca -0.00 -0.88 -0.09 0.00 0.84 0.00 0.00 57.88 57.75 3d4s h LEU 1046Cb 0.72 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 3d4s h LEU 1046CO 0.02 1.66 -0.41 0.44 -0.34 0.00 0.00 178.44 179.81 3d4s h ASP 1047N 0.19 0.00 0.01 1.25 3.32 -0.88 -2.38 116.42 117.92 3d4s h ASP 1047Ca -0.22 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.83 3d4s h ASP 1047Cb 2.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.59 3d4s h ASP 1047CO 0.26 0.41 -0.00 0.50 -1.72 0.00 0.00 179.24 178.69 3d4s h LYS 1048N 0.00 -0.01 -0.40 3.56 3.64 -1.40 -1.39 116.57 120.58 3d4s h LYS 1048Ca -0.00 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.40 3d4s h LYS 1048Cb 0.73 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.52 3d4s h LYS 1048CO 0.05 0.64 0.23 0.00 -2.27 0.00 0.00 179.45 178.10 3d4s h ALA 1049N 0.32 0.50 0.00 5.00 0.00 -1.34 -3.30 119.26 120.43 3d4s h ALA 1049Ca -0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3d4s h ALA 1049Cb 0.65 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 3d4s h ALA 1049CO 0.00 -0.11 -0.06 0.82 0.00 0.00 0.00 179.25 179.90 3d4s h ILE 1050N 0.46 0.60 0.00 0.00 1.08 -1.57 -3.50 117.51 114.58 3d4s h ILE 1050Ca 0.16 -1.46 0.00 0.00 -0.39 0.00 0.00 64.86 63.17 3d4s h ILE 1050Cb 0.02 1.14 0.00 0.00 -3.07 0.00 0.00 36.82 34.91 3d4s h ILE 1050CO -0.08 0.20 0.00 0.61 -0.69 0.00 0.00 178.15 178.19 3d4s n GLY 1051N 1.71 1.82 3.67 5.37 0.00 -0.54 -5.10 105.19 112.12 3d4s n GLY 1051Ca -0.04 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.91 3d4s n GLY 1051CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3d4s s ARG 1052N -0.27 1.28 -0.84 1.61 1.70 -1.12 -5.05 118.95 116.27 3d4s s ARG 1052Ca 0.00 -0.63 -0.25 0.00 -0.47 0.00 0.00 55.73 54.38 3d4s s ARG 1052Cb 0.00 0.49 0.01 0.00 -0.57 0.00 0.00 34.95 34.88 3d4s s ARG 1052CO 0.00 -0.58 1.56 -0.80 -1.08 0.00 0.00 175.30 174.40 3d4s s ASN 1053N -2.81 5.93 0.18 -2.89 -0.87 -1.26 -4.36 114.94 108.86 3d4s s ASN 1053Ca 0.08 -0.68 0.10 0.00 -1.57 0.00 0.00 52.86 50.79 3d4s s ASN 1053Cb -0.02 -2.56 -0.11 0.00 -0.02 0.00 0.00 41.25 38.54 3d4s s ASN 1053CO -0.02 -1.99 1.33 0.71 -2.57 0.00 0.00 177.10 174.57 3d4s h THR 1054N 6.66 1.38 -3.26 1.60 1.35 -1.91 -3.48 112.91 115.25 3d4s h THR 1054Ca -0.05 -2.96 -0.41 0.00 -0.55 0.00 0.00 66.41 62.44 3d4s h THR 1054Cb 1.05 2.68 -0.01 0.00 -1.73 0.00 0.00 68.15 70.14 3d4s h THR 1054CO 1.31 0.79 -0.55 0.59 -0.25 0.00 0.00 175.52 177.41 3d4s n ASN 1055N -3.30 -5.95 -0.41 5.36 5.03 -1.26 -1.93 115.26 112.80 3d4s n ASN 1055Ca 0.01 -0.06 -0.05 0.00 0.87 0.00 0.00 54.58 55.35 3d4s n ASN 1055Cb 0.86 -4.93 -0.02 0.00 -1.02 0.00 0.00 39.78 34.68 3d4s n ASN 1055CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3d4s n GLY 1056N -1.10 0.62 2.80 7.41 0.00 -1.26 -5.04 105.19 108.62 3d4s n GLY 1056Ca -0.23 -0.81 -0.18 0.00 0.00 0.00 0.00 46.02 44.80 3d4s n GLY 1056CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d4s s VAL 1057N -2.19 0.16 0.24 1.61 1.01 -0.82 -2.85 120.40 117.56 3d4s s VAL 1057Ca 0.00 0.12 0.04 0.00 0.00 0.00 0.00 61.98 62.14 3d4s s VAL 1057Cb 0.00 -0.27 -0.05 0.00 0.00 0.00 0.00 36.38 36.06 3d4s s VAL 1057CO 0.00 0.15 0.00 0.27 0.00 0.00 0.00 175.10 175.52 3d4s s ILE 1058N 1.18 1.05 0.73 2.22 -4.36 -0.76 -4.71 121.20 116.55 3d4s s ILE 1058Ca -0.08 -2.03 -0.05 0.00 -0.26 0.00 0.00 60.65 58.24 3d4s s ILE 1058Cb -0.13 -2.39 0.11 0.00 1.25 0.00 0.00 42.46 41.29 3d4s s ILE 1058CO -0.02 -0.29 1.02 0.42 0.24 0.00 0.00 174.94 176.31 3d4s s THR 1059N -3.41 2.23 0.01 8.37 -4.23 -1.26 -4.78 115.64 112.57 3d4s s THR 1059Ca 0.29 -0.42 0.22 0.00 -1.18 0.00 0.00 61.69 60.61 3d4s s THR 1059Cb 0.06 -2.81 0.21 0.00 1.34 0.00 0.00 72.50 71.29 3d4s s THR 1059CO 0.09 0.00 1.72 0.50 -0.54 0.00 0.00 174.62 176.39 3d4s h LYS 1060N -0.64 0.00 0.12 3.99 3.64 -1.99 -2.68 116.57 119.02 3d4s h LYS 1060Ca -0.41 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 58.97 3d4s h LYS 1060Cb 1.28 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 3d4s h LYS 1060CO 0.47 0.26 -0.06 -0.44 -2.27 0.00 0.00 179.45 177.42 3d4s h ASP 1061N 0.00 -0.14 -0.07 4.20 5.19 -1.99 -2.15 116.42 121.46 3d4s h ASP 1061Ca -0.00 -0.33 -0.03 0.00 -0.62 0.00 0.00 57.03 56.04 3d4s h ASP 1061Cb 0.92 0.04 -0.01 0.00 0.18 0.00 0.00 39.33 40.45 3d4s h ASP 1061CO 0.03 0.28 -0.04 -0.33 -3.12 0.00 0.00 179.24 176.07 3d4s h GLU 1062N -0.59 0.27 -0.23 3.56 5.08 -1.95 -0.59 114.58 120.14 3d4s h GLU 1062Ca -0.02 -0.05 -0.13 0.00 -1.00 0.00 0.00 59.36 58.17 3d4s h GLU 1062Cb 0.46 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 3d4s h GLU 1062CO 0.03 0.33 -0.41 0.00 -1.00 0.00 0.00 179.01 177.96 3d4s h ALA 1063N 1.70 0.87 -0.00 3.43 0.00 -1.46 -2.63 119.26 121.17 3d4s h ALA 1063Ca 0.06 -0.44 -0.25 0.00 0.00 0.00 0.00 54.91 54.28 3d4s h ALA 1063Cb 0.25 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.94 3d4s h ALA 1063CO 0.01 0.64 -0.99 1.49 0.00 0.00 0.00 179.25 180.40 3d4s h GLU 1064N 0.44 0.58 -0.83 0.00 4.81 -0.72 -2.47 114.58 116.39 3d4s h GLU 1064Ca 0.04 -0.62 0.01 0.00 -0.13 0.00 0.00 59.36 58.65 3d4s h GLU 1064Cb 0.90 0.18 -0.04 0.00 0.63 0.00 0.00 28.75 30.42 3d4s h GLU 1064CO 0.08 1.23 0.55 0.87 -0.73 0.00 0.00 179.01 181.01 3d4s h LYS 1065N 0.33 1.10 -0.25 1.92 1.57 -1.09 -0.31 116.57 119.84 3d4s h LYS 1065Ca -0.11 -0.07 -0.15 0.00 -1.87 0.00 0.00 60.65 58.46 3d4s h LYS 1065Cb 1.64 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 33.70 3d4s h LYS 1065CO 0.19 0.73 -0.44 -0.07 -0.57 0.00 0.00 179.45 179.28 3d4s h LEU 1066N 1.13 0.67 -1.14 2.94 3.38 -1.52 -2.91 115.31 117.85 3d4s h LEU 1066Ca 0.30 -0.32 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 3d4s h LEU 1066Cb -0.13 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.41 3d4s h LEU 1066CO -0.07 1.02 0.05 0.15 0.09 0.00 0.00 178.44 179.68 3d4s h PHE 1067N 0.51 0.67 -0.42 1.13 3.57 -0.90 -1.04 116.94 120.46 3d4s h PHE 1067Ca 0.03 -0.07 -0.09 0.00 3.53 0.00 0.00 57.97 61.38 3d4s h PHE 1067Cb 0.97 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.50 3d4s h PHE 1067CO 0.04 0.61 -0.09 -0.91 -2.23 0.00 0.00 178.31 175.74 3d4s h ASN 1068N 0.62 0.80 -0.49 0.41 2.35 -0.99 -2.54 115.58 115.74 3d4s h ASN 1068Ca 0.13 -0.36 -0.04 0.00 -0.55 0.00 0.00 56.30 55.49 3d4s h ASN 1068Cb 0.32 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.45 3d4s h ASN 1068CO 0.01 0.97 0.14 1.56 -1.65 0.00 0.00 177.43 178.45 3d4s h GLN 1069N 0.62 0.78 -0.68 0.81 4.20 -1.29 -2.14 115.11 117.40 3d4s h GLN 1069Ca 0.11 -0.18 -0.08 0.00 0.06 0.00 0.00 58.65 58.56 3d4s h GLN 1069Cb 0.61 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 28.26 3d4s h GLN 1069CO 0.04 0.74 0.12 -0.44 -0.67 0.00 0.00 178.83 178.62 3d4s h ASP 1070N 0.67 1.07 -0.21 1.46 3.45 -1.20 -0.72 116.42 120.93 3d4s h ASP 1070Ca 0.16 -0.25 -0.07 0.00 0.43 0.00 0.00 57.03 57.30 3d4s h ASP 1070Cb 0.30 -0.28 -0.00 0.00 -0.56 0.00 0.00 39.33 38.79 3d4s h ASP 1070CO -0.00 1.05 -0.14 0.58 -1.57 0.00 0.00 179.24 179.16 3d4s h VAL 1071N 1.05 1.31 -0.87 -1.35 2.07 -1.42 -2.01 116.25 115.02 3d4s h VAL 1071Ca 0.21 -1.24 -0.02 0.00 0.82 0.00 0.00 66.70 66.46 3d4s h VAL 1071Cb 0.43 1.66 -0.04 0.00 -1.52 0.00 0.00 31.29 31.82 3d4s h VAL 1071CO 0.01 0.38 0.45 0.44 0.02 0.00 0.00 177.57 178.87 3d4s h ASP 1072N 0.17 1.12 0.04 0.57 3.45 -1.32 -0.61 116.42 119.83 3d4s h ASP 1072Ca 0.04 -0.12 -0.07 0.00 0.43 0.00 0.00 57.03 57.32 3d4s h ASP 1072Cb 0.65 -0.29 -0.01 0.00 -0.56 0.00 0.00 39.33 39.12 3d4s h ASP 1072CO 0.04 0.92 -0.20 0.00 -1.57 0.00 0.00 179.24 178.43 3d4s h ALA 1073N 1.24 1.36 -0.08 3.45 0.00 -1.09 -0.69 119.26 123.46 3d4s h ALA 1073Ca 0.30 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 3d4s h ALA 1073Cb 0.08 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 3d4s h ALA 1073CO -0.04 0.44 -0.09 0.00 0.00 0.00 0.00 179.25 179.55 3d4s h ALA 1074N 1.54 0.11 -0.05 0.00 0.00 -0.81 -1.29 119.26 118.77 3d4s h ALA 1074Ca 0.05 -0.30 0.03 0.00 0.00 0.00 0.00 54.91 54.68 3d4s h ALA 1074Cb 0.50 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 3d4s h ALA 1074CO 0.03 -0.05 -0.12 0.28 0.00 0.00 0.00 179.25 179.39 3d4s h VAL 1075N -0.25 0.68 -0.96 0.00 2.07 -0.85 -1.84 116.25 115.10 3d4s h VAL 1075Ca 0.01 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.54 3d4s h VAL 1075Cb 0.62 0.68 -0.05 0.00 -1.52 0.00 0.00 31.29 31.02 3d4s h VAL 1075CO 0.02 0.00 0.64 0.03 0.02 0.00 0.00 177.57 178.28 3d4s h ARG 1076N -0.19 1.25 -0.21 1.57 3.08 -1.19 -2.52 114.38 116.17 3d4s h ARG 1076Ca 0.06 -0.08 -0.05 0.00 0.07 0.00 0.00 59.98 59.98 3d4s h ARG 1076Cb 0.27 -0.28 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 3d4s h ARG 1076CO -0.16 0.83 -0.10 0.78 -1.07 0.00 0.00 179.97 180.25 3d4s h GLY 1077N 1.29 0.35 0.95 0.04 0.00 -0.80 -0.73 103.07 104.16 3d4s h GLY 1077Ca 0.36 -0.21 -0.13 0.00 0.00 0.00 0.00 47.33 47.34 3d4s h GLY 1077CO -0.08 0.20 -0.37 -2.22 0.00 0.00 0.00 176.54 174.07 3d4s h ILE 1078N 0.31 1.32 0.00 2.60 2.04 -0.93 -1.72 117.51 121.13 3d4s h ILE 1078Ca 0.06 -1.58 -0.08 0.00 1.00 0.00 0.00 64.86 64.26 3d4s h ILE 1078Cb 0.37 1.79 -0.01 0.00 -0.74 0.00 0.00 36.82 38.23 3d4s h ILE 1078CO 0.02 0.49 -0.39 -0.07 0.00 0.00 0.00 178.15 178.20 3d4s h LEU 1079N 0.34 0.00 0.04 1.44 3.38 -1.26 -2.62 115.31 116.62 3d4s h LEU 1079Ca 0.02 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 3d4s h LEU 1079Cb 0.96 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.71 3d4s h LEU 1079CO 0.08 0.39 -0.02 -0.09 0.09 0.00 0.00 178.44 178.90 3d4s h ARG 1080N 0.00 -0.05 -6.35 1.13 2.43 -1.07 -3.45 114.38 107.02 3d4s h ARG 1080Ca -0.00 0.00 -0.54 0.00 -0.81 0.00 0.00 59.98 58.63 3d4s h ARG 1080Cb 0.74 0.01 0.01 0.00 -0.42 0.00 0.00 29.97 30.31 3d4s h ARG 1080CO 0.05 0.61 1.09 1.21 -1.51 0.00 0.00 179.97 181.42 3d4s s ASN 1081N -5.84 6.59 0.51 -3.80 3.04 -0.65 -4.90 114.94 109.89 3d4s s ASN 1081Ca -0.16 2.44 0.18 0.00 0.04 0.00 0.00 52.86 55.36 3d4s s ASN 1081Cb -0.00 -2.54 1.28 0.00 -1.54 0.00 0.00 41.25 38.44 3d4s s ASN 1081CO 0.61 -0.95 2.10 0.00 -3.04 0.00 0.00 177.10 175.83 3d4s h ALA 1082N 9.36 2.11 0.03 1.71 0.00 -1.86 -0.77 119.26 129.85 3d4s h ALA 1082Ca -0.43 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.29 3d4s h ALA 1082Cb 1.20 -0.00 0.02 0.00 0.00 0.00 0.00 17.79 19.01 3d4s h ALA 1082CO 0.94 -0.16 -0.72 0.87 0.00 0.00 0.00 179.25 180.18 3d4s h LYS 1083N 0.04 0.44 0.00 0.00 1.57 -1.90 -3.34 116.57 113.38 3d4s h LYS 1083Ca 0.08 -0.51 -0.00 0.00 -1.87 0.00 0.00 60.65 58.35 3d4s h LYS 1083Cb 0.27 0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.73 3d4s h LYS 1083CO -0.00 1.17 -0.09 -0.07 -0.57 0.00 0.00 179.45 179.88 3d4s h LEU 1084N -0.06 0.00 0.08 2.94 3.38 -1.73 -3.39 115.31 116.53 3d4s h LEU 1084Ca -0.10 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.88 3d4s h LEU 1084Cb 1.44 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.17 3d4s h LEU 1084CO 0.14 0.00 -0.14 0.50 0.09 0.00 0.00 178.44 179.04 3d4s h LYS 1085N 0.00 -0.26 0.00 1.13 3.64 -0.75 -2.54 116.57 117.80 3d4s h LYS 1085Ca -0.00 0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.34 3d4s h LYS 1085Cb 1.00 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.87 3d4s h LYS 1085CO 0.00 -0.17 -0.28 -1.35 -2.27 0.00 0.00 179.45 175.37 3d4s h PRO 1086N -0.27 0.00 -0.35 1.90 0.11 -1.75 -3.25 132.00 128.39 3d4s h PRO 1086Ca 0.02 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.04 3d4s h PRO 1086Cb 0.29 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.39 3d4s h PRO 1086CO -0.08 0.28 -0.14 0.28 -0.21 0.00 0.00 178.00 178.14 3d4s h VAL 1087N 0.00 1.28 -0.16 3.15 2.07 -1.74 -2.98 116.25 117.88 3d4s h VAL 1087Ca -0.00 -1.24 -0.04 0.00 0.82 0.00 0.00 66.70 66.24 3d4s h VAL 1087Cb 1.01 1.34 -0.01 0.00 -1.52 0.00 0.00 31.29 32.11 3d4s h VAL 1087CO 0.04 0.41 -0.07 0.22 0.02 0.00 0.00 177.57 178.18 3d4s h TYR 1088N 0.50 0.24 0.02 1.57 3.20 -1.49 -2.99 116.97 118.03 3d4s h TYR 1088Ca 0.08 -0.02 -0.21 0.00 3.14 0.00 0.00 58.73 61.72 3d4s h TYR 1088Cb 0.66 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.86 3d4s h TYR 1088CO 0.06 0.32 -0.94 -0.44 -1.64 0.00 0.00 178.16 175.51 3d4s h ASP 1089N 0.23 0.35 1.09 -2.11 3.32 -1.59 -3.22 116.42 114.48 3d4s h ASP 1089Ca 0.05 -0.29 0.00 0.00 0.02 0.00 0.00 57.03 56.81 3d4s h ASP 1089Cb 0.28 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.72 3d4s h ASP 1089CO 0.01 1.11 0.00 -1.54 -1.72 0.00 0.00 179.24 177.11 3d4s n SER 1090N -3.66 0.62 -4.90 6.45 3.41 -1.13 -4.83 113.62 109.57 3d4s n SER 1090Ca -0.05 0.59 -0.30 0.00 -0.26 0.00 0.00 58.87 58.86 3d4s n SER 1090Cb 0.84 -0.75 -0.04 0.00 -0.26 0.00 0.00 64.21 64.01 3d4s n SER 1090CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3d4s s LEU 1091N -4.24 4.16 0.74 1.04 1.43 -1.16 -4.98 118.68 115.68 3d4s s LEU 1091Ca 0.08 0.68 -0.10 0.00 -1.03 0.00 0.00 54.13 53.77 3d4s s LEU 1091Cb 0.12 -3.46 0.06 0.00 0.03 0.00 0.00 46.19 42.94 3d4s s LEU 1091CO 0.49 -0.08 1.10 1.51 0.23 0.00 0.00 176.35 179.60 3d4s s ASP 1092N -2.77 4.84 0.46 2.29 -4.77 -1.26 -4.77 116.67 110.68 3d4s s ASP 1092Ca 0.43 0.75 0.28 0.00 -3.30 0.00 0.00 52.55 50.71 3d4s s ASP 1092Cb -0.11 -1.37 1.35 0.00 -1.09 0.00 0.00 42.92 41.69 3d4s s ASP 1092CO 0.26 -1.66 1.73 0.00 0.70 0.00 0.00 175.17 176.20 3d4s h ALA 1093N -0.79 2.71 0.16 2.11 0.00 -1.97 -1.31 119.26 120.17 3d4s h ALA 1093Ca -0.45 0.04 -0.26 0.00 0.00 0.00 0.00 54.91 54.24 3d4s h ALA 1093Cb 1.31 0.10 0.02 0.00 0.00 0.00 0.00 17.79 19.21 3d4s h ALA 1093CO 0.64 -1.16 -1.21 0.28 0.00 0.00 0.00 179.25 177.79 3d4s h VAL 1094N 0.18 1.27 0.00 0.00 2.07 -1.93 -3.27 116.25 114.57 3d4s h VAL 1094Ca 0.67 -2.53 -0.07 0.00 0.82 0.00 0.00 66.70 65.59 3d4s h VAL 1094Cb 2.14 2.99 -0.01 0.00 -1.52 0.00 0.00 31.29 34.89 3d4s h VAL 1094CO -0.24 0.75 -0.32 0.03 0.02 0.00 0.00 177.57 177.81 3d4s h ARG 1095N -0.20 0.00 -0.44 1.57 3.08 -1.71 -2.83 114.38 113.85 3d4s h ARG 1095Ca -0.23 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.77 3d4s h ARG 1095Cb 1.83 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.86 3d4s h ARG 1095CO 0.15 0.32 0.07 0.00 -1.07 0.00 0.00 179.97 179.45 3d4s h ARG 1096N 0.00 0.72 -0.51 0.04 3.08 -1.39 -1.80 114.38 114.52 3d4s h ARG 1096Ca -0.00 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 59.85 3d4s h ARG 1096Cb 0.87 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.81 3d4s h ARG 1096CO 0.04 0.75 0.29 0.00 -1.07 0.00 0.00 179.97 179.98 3d4s h ALA 1097N 0.94 1.55 -0.10 0.04 0.00 -1.55 -0.00 119.26 120.14 3d4s h ALA 1097Ca 0.13 -0.07 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 3d4s h ALA 1097Cb 0.37 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3d4s h ALA 1097CO 0.01 0.38 -0.53 0.00 0.00 0.00 0.00 179.25 179.11 3d4s h ALA 1098N 1.62 0.93 -0.12 0.00 0.00 -1.29 -1.64 119.26 118.76 3d4s h ALA 1098Ca 0.18 -0.49 -0.22 0.00 0.00 0.00 0.00 54.91 54.38 3d4s h ALA 1098Cb 0.00 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.72 3d4s h ALA 1098CO -0.03 0.68 -0.79 1.25 0.00 0.00 0.00 179.25 180.35 3d4s h LEU 1099N 0.21 0.90 -1.08 0.00 5.85 -0.49 -3.02 115.31 117.68 3d4s h LEU 1099Ca 0.01 -0.65 -0.08 0.00 0.84 0.00 0.00 57.88 57.99 3d4s h LEU 1099Cb 1.00 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 3d4s h LEU 1099CO 0.08 1.41 -0.27 0.40 -0.34 0.00 0.00 178.44 179.73 3d4s h ILE 1100N 0.45 1.26 -0.61 4.05 2.04 -0.99 -2.78 117.51 120.92 3d4s h ILE 1100Ca -0.07 -1.21 0.00 0.00 1.00 0.00 0.00 64.86 64.59 3d4s h ILE 1100Cb 1.43 1.42 -0.03 0.00 -0.74 0.00 0.00 36.82 38.90 3d4s h ILE 1100CO 0.16 0.37 0.40 -1.13 0.00 0.00 0.00 178.15 177.95 3d4s h ASN 1101N 0.29 0.72 -0.56 1.72 -0.73 -1.27 0.05 115.58 115.80 3d4s h ASN 1101Ca 0.04 -0.03 -0.09 0.00 1.87 0.00 0.00 56.30 58.09 3d4s h ASN 1101Cb 0.63 -0.18 -0.02 0.00 0.27 0.00 0.00 38.32 39.02 3d4s h ASN 1101CO 0.05 0.53 -0.01 0.24 -0.37 0.00 0.00 177.43 177.87 3d4s h MET 1102N 0.83 0.99 -0.16 6.67 2.86 -1.39 -2.74 114.93 122.00 3d4s h MET 1102Ca 0.22 -0.32 -0.09 0.00 -2.06 0.00 0.00 59.70 57.45 3d4s h MET 1102Cb -0.07 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.49 3d4s h MET 1102CO -0.05 1.00 -0.32 0.28 1.06 0.00 0.00 176.91 178.88 3d4s h VAL 1103N 0.88 1.28 -0.24 -2.22 2.07 -1.26 0.00 116.25 116.76 3d4s h VAL 1103Ca 0.16 -1.33 -0.08 0.00 0.82 0.00 0.00 66.70 66.27 3d4s h VAL 1103Cb 0.56 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.82 3d4s h VAL 1103CO 0.03 0.41 -0.19 0.15 0.02 0.00 0.00 177.57 177.99 3d4s h PHE 1104N 0.28 0.47 0.11 1.57 3.57 -0.82 -1.08 116.94 121.04 3d4s h PHE 1104Ca 0.04 -0.08 -0.33 0.00 3.53 0.00 0.00 57.97 61.13 3d4s h PHE 1104Cb 0.70 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.31 3d4s h PHE 1104CO 0.02 0.60 -1.75 0.37 -2.23 0.00 0.00 178.31 175.32 3d4s h GLN 1105N 0.39 0.23 0.00 1.11 4.15 -1.21 -3.43 115.11 116.35 3d4s h GLN 1105Ca 0.07 -0.39 -0.23 0.00 0.77 0.00 0.00 58.65 58.87 3d4s h GLN 1105Cb 0.56 0.15 -0.04 0.00 0.21 0.00 0.00 27.48 28.35 3d4s h GLN 1105CO 0.04 1.19 -1.94 -1.33 -1.93 0.00 0.00 178.83 174.85 3d4s n MET 1106N -3.74 1.51 0.00 1.69 2.81 -0.04 -5.12 117.12 114.24 3d4s n MET 1106Ca -0.30 -0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.56 3d4s n MET 1106Cb 0.96 -1.37 0.00 0.00 -0.71 0.00 0.00 33.22 32.11 3d4s n MET 1106CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3d4s n GLY 1107N 2.06 2.41 0.32 3.03 0.00 -0.41 -4.37 105.19 108.22 3d4s n GLY 1107Ca -0.21 -1.95 -0.03 0.00 0.00 0.00 0.00 46.02 43.84 3d4s n GLY 1107CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3d4s h GLU 1108N 0.00 0.91 -0.39 1.61 3.07 -1.93 -2.24 114.58 115.61 3d4s h GLU 1108Ca 0.00 -0.16 -0.15 0.00 -0.50 0.00 0.00 59.36 58.55 3d4s h GLU 1108Cb 0.00 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 27.75 3d4s h GLU 1108CO 0.00 0.76 -0.35 1.15 -1.40 0.00 0.00 179.01 179.17 3d4s h THR 1109N 0.89 1.27 -0.53 1.13 2.02 -1.97 -2.64 112.91 113.08 3d4s h THR 1109Ca 0.21 -1.53 -0.12 0.00 0.77 0.00 0.00 66.41 65.74 3d4s h THR 1109Cb 0.22 1.36 -0.02 0.00 -1.74 0.00 0.00 68.15 67.97 3d4s h THR 1109CO -0.01 0.51 -0.14 1.23 0.37 0.00 0.00 175.52 177.48 3d4s h GLY 1110N 0.75 1.10 2.00 2.16 0.00 -1.71 -3.01 103.07 104.37 3d4s h GLY 1110Ca 0.07 -0.91 -0.04 0.00 0.00 0.00 0.00 47.33 46.44 3d4s h GLY 1110CO 0.09 0.83 -0.20 -2.08 0.00 0.00 0.00 176.54 175.18 3d4s h VAL 1111N 0.90 0.41 0.00 4.60 2.07 -1.45 -2.95 116.25 119.83 3d4s h VAL 1111Ca 0.13 -1.23 0.00 0.00 0.82 0.00 0.00 66.70 66.43 3d4s h VAL 1111Cb 0.71 1.91 0.00 0.00 -1.52 0.00 0.00 31.29 32.39 3d4s h VAL 1111CO 0.05 0.20 0.00 0.00 0.02 0.00 0.00 177.57 177.84 3d4s h ALA 1112N 1.80 1.00 0.00 1.67 0.00 -1.33 -3.08 119.26 119.32 3d4s h ALA 1112Ca -0.00 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 3d4s h ALA 1112Cb 0.90 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 3d4s h ALA 1112CO 0.03 0.00 -0.24 0.78 0.00 0.00 0.00 179.25 179.82 3d4s h GLY 1113N 2.30 0.00 -6.84 0.00 0.00 -1.54 -3.36 103.07 93.63 3d4s h GLY 1113Ca 0.00 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 46.68 3d4s h GLY 1113CO 0.00 0.00 2.49 0.69 0.00 0.00 0.00 176.54 179.72 3d4s n PHE 1114N -3.63 3.58 -0.08 5.60 3.72 -1.17 -4.74 117.46 120.75 3d4s n PHE 1114Ca -0.01 -2.60 -0.04 0.00 -0.05 0.00 0.00 57.45 54.75 3d4s n PHE 1114Cb 0.37 -2.47 0.17 0.00 -0.94 0.00 0.00 39.48 36.62 3d4s n PHE 1114CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 3d4s h THR 1115N 4.81 1.24 0.07 4.37 2.02 -1.88 -2.24 112.91 121.30 3d4s h THR 1115Ca 0.47 -1.05 -0.28 0.00 0.77 0.00 0.00 66.41 66.32 3d4s h THR 1115Cb 0.75 0.99 -0.02 0.00 -1.74 0.00 0.00 68.15 68.13 3d4s h THR 1115CO 1.69 0.36 -1.44 0.78 0.37 0.00 0.00 175.52 177.29 3d4s h ASN 1116N 0.66 0.22 -0.07 4.18 2.35 -1.96 -3.19 115.58 117.77 3d4s h ASN 1116Ca 0.12 -0.31 -0.05 0.00 -0.55 0.00 0.00 56.30 55.52 3d4s h ASN 1116Cb 0.50 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.80 3d4s h ASN 1116CO 0.03 1.26 -0.15 0.28 -1.65 0.00 0.00 177.43 177.20 3d4s h SER 1117N 0.04 0.24 -0.56 5.81 0.02 -1.86 -2.92 113.55 114.32 3d4s h SER 1117Ca -0.19 -0.57 -0.02 0.00 -0.84 0.00 0.00 61.79 60.17 3d4s h SER 1117Cb 1.95 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 64.40 3d4s h SER 1117CO 0.14 0.77 0.30 -0.07 -1.14 0.00 0.00 176.83 176.83 3d4s h LEU 1118N -0.28 0.73 0.15 5.07 3.38 -1.57 -1.97 115.31 120.83 3d4s h LEU 1118Ca 0.00 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 57.91 3d4s h LEU 1118Cb 0.74 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 3d4s h LEU 1118CO 0.03 0.61 -0.17 -0.09 0.09 0.00 0.00 178.44 178.91 3d4s h ARG 1119N 0.82 -0.35 0.00 1.13 2.43 -1.57 -2.99 114.38 113.85 3d4s h ARG 1119Ca 0.21 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.40 3d4s h ARG 1119Cb 0.06 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 3d4s h ARG 1119CO -0.03 -0.23 0.00 -1.33 -1.51 0.00 0.00 179.97 176.87 3d4s n MET 1120N -5.29 0.24 0.15 0.20 2.81 -1.10 -2.88 117.12 111.24 3d4s n MET 1120Ca -0.07 0.25 0.03 0.00 -1.81 0.00 0.00 57.70 56.10 3d4s n MET 1120Cb 0.21 -1.81 0.12 0.00 -0.71 0.00 0.00 33.22 31.03 3d4s n MET 1120CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 3d4s h LEU 1121N 0.00 0.00 0.00 4.03 3.38 -1.23 -0.51 115.31 120.98 3d4s h LEU 1121Ca 0.00 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.72 3d4s h LEU 1121Cb 0.65 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.36 3d4s h LEU 1121CO 0.00 0.48 -1.32 -0.61 0.09 0.00 0.00 178.44 177.08 3d4s h GLN 1122N 0.00 0.00 -0.16 1.13 4.15 -1.45 -3.30 115.11 115.48 3d4s h GLN 1122Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3d4s h GLN 1122Cb 1.24 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.93 3d4s h GLN 1122CO 0.06 0.77 0.00 1.04 -1.93 0.00 0.00 178.83 178.77 3d4s n GLN 1123N -3.21 1.39 -1.89 1.69 6.02 -1.14 -4.91 117.38 115.32 3d4s n GLN 1123Ca -0.08 -0.60 -0.18 0.00 -0.01 0.00 0.00 57.00 56.13 3d4s n GLN 1123Cb 0.99 -1.16 -0.05 0.00 1.02 0.00 0.00 30.24 31.05 3d4s n GLN 1123CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3d4s n LYS 1124N -0.03 -1.36 -3.23 -1.09 4.76 -1.17 -4.94 118.16 111.10 3d4s n LYS 1124Ca 0.07 1.03 -0.43 0.00 -2.87 0.00 0.00 58.31 56.12 3d4s n LYS 1124Cb 0.15 -5.42 -0.01 0.00 -1.84 0.00 0.00 35.03 27.91 3d4s n LYS 1124CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 3d4s n ARG 1125N -2.60 3.83 0.11 1.97 1.74 -0.21 -4.89 116.66 116.61 3d4s n ARG 1125Ca -0.20 -4.51 -0.13 0.00 -0.77 0.00 0.00 57.85 52.23 3d4s n ARG 1125Cb 0.63 -2.51 -0.08 0.00 -1.02 0.00 0.00 32.46 29.48 3d4s n ARG 1125CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 3d4s h TRP 1126N 5.95 -0.23 -1.01 -1.55 -0.00 -1.88 -2.54 115.95 114.70 3d4s h TRP 1126Ca 0.19 -0.01 0.06 0.00 -0.00 0.00 0.00 58.89 59.14 3d4s h TRP 1126Cb 0.74 0.07 -0.07 0.00 -0.00 0.00 0.00 29.16 29.91 3d4s h TRP 1126CO 0.86 0.03 0.65 -0.44 -0.00 0.00 0.00 178.44 179.54 3d4s h ASP 1127N -0.46 1.05 -0.04 -3.49 3.32 -1.89 -0.72 116.42 114.18 3d4s h ASP 1127Ca -0.02 0.01 -0.22 0.00 0.02 0.00 0.00 57.03 56.81 3d4s h ASP 1127Cb 0.35 -0.22 0.02 0.00 0.22 0.00 0.00 39.33 39.70 3d4s h ASP 1127CO 0.04 0.67 -0.84 -0.33 -1.72 0.00 0.00 179.24 177.07 3d4s h GLU 1128N 1.19 0.64 -0.21 3.56 5.08 -1.97 -3.20 114.58 119.67 3d4s h GLU 1128Ca 0.43 -0.63 -0.05 0.00 -1.00 0.00 0.00 59.36 58.11 3d4s h GLU 1128Cb 0.16 0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 3d4s h GLU 1128CO -0.17 1.24 -0.11 0.00 -1.00 0.00 0.00 179.01 178.97 3d4s h ALA 1129N 0.42 1.43 0.00 3.43 0.00 -1.19 -2.55 119.26 120.80 3d4s h ALA 1129Ca -0.09 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.52 3d4s h ALA 1129Cb 1.50 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 3d4s h ALA 1129CO 0.17 0.39 -0.37 0.00 0.00 0.00 0.00 179.25 179.44 3d4s h ALA 1130N 1.58 1.10 -0.16 0.00 0.00 -1.20 -2.85 119.26 117.74 3d4s h ALA 1130Ca 0.06 -0.33 -0.22 0.00 0.00 0.00 0.00 54.91 54.42 3d4s h ALA 1130Cb 0.39 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.13 3d4s h ALA 1130CO 0.02 0.46 -0.75 0.28 0.00 0.00 0.00 179.25 179.26 3d4s h VAL 1131N 0.00 1.29 -0.01 0.00 2.07 -1.45 -3.14 116.25 115.00 3d4s h VAL 1131Ca -0.00 -1.96 -0.09 0.00 0.82 0.00 0.00 66.70 65.46 3d4s h VAL 1131Cb 0.80 1.96 -0.01 0.00 -1.52 0.00 0.00 31.29 32.51 3d4s h VAL 1131CO 0.05 0.62 -0.43 0.78 0.02 0.00 0.00 177.57 178.61 3d4s h ASN 1132N 0.53 0.02 0.71 0.57 4.21 -1.42 -2.45 115.58 117.74 3d4s h ASN 1132Ca -0.04 -0.01 -0.06 0.00 1.21 0.00 0.00 56.30 57.40 3d4s h ASN 1132Cb 1.37 -0.01 -0.01 0.00 -1.12 0.00 0.00 38.32 38.56 3d4s h ASN 1132CO 0.15 0.44 -0.27 -0.07 -1.29 0.00 0.00 177.43 176.40 3d4s h LEU 1133N 0.02 0.00 -0.03 1.61 3.38 -1.52 -2.30 115.31 116.46 3d4s h LEU 1133Ca -0.00 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.80 3d4s h LEU 1133Cb 0.76 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 3d4s h LEU 1133CO 0.06 0.27 -0.78 0.00 0.09 0.00 0.00 178.44 178.08 3d4s h ALA 1134N 1.73 0.51 -0.50 1.53 0.00 -1.41 -3.33 119.26 117.79 3d4s h ALA 1134Ca -0.00 -0.71 -0.56 0.00 0.00 0.00 0.00 54.91 53.64 3d4s h ALA 1134Cb 0.70 -0.12 -0.14 0.00 0.00 0.00 0.00 17.79 18.22 3d4s h ALA 1134CO 0.04 0.97 1.17 1.63 0.00 0.00 0.00 179.25 183.06 3d4s n LYS 1135N -3.31 3.18 -3.69 0.00 5.02 -0.87 -4.73 118.16 113.76 3d4s n LYS 1135Ca 0.01 -2.61 -0.10 0.00 -2.02 0.00 0.00 58.31 53.59 3d4s n LYS 1135Cb 0.84 -2.33 -0.05 0.00 -0.02 0.00 0.00 35.03 33.47 3d4s n LYS 1135CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3d4s s SER 1136N 0.59 -0.15 0.56 4.39 1.04 -1.25 -4.97 113.70 113.90 3d4s s SER 1136Ca 0.58 -0.36 0.32 0.00 0.48 0.00 0.00 55.95 56.98 3d4s s SER 1136Cb 0.30 0.43 1.64 0.00 0.10 0.00 0.00 66.02 68.50 3d4s s SER 1136CO -0.15 -0.79 2.12 -0.09 0.98 0.00 0.00 173.24 175.30 3d4s h ARG 1137N 2.56 0.00 -0.59 4.02 2.43 -1.90 -2.86 114.38 118.05 3d4s h ARG 1137Ca -0.34 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 58.75 3d4s h ARG 1137Cb 1.24 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.76 3d4s h ARG 1137CO 0.49 0.07 0.04 2.35 -1.51 0.00 0.00 179.97 181.40 3d4s h TRP 1138N 0.00 1.10 -0.17 2.20 7.01 -1.95 -1.79 115.95 122.35 3d4s h TRP 1138Ca -0.00 -0.18 -0.16 0.00 2.11 0.00 0.00 58.89 60.66 3d4s h TRP 1138Cb 0.30 -0.29 -0.01 0.00 -2.10 0.00 0.00 29.16 27.06 3d4s h TRP 1138CO 0.00 0.97 -0.58 -0.92 -2.79 0.00 0.00 178.44 175.12 3d4s h TYR 1139N 0.91 0.67 -0.12 2.65 3.20 -1.68 -2.84 116.97 119.75 3d4s h TYR 1139Ca 0.17 -0.24 -0.14 0.00 3.14 0.00 0.00 58.73 61.65 3d4s h TYR 1139Cb 0.50 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.64 3d4s h TYR 1139CO 0.04 0.98 -0.55 -0.97 -1.64 0.00 0.00 178.16 176.01 3d4s h ASN 1140N 0.40 0.40 0.20 -2.11 -1.24 -1.52 -3.03 115.58 108.68 3d4s h ASN 1140Ca 0.00 -0.21 -0.01 0.00 0.71 0.00 0.00 56.30 56.79 3d4s h ASN 1140Cb 1.12 -0.11 0.00 0.00 0.73 0.00 0.00 38.32 40.06 3d4s h ASN 1140CO 0.11 0.87 -0.10 -0.61 -1.29 0.00 0.00 177.43 176.41 3d4s h GLN 1141N 0.28 -0.26 -3.26 6.67 5.75 -1.32 -3.41 115.11 119.56 3d4s h GLN 1141Ca 0.00 0.02 -0.63 0.00 -0.15 0.00 0.00 58.65 57.89 3d4s h GLN 1141Cb 1.05 0.06 -0.41 0.00 1.07 0.00 0.00 27.48 29.25 3d4s h GLN 1141CO 0.09 0.06 -0.62 0.95 -2.65 0.00 0.00 178.83 176.66 3d4s s THR 1142N -3.03 2.60 0.01 2.39 -4.23 -1.07 -5.00 115.64 107.31 3d4s s THR 1142Ca -0.10 -3.57 -0.25 0.00 -1.18 0.00 0.00 61.69 56.59 3d4s s THR 1142Cb 0.00 -2.78 -0.18 0.00 1.34 0.00 0.00 72.50 70.88 3d4s s THR 1142CO 0.34 -0.87 1.36 -0.65 -0.54 0.00 0.00 174.62 174.26 3d4s h PRO 1143N 6.17 -0.08 -0.79 3.99 0.11 -1.77 -2.44 132.00 137.20 3d4s h PRO 1143Ca -0.01 0.01 0.09 0.00 0.11 0.00 0.00 66.00 66.20 3d4s h PRO 1143Cb 0.85 0.02 -0.07 0.00 0.11 0.00 0.00 31.00 31.91 3d4s h PRO 1143CO 0.69 0.27 0.45 -0.91 -0.21 0.00 0.00 178.00 178.28 3d4s h ASN 1144N -0.44 0.64 -0.04 -2.05 2.35 -1.94 0.79 115.58 114.89 3d4s h ASN 1144Ca -0.01 0.05 -0.05 0.00 -0.55 0.00 0.00 56.30 55.74 3d4s h ASN 1144Cb 0.39 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.68 3d4s h ASN 1144CO 0.01 0.37 -0.16 -0.09 -1.65 0.00 0.00 177.43 175.91 3d4s h ARG 1145N 0.76 0.18 -0.81 0.81 2.43 -1.95 -3.10 114.38 112.71 3d4s h ARG 1145Ca 0.38 -0.14 0.02 0.00 -0.81 0.00 0.00 59.98 59.42 3d4s h ARG 1145Cb 0.33 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.87 3d4s h ARG 1145CO -0.24 0.78 0.53 0.00 -1.51 0.00 0.00 179.97 179.53 3d4s h ALA 1146N 0.40 1.04 -0.63 2.80 0.00 -1.23 -1.87 119.26 119.76 3d4s h ALA 1146Ca -0.01 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.91 3d4s h ALA 1146Cb 0.81 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 18.24 3d4s h ALA 1146CO 0.03 0.41 0.35 -0.22 0.00 0.00 0.00 179.25 179.82 3d4s h LYS 1147N 1.07 0.63 -0.57 0.00 3.64 -0.92 0.22 116.57 120.64 3d4s h LYS 1147Ca 0.31 -0.04 -0.11 0.00 -1.27 0.00 0.00 60.65 59.54 3d4s h LYS 1147Cb -0.08 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.58 3d4s h LYS 1147CO -0.08 0.42 -0.06 0.00 -2.27 0.00 0.00 179.45 177.46 3d4s h ARG 1148N 0.65 1.04 -0.34 1.90 3.08 -1.38 -0.80 114.38 118.52 3d4s h ARG 1148Ca 0.28 -0.36 -0.14 0.00 0.07 0.00 0.00 59.98 59.82 3d4s h ARG 1148Cb 0.16 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 3d4s h ARG 1148CO -0.17 1.06 -0.35 0.28 -1.07 0.00 0.00 179.97 179.72 3d4s h VAL 1149N 0.93 1.28 -0.49 2.04 2.07 -0.92 -1.90 116.25 119.27 3d4s h VAL 1149Ca 0.15 -1.52 -0.06 0.00 0.82 0.00 0.00 66.70 66.09 3d4s h VAL 1149Cb 0.63 1.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.85 3d4s h VAL 1149CO 0.04 0.50 0.09 0.40 0.02 0.00 0.00 177.57 178.62 3d4s h ILE 1150N 0.63 1.25 0.00 4.57 2.04 -0.55 -2.44 117.51 123.01 3d4s h ILE 1150Ca 0.05 -0.91 -0.05 0.00 1.00 0.00 0.00 64.86 64.95 3d4s h ILE 1150Cb 0.94 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.90 3d4s h ILE 1150CO 0.09 0.32 -0.23 0.74 0.00 0.00 0.00 178.15 179.08 3d4s h THR 1151N 0.68 1.00 -0.34 -0.27 2.02 -1.11 -0.52 112.91 114.37 3d4s h THR 1151Ca 0.15 -0.82 -0.16 0.00 0.77 0.00 0.00 66.41 66.35 3d4s h THR 1151Cb 0.38 1.46 -0.00 0.00 -1.74 0.00 0.00 68.15 68.25 3d4s h THR 1151CO 0.01 0.22 -0.43 0.74 0.37 0.00 0.00 175.52 176.43 3d4s h THR 1152N 0.00 1.27 -0.20 3.16 2.02 -1.01 -2.64 112.91 115.51 3d4s h THR 1152Ca -0.00 -1.61 -0.12 0.00 0.77 0.00 0.00 66.41 65.45 3d4s h THR 1152Cb 0.44 1.48 -0.01 0.00 -1.74 0.00 0.00 68.15 68.32 3d4s h THR 1152CO 0.03 0.53 -0.40 -0.26 0.37 0.00 0.00 175.52 175.79 3d4s h PHE 1153N 0.70 0.56 0.56 3.16 0.04 -0.97 -1.32 116.94 119.67 3d4s h PHE 1153Ca 0.04 -0.16 -0.02 0.00 2.80 0.00 0.00 57.97 60.63 3d4s h PHE 1153Cb 1.03 -0.12 -0.01 0.00 2.20 0.00 0.00 35.95 39.05 3d4s h PHE 1153CO 0.07 0.80 -0.40 0.00 -0.60 0.00 0.00 178.31 178.18 3d4s h ARG 1154N 0.39 -0.88 0.12 1.51 2.47 -0.98 -3.37 114.38 113.64 3d4s h ARG 1154Ca 0.04 0.06 -0.34 0.00 -1.26 0.00 0.00 59.98 58.47 3d4s h ARG 1154Cb 0.87 0.20 -0.01 0.00 -1.65 0.00 0.00 29.97 29.38 3d4s h ARG 1154CO 0.07 -0.59 -1.84 1.79 0.56 0.00 0.00 179.97 179.96 3d4s h THR 1155N -0.91 0.73 0.00 2.04 1.35 -1.59 -3.44 112.91 111.09 3d4s h THR 1155Ca -0.07 -2.36 0.00 0.00 -0.55 0.00 0.00 66.41 63.43 3d4s h THR 1155Cb 0.75 2.54 0.00 0.00 -1.73 0.00 0.00 68.15 69.71 3d4s h THR 1155CO 0.04 0.82 0.00 0.61 -0.25 0.00 0.00 175.52 176.74 3d4s n GLY 1156N 1.90 0.77 3.15 5.82 0.00 -0.50 -5.06 105.19 111.27 3d4s n GLY 1156Ca -0.30 -0.17 -0.28 0.00 0.00 0.00 0.00 46.02 45.26 3d4s n GLY 1156CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3d4s n THR 1157N -2.42 0.00 -1.54 2.61 -2.24 -1.26 -4.76 114.28 104.67 3d4s n THR 1157Ca 0.00 -2.08 -0.26 0.00 -2.27 0.00 0.00 64.05 59.44 3d4s n THR 1157Cb 0.00 0.41 0.09 0.00 -2.10 0.00 0.00 70.33 68.73 3d4s n THR 1157CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 3d4s n TRP 1158N -1.10 2.78 0.02 4.78 7.02 -1.26 -4.63 117.44 125.05 3d4s n TRP 1158Ca -0.18 -2.49 0.01 0.00 -1.02 0.00 0.00 57.50 53.82 3d4s n TRP 1158Cb 0.56 -0.95 0.33 0.00 -2.42 0.00 0.00 31.31 28.83 3d4s n TRP 1158CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 3d4s h ASP 1159N 1.81 0.44 0.49 -0.99 3.32 -1.95 -2.91 116.42 116.63 3d4s h ASP 1159Ca 0.49 -0.07 -0.13 0.00 0.02 0.00 0.00 57.03 57.33 3d4s h ASP 1159Cb 1.34 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.77 3d4s h ASP 1159CO 1.14 0.50 -0.60 0.00 -1.72 0.00 0.00 179.24 178.56 3d4s h ALA 1160N 1.56 0.94 -0.71 3.45 0.00 -1.88 -3.19 119.26 119.44 3d4s h ALA 1160Ca 0.10 -0.54 -0.19 0.00 0.00 0.00 0.00 54.91 54.28 3d4s h ALA 1160Cb 0.28 -0.09 -0.11 0.00 0.00 0.00 0.00 17.79 17.87 3d4s h ALA 1160CO 0.01 0.74 0.24 0.66 0.00 0.00 0.00 179.25 180.89 3d4s n TYR 1161N -3.85 2.39 -2.32 0.00 4.01 -1.11 -4.95 117.16 111.33 3d4s n TYR 1161Ca -0.02 -1.16 -0.42 0.00 -0.16 0.00 0.00 57.90 56.14 3d4s n TYR 1161Cb 0.61 -0.67 -0.03 0.00 -0.31 0.00 0.00 39.34 38.94 3d4s n TYR 1161CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 3d4s s LYS 263 N -2.98 4.29 -1.50 -0.72 1.02 -1.17 -3.53 119.74 115.14 3d4s s LYS 263 Ca 0.55 1.83 -0.13 0.00 0.02 0.00 0.00 55.97 58.25 3d4s s LYS 263 Cb 0.44 -3.63 0.07 0.00 -0.52 0.00 0.00 37.83 34.19 3d4s s LYS 263 CO 0.14 -0.58 1.00 1.19 -0.92 0.00 0.00 175.35 176.17 3d4s n PHE 264 N 5.67 -2.35 -0.10 3.18 3.01 -1.26 -4.89 117.46 120.72 3d4s n PHE 264 Ca 0.13 0.92 -0.10 0.00 1.01 0.00 0.00 57.45 59.40 3d4s n PHE 264 Cb 0.45 -4.12 -0.14 0.00 -0.01 0.00 0.00 39.48 35.65 3d4s n PHE 264 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3d4s s LEU 266 N -5.53 3.86 0.19 0.00 2.96 -1.26 -4.93 118.68 113.97 3d4s s LEU 266 Ca -0.13 1.92 -0.11 0.00 -0.22 0.00 0.00 54.13 55.59 3d4s s LEU 266 Cb 0.06 -4.55 0.20 0.00 0.50 0.00 0.00 46.19 42.40 3d4s s LEU 266 CO 0.74 -0.76 1.76 0.50 -1.32 0.00 0.00 176.35 177.27 3d4s h LYS 267 N 1.60 0.43 0.00 1.98 3.64 -2.00 -2.31 116.57 119.92 3d4s h LYS 267 Ca -0.49 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 58.78 3d4s h LYS 267 Cb 1.22 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.93 3d4s h LYS 267 CO 0.59 0.29 -0.39 0.93 -2.27 0.00 0.00 179.45 178.60 3d4s h GLU 268 N 0.45 0.00 -0.07 1.90 3.07 -1.99 -2.54 114.58 115.40 3d4s h GLU 268 Ca 0.26 0.00 -0.16 0.00 -0.50 0.00 0.00 59.36 58.96 3d4s h GLU 268 Cb 0.25 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.15 3d4s h GLU 268 CO -0.23 0.39 -0.66 0.45 -1.40 0.00 0.00 179.01 177.56 3d4s h HIS 269 N 0.00 0.38 -0.09 4.33 3.86 -1.81 -1.47 115.15 120.34 3d4s h HIS 269 Ca -0.00 -0.16 -0.14 0.00 -1.16 0.00 0.00 60.37 58.91 3d4s h HIS 269 Cb 0.77 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 29.17 3d4s h HIS 269 CO 0.00 0.86 -0.57 0.87 0.86 0.00 0.00 177.93 179.95 3d4s h LYS 270 N 0.20 0.29 -0.45 2.45 1.57 -1.24 -0.70 116.57 118.68 3d4s h LYS 270 Ca -0.01 -0.19 -0.11 0.00 -1.87 0.00 0.00 60.65 58.47 3d4s h LYS 270 Cb 1.19 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.51 3d4s h LYS 270 CO 0.11 0.78 -0.18 0.00 -0.57 0.00 0.00 179.45 179.59 3d4s h ALA 271 N 1.18 0.83 -0.31 3.86 0.00 -1.27 -1.21 119.26 122.36 3d4s h ALA 271 Ca -0.00 -0.36 -0.16 0.00 0.00 0.00 0.00 54.91 54.39 3d4s h ALA 271 Cb 1.06 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 3d4s h ALA 271 CO 0.09 0.65 -0.43 -0.07 0.00 0.00 0.00 179.25 179.49 3d4s h LEU 272 N 0.77 0.84 -0.68 0.00 3.38 -1.04 -2.69 115.31 115.89 3d4s h LEU 272 Ca 0.11 -0.39 -0.07 0.00 0.09 0.00 0.00 57.88 57.62 3d4s h LEU 272 Cb 0.71 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.20 3d4s h LEU 272 CO 0.05 1.15 0.15 0.50 0.09 0.00 0.00 178.44 180.38 3d4s h LYS 273 N 0.63 1.09 -0.19 1.13 3.64 -0.97 -1.14 116.57 120.76 3d4s h LYS 273 Ca 0.04 -0.27 0.01 0.00 -1.27 0.00 0.00 60.65 59.17 3d4s h LYS 273 Cb 0.99 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.66 3d4s h LYS 273 CO 0.09 0.98 0.09 1.15 -2.27 0.00 0.00 179.45 179.49 3d4s h THR 274 N 1.02 0.99 -0.18 1.00 2.02 -1.17 -0.49 112.91 116.10 3d4s h THR 274 Ca 0.21 -0.07 -0.02 0.00 0.77 0.00 0.00 66.41 67.31 3d4s h THR 274 Cb 0.39 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 67.56 3d4s h THR 274 CO 0.01 0.04 0.04 -0.07 0.37 0.00 0.00 175.52 175.90 3d4s h LEU 275 N 0.19 0.23 -0.66 2.58 3.38 -1.25 -1.61 115.31 118.17 3d4s h LEU 275 Ca 0.08 -0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.90 3d4s h LEU 275 Cb 0.03 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 3d4s h LEU 275 CO -0.06 0.24 -0.38 1.23 0.09 0.00 0.00 178.44 179.57 3d4s h GLY 276 N 0.44 0.68 1.32 0.83 0.00 -0.37 -2.50 103.07 103.47 3d4s h GLY 276 Ca 0.06 -0.66 -0.14 0.00 0.00 0.00 0.00 47.33 46.59 3d4s h GLY 276 CO -0.00 0.60 -0.36 -2.22 0.00 0.00 0.00 176.54 174.55 3d4s h ILE 277 N 0.52 1.28 -0.17 2.60 2.04 -0.29 0.71 117.51 124.21 3d4s h ILE 277 Ca 0.05 -1.53 0.00 0.00 1.00 0.00 0.00 64.86 64.38 3d4s h ILE 277 Cb 0.88 1.42 -0.01 0.00 -0.74 0.00 0.00 36.82 38.38 3d4s h ILE 277 CO 0.08 0.50 0.11 0.40 0.00 0.00 0.00 178.15 179.23 3d4s h ILE 278 N 0.62 1.05 -0.31 -0.67 1.08 -1.22 0.25 117.51 118.31 3d4s h ILE 278 Ca 0.06 -0.10 -0.05 0.00 -0.39 0.00 0.00 64.86 64.38 3d4s h ILE 278 Cb 0.91 0.82 -0.01 0.00 -3.07 0.00 0.00 36.82 35.46 3d4s h ILE 278 CO 0.08 0.05 0.01 0.24 -0.69 0.00 0.00 178.15 177.84 3d4s h MET 279 N 0.22 0.54 -0.70 2.37 2.86 -1.38 -2.63 114.93 116.22 3d4s h MET 279 Ca 0.06 -0.17 -0.02 0.00 -2.06 0.00 0.00 59.70 57.51 3d4s h MET 279 Cb -0.02 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.56 3d4s h MET 279 CO -0.01 0.67 0.34 0.78 1.06 0.00 0.00 176.91 179.75 3d4s h GLY 280 N 0.35 1.08 0.98 8.32 0.00 -0.74 -1.96 103.07 111.10 3d4s h GLY 280 Ca 0.09 -0.53 -0.06 0.00 0.00 0.00 0.00 47.33 46.83 3d4s h GLY 280 CO 0.01 0.50 0.06 -0.84 0.00 0.00 0.00 176.54 176.27 3d4s h THR 281 N 0.97 1.25 -0.92 4.70 2.02 -0.96 -1.41 112.91 118.56 3d4s h THR 281 Ca 0.24 -0.96 0.03 0.00 0.77 0.00 0.00 66.41 66.48 3d4s h THR 281 Cb 0.11 0.94 -0.05 0.00 -1.74 0.00 0.00 68.15 67.41 3d4s h THR 281 CO -0.03 0.34 0.60 0.15 0.37 0.00 0.00 175.52 176.95 3d4s h PHE 282 N 0.68 1.13 0.12 3.16 3.57 -1.27 -0.18 116.94 124.15 3d4s h PHE 282 Ca 0.14 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 3d4s h PHE 282 Cb 0.43 -0.38 0.00 0.00 2.79 0.00 0.00 35.95 38.79 3d4s h PHE 282 CO 0.03 0.67 -0.06 1.15 -2.23 0.00 0.00 178.31 177.88 3d4s h THR 283 N 1.19 1.03 -0.07 4.41 2.02 -1.14 -0.82 112.91 119.53 3d4s h THR 283 Ca 0.36 -0.63 -0.03 0.00 0.77 0.00 0.00 66.41 66.88 3d4s h THR 283 Cb -0.04 1.43 -0.01 0.00 -1.74 0.00 0.00 68.15 67.79 3d4s h THR 283 CO -0.11 0.15 -0.08 -0.07 0.37 0.00 0.00 175.52 175.79 3d4s h LEU 284 N -0.46 0.09 0.09 2.58 3.38 -1.02 0.95 115.31 120.91 3d4s h LEU 284 Ca -0.02 -0.01 -0.29 0.00 0.09 0.00 0.00 57.88 57.65 3d4s h LEU 284 Cb 0.37 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 3d4s h LEU 284 CO 0.03 0.19 -1.46 0.00 0.09 0.00 0.00 178.44 177.29 3d4s n TRP 286 N -3.40 0.00 -0.18 0.00 7.02 -0.32 -3.12 117.44 117.43 3d4s n TRP 286 Ca -0.14 0.00 -0.03 0.00 -1.02 0.00 0.00 57.50 56.31 3d4s n TRP 286 Cb 1.03 -0.88 0.07 0.00 -2.42 0.00 0.00 31.31 29.10 3d4s n TRP 286 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 3d4s h LEU 287 N 0.00 0.36 -1.41 -0.99 5.85 -0.99 -2.38 115.31 115.75 3d4s h LEU 287 Ca -0.46 0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.36 3d4s h LEU 287 Cb 2.03 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 42.99 3d4s h LEU 287 CO 0.02 0.24 0.46 -0.65 -0.34 0.00 0.00 178.44 178.18 3d4s h PRO 288 N 0.51 0.70 0.05 5.25 0.11 -1.80 0.10 132.00 136.92 3d4s h PRO 288 Ca 0.25 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.32 3d4s h PRO 288 Cb 0.19 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.14 3d4s h PRO 288 CO -0.19 0.46 -0.03 0.35 -0.21 0.00 0.00 178.00 178.39 3d4s h PHE 289 N 0.72 -0.07 -0.33 0.65 3.57 -1.69 -2.14 116.94 117.66 3d4s h PHE 289 Ca 0.30 -0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.70 3d4s h PHE 289 Cb 0.26 0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.00 3d4s h PHE 289 CO -0.00 0.19 -0.20 0.74 -2.23 0.00 0.00 178.31 176.81 3d4s h PHE 290 N -0.33 0.69 -0.08 0.41 -1.00 -1.10 -0.27 116.94 115.25 3d4s h PHE 290 Ca -0.01 -0.14 -0.00 0.00 2.81 0.00 0.00 57.97 60.63 3d4s h PHE 290 Cb 0.29 -0.17 -0.00 0.00 3.61 0.00 0.00 35.95 39.68 3d4s h PHE 290 CO 0.01 0.78 0.05 0.82 -1.61 0.00 0.00 178.31 178.36 3d4s h ILE 291 N 0.55 1.06 0.00 -0.55 2.04 -0.81 -2.32 117.51 117.48 3d4s h ILE 291 Ca 0.08 -0.15 -0.04 0.00 1.00 0.00 0.00 64.86 65.75 3d4s h ILE 291 Cb 0.65 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.74 3d4s h ILE 291 CO 0.05 0.05 -0.19 0.58 0.00 0.00 0.00 178.15 178.64 3d4s h VAL 292 N 0.07 1.03 -0.23 1.67 2.07 -1.24 -1.86 116.25 117.75 3d4s h VAL 292 Ca 0.03 -0.68 -0.04 0.00 0.82 0.00 0.00 66.70 66.84 3d4s h VAL 292 Cb 0.04 1.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 3d4s h VAL 292 CO -0.01 0.19 -0.00 -1.13 0.02 0.00 0.00 177.57 176.64 3d4s h ASN 293 N 0.00 0.40 0.32 0.57 -1.24 -0.60 -2.00 115.58 113.03 3d4s h ASN 293 Ca -0.00 -0.31 -0.18 0.00 0.71 0.00 0.00 56.30 56.52 3d4s h ASN 293 Cb 0.36 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 39.30 3d4s h ASN 293 CO 0.02 0.61 -0.72 0.40 -1.29 0.00 0.00 177.43 176.45 3d4s h ILE 294 N 0.17 1.40 -0.52 2.57 2.04 -1.28 -3.16 117.51 118.74 3d4s h ILE 294 Ca 0.06 -2.17 -0.04 0.00 1.00 0.00 0.00 64.86 63.72 3d4s h ILE 294 Cb 0.41 2.14 -0.02 0.00 -0.74 0.00 0.00 36.82 38.60 3d4s h ILE 294 CO 0.01 0.65 0.17 0.58 0.00 0.00 0.00 178.15 179.56 3d4s h VAL 295 N 0.23 1.20 0.00 1.67 2.07 -1.31 -2.16 116.25 117.95 3d4s h VAL 295 Ca -0.03 -0.68 -0.02 0.00 0.82 0.00 0.00 66.70 66.79 3d4s h VAL 295 Cb 1.29 0.63 -0.00 0.00 -1.52 0.00 0.00 31.29 31.68 3d4s h VAL 295 CO 0.12 0.26 -0.09 -0.74 0.02 0.00 0.00 177.57 177.14 3d4s h HIS 296 N 0.75 0.00 0.12 1.57 -0.00 -1.33 -2.16 115.15 114.10 3d4s h HIS 296 Ca 0.17 0.00 -0.27 0.00 -0.00 0.00 0.00 60.37 60.27 3d4s h HIS 296 Cb 0.21 0.00 0.03 0.00 -0.00 0.00 0.00 27.41 27.65 3d4s h HIS 296 CO 0.01 0.09 -1.15 0.28 -0.00 0.00 0.00 177.93 177.16 3d4s h VAL 297 N 0.00 1.32 0.60 5.26 2.07 -1.37 -3.11 116.25 121.03 3d4s h VAL 297 Ca -0.00 -2.45 -0.03 0.00 0.82 0.00 0.00 66.70 65.04 3d4s h VAL 297 Cb 0.63 2.78 0.01 0.00 -1.52 0.00 0.00 31.29 33.18 3d4s h VAL 297 CO 0.01 0.73 -0.29 0.40 0.02 0.00 0.00 177.57 178.45 3d4s h ILE 298 N 0.15 0.00 -3.79 4.57 1.08 -1.38 -3.41 117.51 114.72 3d4s h ILE 298 Ca -0.18 -0.28 -0.66 0.00 -0.39 0.00 0.00 64.86 63.36 3d4s h ILE 298 Cb 1.84 0.00 -0.38 0.00 -3.07 0.00 0.00 36.82 35.22 3d4s h ILE 298 CO 0.22 0.00 -0.78 -1.10 -0.69 0.00 0.00 178.15 175.80 3d4s s GLN 299 N -4.27 2.00 -0.07 2.37 -0.21 -0.82 -5.01 119.66 113.64 3d4s s GLN 299 Ca -0.12 -1.37 0.03 0.00 0.02 0.00 0.00 55.36 53.92 3d4s s GLN 299 Cb 0.01 -2.88 0.18 0.00 1.00 0.00 0.00 33.01 31.32 3d4s s GLN 299 CO 0.35 -0.64 0.90 -0.40 -2.12 0.00 0.00 175.29 173.39 3d4s n ASP 300 N 4.45 2.38 -0.99 5.90 5.75 -1.17 -3.75 116.55 129.12 3d4s n ASP 300 Ca -0.11 -2.25 0.03 0.00 -0.01 0.00 0.00 54.79 52.45 3d4s n ASP 300 Cb 0.42 -0.55 0.03 0.00 -1.03 0.00 0.00 41.12 39.99 3d4s n ASP 300 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 3d4s n ASN 301 N 0.14 0.73 -0.10 -1.12 6.94 -1.26 -4.89 115.26 115.69 3d4s n ASN 301 Ca 0.08 -2.18 -0.19 0.00 -0.02 0.00 0.00 54.58 52.28 3d4s n ASN 301 Cb 0.55 -0.28 -0.08 0.00 -2.36 0.00 0.00 39.78 37.61 3d4s n ASN 301 CO 0.00 0.00 0.00 -0.11 -1.03 0.00 0.00 177.26 176.12 3d4s n LEU 302 N 0.11 2.05 -4.83 -4.53 7.94 -1.25 -5.00 117.00 111.50 3d4s n LEU 302 Ca 0.05 0.11 -0.35 0.00 -1.11 0.00 0.00 56.01 54.72 3d4s n LEU 302 Cb 0.92 -0.64 -0.07 0.00 0.53 0.00 0.00 43.42 44.17 3d4s n LEU 302 CO -0.02 0.59 -0.21 0.27 -1.11 0.00 0.00 177.39 176.90 3d4s s ILE 303 N -2.38 5.08 0.67 1.96 -5.25 -1.26 -5.12 121.20 114.90 3d4s s ILE 303 Ca -0.28 -0.13 -0.02 0.00 -0.99 0.00 0.00 60.65 59.23 3d4s s ILE 303 Cb 0.09 -3.28 0.14 0.00 2.95 0.00 0.00 42.46 42.36 3d4s s ILE 303 CO 0.40 0.47 0.92 0.54 -1.79 0.00 0.00 174.94 175.47 3d4s n ARG 304 N 1.52 -0.18 -0.00 0.37 1.74 -1.26 -4.99 116.66 113.86 3d4s n ARG 304 Ca -0.16 -2.32 -0.17 0.00 -0.77 0.00 0.00 57.85 54.44 3d4s n ARG 304 Cb 0.54 -0.67 -0.11 0.00 -1.02 0.00 0.00 32.46 31.20 3d4s n ARG 304 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 3d4s h LYS 305 N 0.00 0.40 -0.48 5.56 3.64 -1.99 -2.93 116.57 120.76 3d4s h LYS 305 Ca -0.30 -0.42 -0.03 0.00 -1.27 0.00 0.00 60.65 58.63 3d4s h LYS 305 Cb 1.07 0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.99 3d4s h LYS 305 CO 0.31 1.08 0.17 1.49 -2.27 0.00 0.00 179.45 180.23 3d4s h GLU 306 N -0.12 0.70 -0.19 1.90 4.57 -1.99 -1.42 114.58 118.03 3d4s h GLU 306 Ca -0.07 -0.11 -0.18 0.00 -1.18 0.00 0.00 59.36 57.82 3d4s h GLU 306 Cb 1.28 -0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 29.74 3d4s h GLU 306 CO 0.11 0.59 -0.62 0.28 -1.18 0.00 0.00 179.01 178.19 3d4s h VAL 307 N 0.69 1.31 -0.43 0.32 2.07 -1.97 -2.13 116.25 116.10 3d4s h VAL 307 Ca 0.16 -1.87 -0.07 0.00 0.82 0.00 0.00 66.70 65.74 3d4s h VAL 307 Cb 0.17 1.84 -0.02 0.00 -1.52 0.00 0.00 31.29 31.76 3d4s h VAL 307 CO -0.01 0.59 -0.01 0.22 0.02 0.00 0.00 177.57 178.38 3d4s h TYR 308 N 0.48 0.85 -0.29 1.57 5.03 -1.25 -2.74 116.97 120.61 3d4s h TYR 308 Ca -0.01 -0.15 -0.19 0.00 2.58 0.00 0.00 58.73 60.96 3d4s h TYR 308 Cb 1.20 -0.22 0.00 0.00 1.55 0.00 0.00 36.73 39.26 3d4s h TYR 308 CO 0.06 0.84 -0.55 0.82 -1.32 0.00 0.00 178.16 178.01 3d4s h ILE 309 N 0.61 1.27 -0.47 1.81 2.04 -1.31 -2.92 117.51 118.55 3d4s h ILE 309 Ca 0.12 -1.73 0.01 0.00 1.00 0.00 0.00 64.86 64.26 3d4s h ILE 309 Cb 0.50 1.62 -0.03 0.00 -0.74 0.00 0.00 36.82 38.18 3d4s h ILE 309 CO 0.02 0.57 0.30 0.25 0.00 0.00 0.00 178.15 179.29 3d4s h LEU 310 N 0.67 0.51 -1.30 1.44 5.85 -1.37 -2.09 115.31 119.03 3d4s h LEU 310 Ca 0.01 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 3d4s h LEU 310 Cb 1.16 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.06 3d4s h LEU 310 CO 0.12 0.37 -0.20 -0.07 -0.34 0.00 0.00 178.44 178.33 3d4s h LEU 311 N 0.61 0.00 -0.50 2.25 3.38 -1.54 -2.61 115.31 116.90 3d4s h LEU 311 Ca 0.18 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.98 3d4s h LEU 311 Cb -0.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 3d4s h LEU 311 CO -0.05 0.20 -0.67 -1.13 0.09 0.00 0.00 178.44 176.87 3d4s h ASN 312 N 0.00 0.40 1.55 -0.43 -0.00 -1.22 -3.02 115.58 112.86 3d4s h ASN 312 Ca -0.00 -0.25 -0.04 0.00 -0.00 0.00 0.00 56.30 56.01 3d4s h ASN 312 Cb 0.65 -0.12 -0.01 0.00 -0.00 0.00 0.00 38.32 38.85 3d4s h ASN 312 CO 0.03 0.96 -0.19 -0.50 -0.00 0.00 0.00 177.43 177.72 3d4s h TRP 313 N 0.24 0.00 -0.03 0.67 4.06 -1.04 -0.44 115.95 119.42 3d4s h TRP 313 Ca -0.02 0.00 -0.13 0.00 2.06 0.00 0.00 58.89 60.80 3d4s h TRP 313 Cb 1.22 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.37 3d4s h TRP 313 CO 0.03 0.19 -0.59 0.82 -3.56 0.00 0.00 178.44 175.34 3d4s h ILE 314 N 0.00 1.41 -0.03 1.49 2.04 -1.44 -0.72 117.51 120.26 3d4s h ILE 314 Ca -0.00 -1.99 -0.24 0.00 1.00 0.00 0.00 64.86 63.62 3d4s h ILE 314 Cb 1.02 2.05 0.01 0.00 -0.74 0.00 0.00 36.82 39.15 3d4s h ILE 314 CO 0.02 0.58 -0.95 1.23 0.00 0.00 0.00 178.15 179.03 3d4s h GLY 315 N 1.65 0.67 1.73 5.37 0.00 -1.35 -3.22 103.07 107.92 3d4s h GLY 315 Ca -0.01 -1.13 -0.11 0.00 0.00 0.00 0.00 47.33 46.09 3d4s h GLY 315 CO 0.08 1.00 -0.41 -0.97 0.00 0.00 0.00 176.54 176.24 3d4s h TYR 316 N 0.36 0.36 0.00 5.60 0.99 -0.81 -2.90 116.97 120.56 3d4s h TYR 316 Ca -0.10 -0.10 0.00 0.00 2.00 0.00 0.00 58.73 60.54 3d4s h TYR 316 Cb 1.59 -0.08 0.00 0.00 1.00 0.00 0.00 36.73 39.24 3d4s h TYR 316 CO 0.08 0.67 0.00 1.55 -0.00 0.00 0.00 178.16 180.46 3d4s n VAL 317 N -4.03 0.51 0.24 -2.88 3.14 -0.30 -2.89 118.33 112.12 3d4s n VAL 317 Ca -0.01 0.07 0.12 0.00 -2.96 0.00 0.00 64.34 61.55 3d4s n VAL 317 Cb 0.48 -0.75 0.54 0.00 -1.06 0.00 0.00 33.84 33.05 3d4s n VAL 317 CO 0.00 0.00 0.00 -1.13 -6.46 0.00 0.00 176.83 169.24 3d4s h ASN 318 N 0.00 0.00 0.43 6.55 -1.24 -1.51 -3.03 115.58 116.77 3d4s h ASN 318 Ca 0.00 0.00 -0.05 0.00 0.71 0.00 0.00 56.30 56.96 3d4s h ASN 318 Cb 0.44 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.48 3d4s h ASN 318 CO 0.00 0.17 -0.22 0.28 -1.29 0.00 0.00 177.43 176.37 3d4s h SER 319 N 0.00 0.00 0.08 1.15 0.02 -1.68 -2.73 113.55 110.39 3d4s h SER 319 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3d4s h SER 319 Cb 0.65 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.19 3d4s h SER 319 CO 0.02 0.22 -0.20 0.61 -1.14 0.00 0.00 176.83 176.34 3d4s n GLY 320 N -0.54 -0.09 0.12 -3.77 0.00 -1.14 -4.46 105.19 95.31 3d4s n GLY 320 Ca -0.02 -0.51 -0.20 0.00 0.00 0.00 0.00 46.02 45.30 3d4s n GLY 320 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3d4s h PHE 321 N 2.26 0.59 -0.80 1.61 -1.00 -1.57 -3.40 116.94 114.63 3d4s h PHE 321 Ca 0.00 -0.41 0.14 0.00 2.81 0.00 0.00 57.97 60.52 3d4s h PHE 321 Cb 0.63 -0.03 -0.14 0.00 3.61 0.00 0.00 35.95 40.01 3d4s h PHE 321 CO 0.00 1.30 -0.30 -0.91 -1.61 0.00 0.00 178.31 176.79 3d4s h ASN 322 N -0.28 -1.08 -0.94 2.17 2.35 -1.78 -1.81 115.58 114.20 3d4s h ASN 322 Ca -0.14 0.26 0.12 0.00 -0.55 0.00 0.00 56.30 55.99 3d4s h ASN 322 Cb 1.61 0.60 -0.07 0.00 0.05 0.00 0.00 38.32 40.51 3d4s h ASN 322 CO 0.15 -0.29 0.60 -0.65 -1.65 0.00 0.00 177.43 175.60 3d4s h PRO 323 N -0.06 0.87 -0.31 0.81 0.11 -1.86 0.12 132.00 131.68 3d4s h PRO 323 Ca 0.33 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 66.28 3d4s h PRO 323 Cb 0.59 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.49 3d4s h PRO 323 CO -0.83 0.58 -0.26 -0.07 -0.21 0.00 0.00 178.00 177.21 3d4s h LEU 324 N 0.90 0.62 -0.79 2.35 3.38 -1.58 -2.67 115.31 117.52 3d4s h LEU 324 Ca 0.46 -0.23 -0.10 0.00 0.09 0.00 0.00 57.88 58.10 3d4s h LEU 324 Cb 0.50 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 3d4s h LEU 324 CO -0.22 0.86 -0.49 0.40 0.09 0.00 0.00 178.44 179.08 3d4s h ILE 325 N 0.54 1.12 0.00 1.22 2.04 -0.75 -3.01 117.51 118.66 3d4s h ILE 325 Ca 0.07 -1.84 0.00 0.00 1.00 0.00 0.00 64.86 64.09 3d4s h ILE 325 Cb 0.73 2.07 0.00 0.00 -0.74 0.00 0.00 36.82 38.87 3d4s h ILE 325 CO 0.06 0.48 0.00 -1.22 0.00 0.00 0.00 178.15 177.47 3d4s n TYR 326 N -3.61 0.52 0.25 1.37 0.53 0.27 -2.66 117.16 113.84 3d4s n TYR 326 Ca -0.00 0.20 0.08 0.00 -1.02 0.00 0.00 57.90 57.16 3d4s n TYR 326 Cb 0.58 -0.82 0.64 0.00 -1.03 0.00 0.00 39.34 38.70 3d4s n TYR 326 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 3d4s h ARG 328 N 0.00 0.39 -6.28 0.00 3.08 -1.73 -3.41 114.38 106.43 3d4s h ARG 328 Ca -0.00 -0.02 -0.55 0.00 0.07 0.00 0.00 59.98 59.48 3d4s h ARG 328 Cb 0.11 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 3d4s h ARG 328 CO 0.01 0.26 0.97 0.45 -1.07 0.00 0.00 179.97 180.59 3d4s s SER 329 N -5.35 6.77 0.50 7.04 0.15 -0.94 -4.92 113.70 116.95 3d4s s SER 329 Ca -0.13 2.11 0.15 0.00 0.70 0.00 0.00 55.95 58.78 3d4s s SER 329 Cb 0.19 -2.54 1.21 0.00 -1.71 0.00 0.00 66.02 63.17 3d4s s SER 329 CO 0.75 -0.83 2.12 -0.65 1.20 0.00 0.00 173.24 175.84 3d4s h PRO 330 N 8.69 0.09 -0.40 5.44 0.11 -1.86 -2.32 132.00 141.75 3d4s h PRO 330 Ca -0.36 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 65.60 3d4s h PRO 330 Cb 1.16 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 3d4s h PRO 330 CO 0.94 0.06 -0.29 -0.44 -0.21 0.00 0.00 178.00 178.06 3d4s h ASP 331 N 0.09 0.91 0.17 -2.05 5.19 -1.93 -3.04 116.42 115.76 3d4s h ASP 331 Ca 0.04 -0.37 -0.21 0.00 -0.62 0.00 0.00 57.03 55.87 3d4s h ASP 331 Cb 0.06 -0.25 0.00 0.00 0.18 0.00 0.00 39.33 39.32 3d4s h ASP 331 CO -0.01 1.13 -0.84 -0.26 -3.12 0.00 0.00 179.24 176.15 3d4s h PHE 332 N 0.74 0.73 -0.06 4.55 -1.00 -1.68 -2.81 116.94 117.41 3d4s h PHE 332 Ca 0.08 -0.35 0.02 0.00 2.81 0.00 0.00 57.97 60.53 3d4s h PHE 332 Cb 0.85 -0.10 -0.02 0.00 3.61 0.00 0.00 35.95 40.29 3d4s h PHE 332 CO 0.05 1.15 -0.06 0.00 -1.61 0.00 0.00 178.31 177.85 3d4s h ARG 333 N 0.33 -0.07 -0.62 1.51 3.08 -1.46 0.12 114.38 117.26 3d4s h ARG 333 Ca -0.06 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.04 3d4s h ARG 333 Cb 1.45 0.02 -0.05 0.00 0.08 0.00 0.00 29.97 31.47 3d4s h ARG 333 CO 0.15 -0.05 0.35 0.82 -1.07 0.00 0.00 179.97 180.18 3d4s h ILE 334 N -0.07 0.99 -0.62 2.04 2.04 -1.61 -2.15 117.51 118.13 3d4s h ILE 334 Ca 0.04 -0.23 -0.07 0.00 1.00 0.00 0.00 64.86 65.60 3d4s h ILE 334 Cb 0.14 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.46 3d4s h ILE 334 CO -0.10 0.12 0.10 0.00 0.00 0.00 0.00 178.15 178.26 3d4s h ALA 335 N 1.31 0.82 0.27 1.87 0.00 -1.19 -2.76 119.26 119.59 3d4s h ALA 335 Ca 0.27 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3d4s h ALA 335 Cb 0.13 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.69 3d4s h ALA 335 CO -0.16 0.58 -0.13 0.74 0.00 0.00 0.00 179.25 180.29 3d4s h PHE 336 N 0.93 -0.34 0.00 0.00 0.04 -0.45 -2.44 116.94 114.68 3d4s h PHE 336 Ca 0.19 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.95 3d4s h PHE 336 Cb 0.43 0.11 0.00 0.00 2.20 0.00 0.00 35.95 38.70 3d4s h PHE 336 CO 0.03 -0.01 0.00 0.00 -0.60 0.00 0.00 178.31 177.73 3d4s n GLN 337 N -5.11 0.08 -0.01 1.51 10.64 -0.84 -1.20 117.38 122.45 3d4s n GLN 337 Ca -0.09 0.26 -0.20 0.00 -1.83 0.00 0.00 57.00 55.13 3d4s n GLN 337 Cb 0.25 -1.50 -0.14 0.00 -0.86 0.00 0.00 30.24 27.99 3d4s n GLN 337 CO 0.00 0.00 0.00 -1.91 -1.83 0.00 0.00 177.06 173.32 3d4s n GLU 338 N -1.38 0.74 0.14 2.61 0.00 -1.04 -0.86 120.64 120.85 3d4s n GLU 338 Ca 0.04 0.25 0.00 0.00 0.00 0.00 0.00 57.16 57.45 3d4s n GLU 338 Cb 0.09 -1.69 0.19 0.00 0.00 0.00 0.00 31.44 30.03 3d4s n GLU 338 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.13 177.06 3d4s h LEU 339 N 0.06 0.00 -0.27 4.31 3.38 -0.83 -2.81 115.31 119.15 3d4s h LEU 339 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 3d4s h LEU 339 Cb 2.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.77 3d4s h LEU 339 CO 0.07 0.58 -0.18 0.18 0.09 0.00 0.00 178.44 179.19 3d4s n LEU 340 N -3.72 0.60 -3.26 1.67 4.77 -0.34 -4.97 117.00 111.75 3d4s n LEU 340 Ca -0.01 -0.04 -0.12 0.00 -0.03 0.00 0.00 56.01 55.81 3d4s n LEU 340 Cb 0.61 -0.19 0.04 0.00 -2.33 0.00 0.00 43.42 41.55 3d4s n LEU 340 CO 0.41 0.11 0.12 0.00 -1.33 0.00 0.00 177.39 176.70