Table 1 Parameters for fitting cubic equation (y = b0+ b1x + b2x2+ b3x3) to relate ASA (y) to the partner number, PN (x) for different residues.
Residuea | ASA (Å2) | Whole residue | Side chain | ||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
Gly-X-Glyb | b0 | b1 | b2 | b3 | R2 | b0 | b1 | b2 | b3 | R2 | |
Gly 6245 | 83.9 | 84.4 4.40 | -3.4 2.31 | -1.1 0.33 | 0.07 0.01 | 0.991 | |||||
Ala 6688 | 116.4 (55.4) | 130.5 6.53 | -9.2 3.42 | -0.9 0.49 | 0.07 0.02 | 0.990 | 62.3 2.86 | -15.9 3.30 | 0.4 1.00 | 0.08 0.08 | 0.989 |
Ser 4614 | 125.7 (69.1) | 140.0 3.89 | -12.6 2.04 | -0.5 0.29 | 0.05 0.01 | 0.997 | 74.3 2.14 | -17.6 1.95 | 0.9 0.47 | 0.01 0.03 | 0.994 |
Cys 1367 | 141.5 (82.1) | 65.6 12.37 | 3.4 4.79 | -1.5 0.55 | 0.06 0.02 | 0.982 | 65.6 2.62 | -11.3 2.39 | -0.3 0.57 | 0.08 0.04 | 0.990 |
Thr 4724 | 148.1 (88.6) | 156.7 4.17 | -10.5 2.06 | -0.9 0.28 | 0.06 0.01 | 0.997 | 101.7 2.65 | -19.1 1.99 | 0.7 0.40 | 0.02 0.02 | 0.994 |
Asp 4463 | 155.4 (97.8) | 170.9 4.02 | -15.4 1.78 | -0.1 0.22 | 0.03 0.01 | 0.997 | 107.6 1.34 | -18.2 1.10 | 0.3 0.24 | 0.04 0.01 | 0.999 |
Pro 3701 | 144.8 (106.4) | 147.2 4.16 | -6.5 2.06 | -1.3 0.28 | 0.08 0.01 | 0.997 | 103.7 2.70 | -10.8 2.03 | -0.9 0.40 | 0.09 0.02 | 0.995 |
Asn 3537 | 168.9 (109.9) | 173.0 4.49 | -11.8 2.10 | -0.7 0.27 | 0.05 0.01 | 0.997 | 116.9 2.24 | -20.4 1.55 | 0.7 0.28 | 0.01 0.01 | 0.997 |
Val 5619 | 162.2 (103.1) | 167.8 7.37 | -15.1 3.05 | -0.4 0.36 | 0.04 0.01 | 0.995 | 111.8 2.51 | -21.6 2.07 | 0.7 0.45 | 0.04 0.03 | 0.996 |
Glu 3843 | 187.2 (132.5) | 190.8 4.47 | -9.7 1.77 | -1.0 0.20 | 0.05 0.01 | 0.999 | 134.1 0.79 | -19.4 0.65 | -0.0 0.14 | 0.06 0.01 | 1.000 |
Gln 2645 | 189.2 (129.7) | 231.8 9.56 | -21.9 3.78 | 0.2 0.42 | 0.02 0.02 | 0.995 | 139.0 2.27 | -20.5 1.57 | 0.3 0.29 | 0.03 0.02 | 0.998 |
His 1789 | 198.5 (141.3) | 209.9 3.31 | -15.9 1.47 | -0.4 0.18 | 0.04 0.01 | 0.999 | 147.5 1.88 | -21.9 1.41 | 0.3 0.28 | 0.04 0.02 | 0.999 |
Leu 6575 | 198.0 (141.5) | 233.2 12.42 | -26.7 4.91 | 0.6 0.55 | 0.01 0.02 | 0.990 | 151.2 4.90 | -31.7 2.92 | 1.9 0.48 | -0.03 0.02 | 0.995 |
Ile 4362 | 190.0 (130.7) | 214.5 5.24 | -22.6 2.17 | 0.2 0.26 | 0.03 0.01 | 0.998 | 140.0 3.39 | -26.2 2.35 | 1.1 0.43 | 0.01 0.02 | 0.995 |
Met 1533 | 210.6 (150.4) | 223.0 5.88 | -15.7 2.61 | -0.8 0.31 | 0.05 0.01 | 0.996 | 151.7 3.20 | -26.1 2.22 | 0.8 0.41 | 0.02 0.02 | 0.996 |
Lys 3861 | 207.5 (148.0) | 231.0 8.66 | -15.3 3.42 | -0.4 0.38 | 0.03 0.01 | 0.996 | 157.6 1.37 | -20.6 0.95 | 0.3 0.17 | 0.03 0.01 | 0.999 |
Phe 3225 | 223.3 (164.2) | 210.3 7.59 | -11.4 3.20 | -1.0 0.37 | 0.06 0.01 | 0.993 | 173.5 3.14 | -27.0 2.01 | 0.8 0.34 | 0.02 0.02 | 0.997 |
Tyr 2927 | 238.3 (180.0) | 220.1 8.06 | -10.0 3.40 | -1.2 0.39 | 0.06 0.01 | 0.992 | 174.0 4.67 | -21.7 2.79 | 0.1 0.44 | 0.04 0.02 | 0.993 |
Arg 3024 | 249.3 (190.2) | 274.3 5.26 | -21.1 1.76 | 0.1 0.17 | 0.02 0.01 | 0.998 | 193.6 2.05 | -26.8 1.08 | 0.9 0.15 | 0.03 0.01 | 0.999 |
Trp 1230 | 265.4 (209.6) | 265.8 10.60 | -20.5 3.25 | -0.1 0.29 | 0.02 0.01 | 0.996 | 225.6 2.84 | -34.2 1.49 | 1.5 0.21 | -0.01 0.01 | 0.998 |