A0A3Q0KBF0_SCHMA Loading...

Putative g-protein coupled receptor

AlphaFold DB , UniProt , Accession A0A3Q0KBF0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 521 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.9	Very low	36.5	Very low	244 Å²	244	159.5 Å²	159.5	100%	1.202	81%	0.814	S	S	*	*				0	121	0	-79.6	168.8	171.3	0	0	107.5
2	N	36.2	Very low	36.7	Very low	154 Å²	154	160.8 Å²	160.8	82%	0.824	82%	0.815	S	S	*	*			trans	60.3	69.6	177.3	-63.8	1.7	0	0	0	119.2
3	F	35.9	Very low	37.4	Very low	225 Å²	225	163.3 Å²	163.3	99%	0.987	82%	0.818	S	S	*	*			trans	-87.1	86.7	150.8	-107.4	-90.5	0	0	0	108.1
4	S	37.1	Very low	37.9	Very low	83 Å²	83	162.8 Å²	162.8	58%	0.58	82%	0.819	S	S	*	*			trans	-161.7	88.4	173.9	53.9	0	0	0	0	108.9
5	N	36.3	Very low	39.4	Very low	155 Å²	155	162.9 Å²	162.9	83%	0.829	82%	0.816	S	S	*	*			trans	-175.6	51.5	158.7	-89.6	-13.3	0	0	0	109.9	T7	N5-T7 VanDerWaalsContact C-N 3.25Å; N5-T7 PolarHBondContact O-N 2.96Å
6	L	34.6	Very low	41.5	Very low	162 Å²	162	160.1 Å²	160.1	85%	0.848	82%	0.816	S	S	*	*			trans	-93.7	65.1	162.4	-160.2	82.2	0	0	0	108	I8	L6-I8 VanDerWaalsContact C-N 3.31Å; L6-I8 PolarHBondContact O-N 3.45Å; L6-I8 VanDerWaalsContact O-N 3.08Å
7	T	36.3	Very low	43.8	Very low	116 Å²	116	156.2 Å²	156.2	71%	0.712	80%	0.796	S	S	*	*			trans	-75.8	90.8	168.7	-6.2	0	0	0	0	106.8	N5 Q9	N5-T7 VanDerWaalsContact C-N 3.25Å; N5-T7 PolarHBondContact O-N 2.96Å; T7-Q9 VanDerWaalsContact C-N 3.3Å; T7-Q9 PolarHBondContact O-N 3.3Å
8	I	38.7	Very low	46.3	Very low	130 Å²	130	152.1 Å²	152.1	67%	0.667	78%	0.776	S	S	*	*			trans	-59.3	99.4	160	-65.6	170.9	0	0	0	105.6	L6 L10	L6-I8 VanDerWaalsContact C-N 3.31Å; L6-I8 PolarHBondContact O-N 3.45Å; L6-I8 VanDerWaalsContact O-N 3.08Å; I8-L10 VanDerWaalsContact C-N 3.26Å; I8-L10 HydrophobicContact CG2-CG 4.36Å; I8-L10 PolarHBondContact O-N 3.35Å
9	Q	36.4	Very low	48.8	Very low	166 Å²	166	148.9 Å²	148.9	78%	0.776	77%	0.767	S	S	*	*			trans	-65.8	95.4	160.9	-83.8	-174.5	-36.3	0	0	106.8	T7 F11	T7-Q9 VanDerWaalsContact C-N 3.3Å; T7-Q9 PolarHBondContact O-N 3.3Å; Q9-F11 PolarHBondContact O-N 3.38Å
10	L	34	Very low	51	Low	160 Å²	160	144.8 Å²	144.8	84%	0.838	75%	0.745	S	S	*	*			trans	-61.4	87.9	154.1	-86	154.2	0	0	0	106.6	I8 E12	I8-L10 VanDerWaalsContact C-N 3.26Å; I8-L10 HydrophobicContact CG2-CG 4.36Å; I8-L10 PolarHBondContact O-N 3.35Å; L10-E12 PolarHBondContact O-N 3Å
11	F	38.9	Very low	53.1	Low	159 Å²	159	140 Å²	140	70%	0.697	72%	0.718	S	S	*	*			trans	-58.7	126.9	169.4	-141.2	-96.2	0	0	0	107.8	Q9 F13	Q9-F11 PolarHBondContact O-N 3.38Å; F11-F13 PolarHBondContact O-N 3.43Å; F11-F13 VanDerWaalsContact O-N 3.1Å
12	E	39.5	Very low	55.9	Low	175 Å²	175	132.1 Å²	132.1	82%	0.818	68%	0.68	S	S	*	*			trans	-50.7	113.6	177.3	-73.7	174	133.7	0	0	110.6	L10 N14	L10-E12 PolarHBondContact O-N 3Å; E12-N14 PolarHBondContact O-N 3.48Å
13	F	45.2	Very low	58.8	Low	194 Å²	194	127.2 Å²	127.2	85%	0.851	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	48.8	-179.6	-143.4	-87	0	0	0	111.5	F11	F11-F13 PolarHBondContact O-N 3.43Å; F11-F13 VanDerWaalsContact O-N 3.1Å
14	N	44.4	Very low	61.7	Low	156 Å²	156	116.5 Å²	116.5	83%	0.834	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.4	11.2	-176.8	-141.2	22.8	0	0	0	114.8	E12	E12-N14 PolarHBondContact O-N 3.48Å
15	E	60.1	Low	64.5	Low	165 Å²	165	113.2 Å²	113.2	77%	0.771	59%	0.587	S	S	*	*	S	Bend	trans	-92.3	128	163.3	-82.1	-175.6	145.8	0	0	110	I17	E15-I17 PolarHBondContact O-N 3.43Å; E15-I17 VanDerWaalsContact O-N 3.16Å
16	S	74	Confident	67.5	Low	117 Å²	117	111 Å²	111	82%	0.818	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-56.5	119.6	173.7	54.8	0	0	0	0	109.9	D18	S16-D18 PolarHBondContact O-N 3.18Å
17	I	80.2	Confident	70.5	Confident	95 Å²	95	104.4 Å²	104.4	49%	0.487	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-50.2	125	175.3	-61.5	172.2	0	0	0	109.1	E15 P19 W21 L22	E15-I17 PolarHBondContact O-N 3.43Å; E15-I17 VanDerWaalsContact O-N 3.16Å; I17-P19 WeakPolarHBondContact O-CD 3.4Å; I17-P19 VanDerWaalsContact O-N 3.12Å; I17-W21 HydrophobicContact CG2-CE3 3.84Å; I17-W21 HydrophobicContact CG2-CZ3 3.95Å; I17-L22 HydrophobicContact CG2-CB 4.07Å
18	D	89.2	Confident	73.4	Confident	82 Å²	82	98.9 Å²	98.9	44%	0.439	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-58.3	116.8	176.6	177	0.1	0	0	0	109.6	S16 I20 W21 L22	S16-D18 PolarHBondContact O-N 3.18Å; D18-I20 PolarHBondContact O-N 2.8Å; D18-I20 WeakPolarHBondContact OD1-CB 3.33Å; D18-I20 PolarHBondContact OD1-N 3.46Å; D18-W21 HydrophobicContact CB-CB 4.02Å; D18-W21 PolarHBondContact O-N 3.49Å; D18-L22 PolarHBondContact O-N 3.38Å
19	P	93.3	Very high	76.3	Confident	91 Å²	91	94.1 Å²	94.1	59%	0.591	49%	0.488	S	S	*	.	H	α-helix	trans	-61.7	-27.4	-178.5	25.2	-35.1	0	0	0	112.8	I17 S23	I17-P19 WeakPolarHBondContact O-CD 3.4Å; I17-P19 VanDerWaalsContact O-N 3.12Å; P19-S23 VanDerWaalsContact O-CB 3.26Å; P19-S23 WeakPolarHBondContact O-CB 3.33Å; P19-S23 PolarHBondContact O-N 3.47Å; P19-S23 PolarHBondContact O-OG 3.3Å
20	I	93.5	Very high	79.2	Confident	66 Å²	66	88 Å²	88	34%	0.338	46%	0.464	S	S	.	.	H	α-helix	trans	-71.6	-44.4	178.3	-60.2	176.4	0	0	0	110	D18 S23 T24 L409 L410	D18-I20 PolarHBondContact O-N 2.8Å; D18-I20 WeakPolarHBondContact OD1-CB 3.33Å; D18-I20 PolarHBondContact OD1-N 3.46Å; I20-S23 PolarHBondContact O-N 3.24Å; I20-T24 PolarHBondContact O-N 3.32Å; I20-T24 PolarHBondContact O-OG1 3.01Å; I20-L409 HydrophobicContact CG2-CB 4.26Å; I20-L410 HydrophobicContact CG2-CB 4.04Å
21	W	94.6	Very high	82.2	Confident	46 Å²	46	80.4 Å²	80.4	17%	0.174	42%	0.424	C	S	.	.	H	α-helix	trans	-61.1	-48.8	175.3	176.9	82.3	0	0	0	111.1	I17 D18 S23 T24 L25 E139 Y140 H142	I17-W21 HydrophobicContact CG2-CE3 3.84Å; I17-W21 HydrophobicContact CG2-CZ3 3.95Å; D18-W21 HydrophobicContact CB-CB 4.02Å; D18-W21 PolarHBondContact O-N 3.49Å; W21-S23 VanDerWaalsContact C-N 3.33Å; W21-S23 PolarHBondContact O-N 3.44Å; W21-T24 WeakPolarHBondContact O-CB 3.18Å; W21-T24 PolarHBondContact O-N 2.95Å; W21-L25 HydrophobicContact CD2-CD1 4.13Å; W21-L25 HydrophobicContact CE3-CD1 4.19Å; W21-L25 HydrophobicContact CH2-CD1 3.57Å; W21-L25 HydrophobicContact CZ2-CD1 3.48Å; W21-L25 VanDerWaalsContact CZ2-CD1 3.48Å; W21-L25 HydrophobicContact CZ2-CG 4.44Å; W21-L25 HydrophobicContact CZ3-CD1 3.92Å; W21-L25 PolarHBondContact O-N 3.03Å; W21-E139 PolarHBondContact NE1-O 3.13Å; W21-Y140 HydrophobicContact CZ2-CD2 4.35Å; W21-H142 AromaticContact CD1-CE1 3.93Å; W21-H142 AromaticContact CE2-CE1 3.64Å; W21-H142 AromaticContact CZ2-CE1 3.96Å; W21-H142 AromaticContact CZ2-NE2 3.99Å; W21-H142 AromaticContact NE1-CE1 3.39Å; W21-H142 PolarHBondContact NE1-CE1 3.1Å; W21-H142 AromaticContact NE1-ND1 3.79Å
22	L	95.5	Very high	85.1	Confident	78 Å²	78	74.3 Å²	74.3	41%	0.408	40%	0.401	S	S	.	.	H	α-helix	trans	-60	-42.9	177.3	-178.3	61.4	0	0	0	112	I17 D18 T24 L25 I26	I17-L22 HydrophobicContact CG2-CB 4.07Å; D18-L22 PolarHBondContact O-N 3.38Å; L22-T24 VanDerWaalsContact C-N 3.27Å; L22-T24 PolarHBondContact O-N 3.13Å; L22-L25 PolarHBondContact O-N 2.86Å; L22-I26 HydrophobicContact CD1-CD1 4.42Å; L22-I26 HydrophobicContact CG-CD1 4.11Å; L22-I26 WeakPolarHBondContact O-CG1 3.33Å; L22-I26 PolarHBondContact O-N 3.35Å
23	S	96.7	Very high	87.8	Confident	51 Å²	51	71.1 Å²	71.1	36%	0.357	39%	0.389	S	S	.	.	H	α-helix	trans	-62.4	-34.9	176.1	-61.8	0	0	0	0	112.3	P19 I20 W21 I26 L27	P19-S23 VanDerWaalsContact O-CB 3.26Å; P19-S23 WeakPolarHBondContact O-CB 3.33Å; P19-S23 PolarHBondContact O-N 3.47Å; P19-S23 PolarHBondContact O-OG 3.3Å; I20-S23 PolarHBondContact O-N 3.24Å; W21-S23 VanDerWaalsContact C-N 3.33Å; W21-S23 PolarHBondContact O-N 3.44Å; S23-I26 PolarHBondContact O-N 3.39Å; S23-L27 WeakPolarHBondContact O-CB 3.5Å; S23-L27 PolarHBondContact O-N 3.2Å
24	T	96.5	Very high	90.3	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-66.9	-44.3	176.8	-56.6	0	0	0	0	111	I20 W21 L22 I26 L27 L28 L409 L410 N413	I20-T24 PolarHBondContact O-N 3.32Å; I20-T24 PolarHBondContact O-OG1 3.01Å; W21-T24 WeakPolarHBondContact O-CB 3.18Å; W21-T24 PolarHBondContact O-N 2.95Å; L22-T24 VanDerWaalsContact C-N 3.27Å; L22-T24 PolarHBondContact O-N 3.13Å; T24-I26 PolarHBondContact O-N 3.45Å; T24-L27 WeakPolarHBondContact O-CB 3.38Å; T24-L27 PolarHBondContact O-N 3.38Å; T24-L28 HydrophobicContact CG2-CD1 4.1Å; T24-L28 HydrophobicContact CG2-CG 4.48Å; T24-L28 WeakPolarHBondContact O-CG 3.48Å; T24-L28 PolarHBondContact O-N 3.14Å; T24-L409 HydrophobicContact CG2-CD2 4.16Å; T24-L409 HydrophobicContact CG2-CG 3.92Å; T24-L410 WeakPolarHBondContact OG1-CA 3.32Å; T24-L410 PolarHBondContact OG1-N 3.48Å; T24-N413 HydrophobicContact CG2-CB 4.06Å
25	L	97.4	Very high	92.9	Very high	14 Å²	14	59 Å²	59	7%	0.073	33%	0.333	C	S	.	.	H	α-helix	trans	-62.9	-42.4	175.5	-66.1	-174.5	0	0	0	111.9	W21 L22 L27 L28 G29 F136 E139 Y140	W21-L25 HydrophobicContact CD2-CD1 4.13Å; W21-L25 HydrophobicContact CE3-CD1 4.19Å; W21-L25 HydrophobicContact CH2-CD1 3.57Å; W21-L25 HydrophobicContact CZ2-CD1 3.48Å; W21-L25 VanDerWaalsContact CZ2-CD1 3.48Å; W21-L25 HydrophobicContact CZ2-CG 4.44Å; W21-L25 HydrophobicContact CZ3-CD1 3.92Å; W21-L25 PolarHBondContact O-N 3.03Å; L22-L25 PolarHBondContact O-N 2.86Å; L25-L27 VanDerWaalsContact C-N 3.34Å; L25-L27 PolarHBondContact O-N 3.38Å; L25-L28 PolarHBondContact O-N 3.19Å; L25-G29 PolarHBondContact O-N 3.04Å; L25-F136 HydrophobicContact CB-CD2 4.46Å; L25-F136 HydrophobicContact CB-CE2 3.82Å; L25-F136 HydrophobicContact CB-CZ 4.33Å; L25-F136 HydrophobicContact CD2-CD2 4.08Å; L25-F136 HydrophobicContact CD2-CE2 3.98Å; L25-F136 HydrophobicContact CD2-CG 4.42Å; L25-F136 HydrophobicContact CD2-CZ 4.22Å; L25-F136 HydrophobicContact CG-CE2 4.41Å; L25-F136 VanDerWaalsContact O-CE2 3.32Å; L25-F136 WeakPolarHBondContact O-CE2 3.41Å; L25-E139 HydrophobicContact CD2-CB 4.13Å; L25-Y140 HydrophobicContact CD1-CD2 4.22Å
26	I	97.8	Very high	94.7	Very high	109 Å²	109	52.7 Å²	52.7	56%	0.559	31%	0.306	S	S	*	.	H	α-helix	trans	-61.4	-43.8	175.2	-67.3	167.7	0	0	0	110.7	L22 S23 T24 S30	L22-I26 HydrophobicContact CD1-CD1 4.42Å; L22-I26 HydrophobicContact CG-CD1 4.11Å; L22-I26 WeakPolarHBondContact O-CG1 3.33Å; L22-I26 PolarHBondContact O-N 3.35Å; S23-I26 PolarHBondContact O-N 3.39Å; T24-I26 PolarHBondContact O-N 3.45Å; I26-S30 VanDerWaalsContact O-CB 3.29Å; I26-S30 WeakPolarHBondContact O-CB 3.48Å; I26-S30 PolarHBondContact O-N 2.94Å; I26-S30 PolarHBondContact O-OG 3.44Å
27	L	98.1	Very high	95.8	Very high	22 Å²	22	51.4 Å²	51.4	12%	0.115	29%	0.289	C	S	.	.	H	α-helix	trans	-56.9	-56.6	175.6	174	68.3	0	0	0	110.6	S23 T24 L25 G29 S30 V31 L410 N413 T414 L417	S23-L27 WeakPolarHBondContact O-CB 3.5Å; S23-L27 PolarHBondContact O-N 3.2Å; T24-L27 WeakPolarHBondContact O-CB 3.38Å; T24-L27 PolarHBondContact O-N 3.38Å; L25-L27 VanDerWaalsContact C-N 3.34Å; L25-L27 PolarHBondContact O-N 3.38Å; L27-G29 PolarHBondContact O-N 3.22Å; L27-S30 PolarHBondContact O-N 3.15Å; L27-S30 PolarHBondContact O-OG 3.27Å; L27-V31 HydrophobicContact CD1-CG2 4.25Å; L27-V31 HydrophobicContact CG-CG2 4.44Å; L27-V31 WeakPolarHBondContact O-CG2 3.26Å; L27-V31 PolarHBondContact O-N 3.3Å; L27-L410 HydrophobicContact CB-CD1 4.13Å; L27-L410 HydrophobicContact CD2-CD1 3.79Å; L27-N413 HydrophobicContact CD2-CB 4.2Å; L27-T414 HydrophobicContact CD2-CG2 4.46Å; L27-L417 HydrophobicContact CD1-CD1 4.24Å; L27-L417 HydrophobicContact CD1-CD2 3.56Å; L27-L417 HydrophobicContact CD1-CG 3.89Å
28	L	98.2	Very high	96.5	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.2	-43.8	-177.8	-68.6	173.1	0	0	0	112	T24 L25 S30 V31 S32 V132 T135 F136 E139 N413 Y416	T24-L28 HydrophobicContact CG2-CD1 4.1Å; T24-L28 HydrophobicContact CG2-CG 4.48Å; T24-L28 WeakPolarHBondContact O-CG 3.48Å; T24-L28 PolarHBondContact O-N 3.14Å; L25-L28 PolarHBondContact O-N 3.19Å; L28-S30 PolarHBondContact O-N 3.39Å; L28-V31 PolarHBondContact O-N 3.47Å; L28-S32 WeakPolarHBondContact O-CB 3.32Å; L28-S32 PolarHBondContact O-N 3.36Å; L28-V132 HydrophobicContact CB-CG1 4.26Å; L28-V132 HydrophobicContact CD2-CG1 4.17Å; L28-V132 WeakPolarHBondContact O-CG1 3.42Å; L28-T135 HydrophobicContact CD1-CG2 4.05Å; L28-T135 HydrophobicContact CD2-CG2 4.26Å; L28-F136 HydrophobicContact CB-CB 4.18Å; L28-F136 HydrophobicContact CB-CD2 3.95Å; L28-F136 HydrophobicContact CD1-CB 4.4Å; L28-E139 HydrophobicContact CD1-CG 4.1Å; L28-N413 HydrophobicContact CD2-CB 4.46Å; L28-Y416 HydrophobicContact CD2-CD2 3.52Å; L28-Y416 HydrophobicContact CD2-CE2 3.87Å; L28-Y416 HydrophobicContact CD2-CG 4.22Å
29	G	98.2	Very high	96.9	Very high	30 Å²	30	43.4 Å²	43.4	31%	0.309	25%	0.249	S	C	.	.	H	α-helix	trans	-60.6	-43	175.5	0	0	0	0	0	112.5	L25 L27 S32 L33	L25-G29 PolarHBondContact O-N 3.04Å; L27-G29 PolarHBondContact O-N 3.22Å; G29-S32 PolarHBondContact O-N 2.97Å; G29-L33 PolarHBondContact O-N 3.32Å
30	S	97.9	Very high	97	Very high	39 Å²	39	43.5 Å²	43.5	27%	0.273	24%	0.244	S	C	.	.	H	α-helix	trans	-66	-40.5	176.5	77.9	0	0	0	0	112.5	I26 L27 L28 L33 L34	I26-S30 VanDerWaalsContact O-CB 3.29Å; I26-S30 WeakPolarHBondContact O-CB 3.48Å; I26-S30 PolarHBondContact O-N 2.94Å; I26-S30 PolarHBondContact O-OG 3.44Å; L27-S30 PolarHBondContact O-N 3.15Å; L27-S30 PolarHBondContact O-OG 3.27Å; L28-S30 PolarHBondContact O-N 3.39Å; S30-L33 PolarHBondContact O-N 2.86Å; S30-L34 VanDerWaalsContact O-CB 3.26Å; S30-L34 WeakPolarHBondContact O-CB 3.29Å; S30-L34 WeakPolarHBondContact O-CG 3.39Å; S30-L34 PolarHBondContact O-N 3.2Å
31	V	98.2	Very high	97	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62	-47.2	176.3	177.8	0	0	0	0	110.5	L27 L28 G35 V132 Y416 L417 M420	L27-V31 HydrophobicContact CD1-CG2 4.25Å; L27-V31 HydrophobicContact CG-CG2 4.44Å; L27-V31 WeakPolarHBondContact O-CG2 3.26Å; L27-V31 PolarHBondContact O-N 3.3Å; L28-V31 PolarHBondContact O-N 3.47Å; V31-G35 VanDerWaalsContact O-CA 3.28Å; V31-G35 WeakPolarHBondContact O-CA 3.31Å; V31-G35 PolarHBondContact O-N 3.35Å; V31-V132 HydrophobicContact CB-CG1 4.15Å; V31-V132 HydrophobicContact CG1-CG1 4.28Å; V31-V132 HydrophobicContact CG1-CG2 3.96Å; V31-Y416 WeakPolarHBondContact CG1-O 3.48Å; V31-L417 HydrophobicContact CG2-CD2 4.2Å; V31-M420 HydrophobicContact CB-CE 3.77Å; V31-M420 HydrophobicContact CG1-CB 4.42Å; V31-M420 HydrophobicContact CG1-CE 4.42Å; V31-M420 HydrophobicContact CG2-CE 3.31Å
32	S	98.1	Very high	96.9	Very high	30 Å²	30	40.8 Å²	40.8	21%	0.21	23%	0.233	C	C	.	.	H	α-helix	trans	-58.2	-53	178.6	173.4	0	0	0	0	110.9	L28 G29 T36 C128	L28-S32 WeakPolarHBondContact O-CB 3.32Å; L28-S32 PolarHBondContact O-N 3.36Å; G29-S32 PolarHBondContact O-N 2.97Å; S32-T36 WeakPolarHBondContact O-CB 2.96Å; S32-T36 PolarHBondContact O-N 3.47Å; S32-T36 PolarHBondContact O-OG1 2.97Å; S32-C128 PolarHBondContact OG-O 3.14Å
33	L	97.8	Very high	96.7	Very high	108 Å²	108	38.2 Å²	38.2	57%	0.565	22%	0.22	S	C	*	.	H	α-helix	trans	-67.5	-57.2	-176.3	-179	63.5	0	0	0	112.7	G29 S30 T36 I37	G29-L33 PolarHBondContact O-N 3.32Å; S30-L33 PolarHBondContact O-N 2.86Å; L33-T36 PolarHBondContact O-N 3.05Å; L33-I37 HydrophobicContact CD1-CD1 3.95Å; L33-I37 HydrophobicContact CG-CD1 4.18Å; L33-I37 WeakPolarHBondContact O-CG1 3.44Å; L33-I37 PolarHBondContact O-N 3.43Å; L33-I37 VanDerWaalsContact O-N 3.14Å
34	L	97.6	Very high	96.3	Very high	97 Å²	97	37.2 Å²	37.2	51%	0.508	22%	0.218	S	C	.	.	H	α-helix	trans	-70	-37.8	-174.2	-62.3	179	0	0	0	111.6	S30 G38	S30-L34 VanDerWaalsContact O-CB 3.26Å; S30-L34 WeakPolarHBondContact O-CB 3.29Å; S30-L34 WeakPolarHBondContact O-CG 3.39Å; S30-L34 PolarHBondContact O-N 3.2Å; L34-G38 PolarHBondContact O-N 3.27Å
35	G	97.8	Very high	95.8	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-66	-42.3	176.6	0	0	0	0	0	112.2	V31 G38 N39	V31-G35 VanDerWaalsContact O-CA 3.28Å; V31-G35 WeakPolarHBondContact O-CA 3.31Å; V31-G35 PolarHBondContact O-N 3.35Å; G35-G38 PolarHBondContact O-N 2.99Å; G35-N39 VanDerWaalsContact O-CB 3.32Å; G35-N39 WeakPolarHBondContact O-CB 3.35Å; G35-N39 PolarHBondContact O-N 3.26Å; G35-N39 PolarHBondContact O-ND2 2.91Å
36	T	97.9	Very high	95.1	Very high	32 Å²	32	38.3 Å²	38.3	20%	0.196	22%	0.222	C	C	.	.	H	α-helix	trans	-60.4	-51	175.3	-62.2	0	0	0	0	111.4	S32 L33 G38 L40 L125	S32-T36 WeakPolarHBondContact O-CB 2.96Å; S32-T36 PolarHBondContact O-N 3.47Å; S32-T36 PolarHBondContact O-OG1 2.97Å; L33-T36 PolarHBondContact O-N 3.05Å; T36-G38 PolarHBondContact O-N 2.96Å; T36-L40 HydrophobicContact CG2-CD1 3.93Å; T36-L40 WeakPolarHBondContact O-CB 3.45Å; T36-L40 VanDerWaalsContact O-CG 3.26Å; T36-L40 WeakPolarHBondContact O-CG 3.47Å; T36-L40 PolarHBondContact O-N 3.44Å; T36-L125 HydrophobicContact CG2-CD1 3.97Å
37	I	96.7	Very high	94.4	Very high	90 Å²	90	35.7 Å²	35.7	46%	0.462	21%	0.208	S	C	.	.	H	α-helix	trans	-60	-48.6	179.3	-66.3	167.8	0	0	0	110.6	L33 L40 L41	L33-I37 HydrophobicContact CD1-CD1 3.95Å; L33-I37 HydrophobicContact CG-CD1 4.18Å; L33-I37 WeakPolarHBondContact O-CG1 3.44Å; L33-I37 PolarHBondContact O-N 3.43Å; L33-I37 VanDerWaalsContact O-N 3.14Å; I37-L40 PolarHBondContact O-N 3.26Å; I37-L41 HydrophobicContact CG2-CD1 4.17Å; I37-L41 WeakPolarHBondContact O-CG 3.41Å; I37-L41 PolarHBondContact O-N 3.39Å
38	G	96.2	Very high	93.2	Very high	9 Å²	9	36 Å²	36	9%	0.093	21%	0.209	C	C	.	.	H	α-helix	trans	-62.9	-46.2	-177.4	0	0	0	0	0	112.6	L34 G35 T36 L41 V42 P423	L34-G38 PolarHBondContact O-N 3.27Å; G35-G38 PolarHBondContact O-N 2.99Å; T36-G38 PolarHBondContact O-N 2.96Å; G38-L41 WeakPolarHBondContact O-CB 3.45Å; G38-L41 PolarHBondContact O-N 3.06Å; G38-V42 WeakPolarHBondContact O-CG2 3.5Å; G38-V42 PolarHBondContact O-N 3.28Å; G38-P423 VanDerWaalsContact CA-CG 3.49Å; G38-P423 WeakPolarHBondContact O-CG 3.4Å
39	N	96.8	Very high	91.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-71.6	-34.5	-178.3	-71.4	-50.3	0	0	0	112.3	G35 L41 V42 L43 D124 L125 N419 P423	G35-N39 VanDerWaalsContact O-CB 3.32Å; G35-N39 WeakPolarHBondContact O-CB 3.35Å; G35-N39 PolarHBondContact O-N 3.26Å; G35-N39 PolarHBondContact O-ND2 2.91Å; N39-L41 VanDerWaalsContact C-N 3.32Å; N39-L41 PolarHBondContact O-N 3.22Å; N39-V42 PolarHBondContact O-N 3.32Å; N39-L43 WeakPolarHBondContact O-CG 3.29Å; N39-L43 PolarHBondContact O-N 3.29Å; N39-D124 WeakPolarHBondContact ND2-CB 3.49Å; N39-L125 HydrophobicContact CB-CB 4Å; N39-L125 HydrophobicContact CB-CD1 4.42Å; N39-N419 PolarHBondContact ND2-O 3.08Å; N39-P423 WeakPolarHBondContact OD1-CD 3.48Å; N39-P423 WeakPolarHBondContact OD1-CG 3.28Å
40	L	95.4	Very high	89.9	Confident	92 Å²	92	46.2 Å²	46.2	48%	0.482	25%	0.249	S	C	.	.	H	α-helix	trans	-60	-40.6	168.8	-75.5	173.3	0	0	0	112.2	T36 I37 L43 G44 L125	T36-L40 HydrophobicContact CG2-CD1 3.93Å; T36-L40 WeakPolarHBondContact O-CB 3.45Å; T36-L40 VanDerWaalsContact O-CG 3.26Å; T36-L40 WeakPolarHBondContact O-CG 3.47Å; T36-L40 PolarHBondContact O-N 3.44Å; I37-L40 PolarHBondContact O-N 3.26Å; L40-L43 PolarHBondContact O-N 3.19Å; L40-G44 PolarHBondContact O-N 3.4Å; L40-L125 HydrophobicContact CD2-CD1 4.18Å; L40-L125 HydrophobicContact CD2-CD2 3.82Å; L40-L125 HydrophobicContact CG-CD1 3.9Å; L40-L125 HydrophobicContact CG-CD2 4.4Å
41	L	93.1	Very high	88.1	Confident	56 Å²	56	51.3 Å²	51.3	29%	0.293	27%	0.266	S	S	.	.	H	α-helix	trans	-64.3	-40.5	175.3	-72.8	171.1	0	0	0	112	I37 G38 N39 G44 V45 L437 F441	I37-L41 HydrophobicContact CG2-CD1 4.17Å; I37-L41 WeakPolarHBondContact O-CG 3.41Å; I37-L41 PolarHBondContact O-N 3.39Å; G38-L41 WeakPolarHBondContact O-CB 3.45Å; G38-L41 PolarHBondContact O-N 3.06Å; N39-L41 VanDerWaalsContact C-N 3.32Å; N39-L41 PolarHBondContact O-N 3.22Å; L41-G44 PolarHBondContact O-N 2.87Å; L41-V45 WeakPolarHBondContact O-CB 3.47Å; L41-V45 VanDerWaalsContact O-CG2 3.32Å; L41-V45 WeakPolarHBondContact O-CG2 3.48Å; L41-V45 PolarHBondContact O-N 3.21Å; L41-L437 HydrophobicContact CD2-CD1 4.41Å; L41-F441 HydrophobicContact CD2-CZ 4.03Å
42	V	92.9	Very high	86.3	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-61.5	-50.8	175.8	175.9	0	0	0	0	110.6	G38 N39 G44 V45 Y46 I117 A121 P423 Y426 F433	G38-V42 WeakPolarHBondContact O-CG2 3.5Å; G38-V42 PolarHBondContact O-N 3.28Å; N39-V42 PolarHBondContact O-N 3.32Å; V42-G44 VanDerWaalsContact C-N 3.34Å; V42-G44 PolarHBondContact O-N 2.78Å; V42-V45 PolarHBondContact O-N 3.43Å; V42-Y46 HydrophobicContact CG1-CD2 3.9Å; V42-Y46 HydrophobicContact CG1-CE2 4.12Å; V42-Y46 WeakPolarHBondContact O-CD2 3.24Å; V42-Y46 PolarHBondContact O-N 2.89Å; V42-Y46 VanDerWaalsContact O-N 3.08Å; V42-I117 HydrophobicContact CG1-CG2 4.18Å; V42-A121 HydrophobicContact CB-CB 4.05Å; V42-A121 HydrophobicContact CG1-CB 3.67Å; V42-P423 HydrophobicContact CG2-CB 4.11Å; V42-P423 HydrophobicContact CG2-CG 4.05Å; V42-Y426 HydrophobicContact CG1-CD2 4.32Å; V42-Y426 HydrophobicContact CG1-CE2 4.26Å; V42-Y426 HydrophobicContact CG2-CD2 3.79Å; V42-Y426 HydrophobicContact CG2-CE2 4.3Å; V42-F433 HydrophobicContact CG2-CE2 4.12Å; V42-F433 HydrophobicContact CG2-CZ 4.14Å
43	L	92.3	Very high	84.3	Confident	23 Å²	23	60.4 Å²	60.4	12%	0.12	30%	0.304	C	S	.	.	H	α-helix	trans	-59	-45.6	176.4	-68.1	174.8	0	0	0	111.4	N39 L40 V45 Y46 I47 L118 A121 L125	N39-L43 WeakPolarHBondContact O-CG 3.29Å; N39-L43 PolarHBondContact O-N 3.29Å; L40-L43 PolarHBondContact O-N 3.19Å; L43-V45 VanDerWaalsContact C-N 3.33Å; L43-V45 PolarHBondContact O-N 3.27Å; L43-Y46 PolarHBondContact O-N 3.36Å; L43-I47 HydrophobicContact CB-CD1 4.19Å; L43-I47 HydrophobicContact CD2-CD1 4.01Å; L43-I47 VanDerWaalsContact O-CB 3.26Å; L43-I47 WeakPolarHBondContact O-CB 3.19Å; L43-I47 VanDerWaalsContact O-CG1 3.29Å; L43-I47 WeakPolarHBondContact O-CG1 3.22Å; L43-I47 PolarHBondContact O-N 3.07Å; L43-L118 HydrophobicContact CD2-CD2 3.97Å; L43-A121 HydrophobicContact CD2-CB 3.8Å; L43-A121 HydrophobicContact CG-CB 3.95Å; L43-L125 HydrophobicContact CD1-CD2 3.65Å
44	G	88.5	Confident	82.3	Confident	31 Å²	31	62.2 Å²	62.2	32%	0.32	31%	0.309	S	S	.	.	H	α-helix	trans	-57.5	-43	177.4	0	0	0	0	0	112.9	L40 L41 V42 Q48	L40-G44 PolarHBondContact O-N 3.4Å; L41-G44 PolarHBondContact O-N 2.87Å; V42-G44 VanDerWaalsContact C-N 3.34Å; V42-G44 PolarHBondContact O-N 2.78Å; G44-Q48 WeakPolarHBondContact O-CA 3.39Å; G44-Q48 VanDerWaalsContact O-CB 3.29Å; G44-Q48 WeakPolarHBondContact O-CB 3.44Å; G44-Q48 PolarHBondContact O-N 3.43Å
45	V	86.1	Confident	80.3	Confident	3 Å²	3	59.6 Å²	59.6	2%	0.018	30%	0.296	C	S	.	.	H	α-helix	trans	-67.8	-40.4	178.6	162.6	0	0	0	0	112.8	L41 V42 L43 F433 K436 L437 L440	L41-V45 WeakPolarHBondContact O-CB 3.47Å; L41-V45 VanDerWaalsContact O-CG2 3.32Å; L41-V45 WeakPolarHBondContact O-CG2 3.48Å; L41-V45 PolarHBondContact O-N 3.21Å; V42-V45 PolarHBondContact O-N 3.43Å; L43-V45 VanDerWaalsContact C-N 3.33Å; L43-V45 PolarHBondContact O-N 3.27Å; V45-F433 HydrophobicContact CB-CD2 4.23Å; V45-F433 HydrophobicContact CB-CE2 3.79Å; V45-F433 HydrophobicContact CG1-CD2 3.66Å; V45-F433 HydrophobicContact CG1-CE2 3.77Å; V45-F433 HydrophobicContact CG2-CD2 4.46Å; V45-F433 HydrophobicContact CG2-CE2 3.84Å; V45-F433 HydrophobicContact CG2-CZ 4.36Å; V45-K436 HydrophobicContact CG1-CB 3.5Å; V45-K436 HydrophobicContact CG1-CD 3.83Å; V45-K436 HydrophobicContact CG1-CG 4.33Å; V45-L437 HydrophobicContact CG2-CB 4.34Å; V45-L437 HydrophobicContact CG2-CD1 3.87Å; V45-L440 HydrophobicContact CG2-CD2 4.21Å
46	Y	82.8	Confident	78.2	Confident	33 Å²	33	62.6 Å²	62.6	13%	0.129	31%	0.31	C	S	.	.	H	α-helix	trans	-87.3	-28.7	-176.1	-78.5	-80.8	0	0	0	113.5	V42 L43 T114 I117 L118 F433	V42-Y46 HydrophobicContact CG1-CD2 3.9Å; V42-Y46 HydrophobicContact CG1-CE2 4.12Å; V42-Y46 WeakPolarHBondContact O-CD2 3.24Å; V42-Y46 PolarHBondContact O-N 2.89Å; V42-Y46 VanDerWaalsContact O-N 3.08Å; L43-Y46 PolarHBondContact O-N 3.36Å; Y46-T114 HydrophobicContact CD1-CG2 3.49Å; Y46-T114 VanDerWaalsContact CD1-CG2 3.49Å; Y46-T114 HydrophobicContact CE1-CG2 3.76Å; Y46-T114 HydrophobicContact CG-CG2 4.44Å; Y46-I117 HydrophobicContact CD2-CG2 4.19Å; Y46-I117 HydrophobicContact CE2-CG2 3.69Å; Y46-L118 HydrophobicContact CG-CD2 4.4Å; Y46-F433 AromaticContact CE2-CD2 3.98Å; Y46-F433 HydrophobicContact CE2-CD2 3.98Å; Y46-F433 HydrophobicContact CE2-CE2 4.49Å
47	I	82.5	Confident	76.2	Confident	55 Å²	55	65.7 Å²	65.7	28%	0.282	33%	0.325	S	S	.	.	H	α-helix	trans	-94.4	-1.2	178.1	-50.5	173.2	0	0	0	111.4	L43 Q49 H50 F51 L118	L43-I47 HydrophobicContact CB-CD1 4.19Å; L43-I47 HydrophobicContact CD2-CD1 4.01Å; L43-I47 VanDerWaalsContact O-CB 3.26Å; L43-I47 WeakPolarHBondContact O-CB 3.19Å; L43-I47 VanDerWaalsContact O-CG1 3.29Å; L43-I47 WeakPolarHBondContact O-CG1 3.22Å; L43-I47 PolarHBondContact O-N 3.07Å; I47-Q49 PolarHBondContact O-N 2.99Å; I47-H50 HydrophobicContact CG2-CB 3.81Å; I47-H50 WeakPolarHBondContact O-CB 3.27Å; I47-H50 PolarHBondContact O-N 3.28Å; I47-F51 HydrophobicContact CB-CD2 4.32Å; I47-F51 HydrophobicContact CB-CE2 4.34Å; I47-F51 HydrophobicContact CG2-CD2 3.62Å; I47-F51 HydrophobicContact CG2-CE2 3.51Å; I47-F51 PolarHBondContact O-N 3Å; I47-L118 HydrophobicContact CD1-CD2 4.28Å; I47-L118 HydrophobicContact CG1-CD2 3.94Å
48	Q	72.9	Confident	74.2	Confident	28 Å²	28	67 Å²	67	13%	0.131	33%	0.327	C	S	.	.	H	α-helix	trans	-47.7	-35.5	179.8	-165.8	178.7	-4.8	0	0	113.8	G44 H50 W52	G44-Q48 WeakPolarHBondContact O-CA 3.39Å; G44-Q48 VanDerWaalsContact O-CB 3.29Å; G44-Q48 WeakPolarHBondContact O-CB 3.44Å; G44-Q48 PolarHBondContact O-N 3.43Å; Q48-H50 PolarHBondContact O-N 2.92Å; Q48-W52 HydrophobicContact CG-CB 4.46Å; Q48-W52 PolarHBondContact O-N 3.36Å
49	Q	63.4	Low	72.2	Confident	87 Å²	87	69.3 Å²	69.3	41%	0.407	33%	0.333	S	S	.	.	H	α-helix	trans	-62.9	-28.8	178.5	-71	179.4	-22.6	0	0	113.5	I47 H56	I47-Q49 PolarHBondContact O-N 2.99Å; Q49-H56 PolarHBondContact NE2-NE2 2.87Å
50	H	63.7	Low	70.2	Confident	158 Å²	158	75.4 Å²	75.4	73%	0.731	36%	0.356	S	S	*	.	H	α-helix	trans	-85.6	-39.2	-179	-161	-70.5	0	0	0	112.2	I47 Q48	I47-H50 HydrophobicContact CG2-CB 3.81Å; I47-H50 WeakPolarHBondContact O-CB 3.27Å; I47-H50 PolarHBondContact O-N 3.28Å; Q48-H50 PolarHBondContact O-N 2.92Å
51	F	60.3	Low	68.2	Low	146 Å²	146	77.9 Å²	77.9	64%	0.64	37%	0.365	S	S	*	.	H	α-helix	trans	-86	-31.1	-178.3	-73.4	-74.9	0	0	0	113.6	I47	I47-F51 HydrophobicContact CB-CD2 4.32Å; I47-F51 HydrophobicContact CB-CE2 4.34Å; I47-F51 HydrophobicContact CG2-CD2 3.62Å; I47-F51 HydrophobicContact CG2-CE2 3.51Å; I47-F51 PolarHBondContact O-N 3Å
52	W	59.1	Low	66.6	Low	155 Å²	155	78.8 Å²	78.8	59%	0.587	37%	0.37	S	S	*	.			trans	-131.2	66.3	-173.8	-69.9	93.2	0	0	0	112.4	Q48 H54 L55 H56	Q48-W52 HydrophobicContact CG-CB 4.46Å; Q48-W52 PolarHBondContact O-N 3.36Å; W52-H54 PolarHBondContact O-N 3.48Å; W52-L55 HydrophobicContact CB-CB 4.17Å; W52-L55 HydrophobicContact CB-CD1 4.17Å; W52-L55 HydrophobicContact CD2-CD1 4.13Å; W52-L55 HydrophobicContact CE3-CD1 3.63Å; W52-L55 HydrophobicContact CG-CD1 4.38Å; W52-L55 HydrophobicContact CZ3-CD1 4.36Å; W52-L55 PolarHBondContact O-N 3.4Å; W52-L55 VanDerWaalsContact O-N 3.14Å; W52-H56 PolarHBondContact O-N 2.84Å
53	P	57.2	Low	64.7	Low	65 Å²	65	83.6 Å²	83.6	42%	0.422	39%	0.388	S	S	.	.	H	α-helix	trans	-59.5	-32.3	179.8	24.3	-33.7	0	0	0	112.5	L55 H56 L57	P53-L55 PolarHBondContact O-N 3.49Å; P53-H56 WeakPolarHBondContact O-CB 3.39Å; P53-H56 PolarHBondContact O-N 3.36Å; P53-L57 PolarHBondContact O-N 3.32Å; P53-L57 VanDerWaalsContact O-N 3.12Å
54	H	55.5	Low	62.6	Low	146 Å²	146	86.7 Å²	86.7	68%	0.676	40%	0.399	S	S	*	.	H	α-helix	trans	-66.2	-35.7	178.1	-65	-68.7	0	0	0	113.4	W52 H56 L57 K58	W52-H54 PolarHBondContact O-N 3.48Å; H54-H56 VanDerWaalsContact C-N 3.31Å; H54-L57 PolarHBondContact O-N 2.91Å; H54-K58 PolarHBondContact O-N 3.47Å; H54-K58 VanDerWaalsContact O-N 3.14Å
55	L	54.6	Low	60.9	Low	42 Å²	42	91.2 Å²	91.2	22%	0.22	41%	0.411	C	S	.	.	H	α-helix	trans	-66.8	-37	173.4	-98.4	87.2	0	0	0	111.1	W52 P53 K58 Y59 N443	W52-L55 HydrophobicContact CB-CB 4.17Å; W52-L55 HydrophobicContact CB-CD1 4.17Å; W52-L55 HydrophobicContact CD2-CD1 4.13Å; W52-L55 HydrophobicContact CE3-CD1 3.63Å; W52-L55 HydrophobicContact CG-CD1 4.38Å; W52-L55 HydrophobicContact CZ3-CD1 4.36Å; W52-L55 PolarHBondContact O-N 3.4Å; W52-L55 VanDerWaalsContact O-N 3.14Å; P53-L55 PolarHBondContact O-N 3.49Å; L55-K58 PolarHBondContact O-N 3.49Å; L55-Y59 WeakPolarHBondContact O-CB 3.41Å; L55-Y59 PolarHBondContact O-N 3.42Å; L55-N443 HydrophobicContact CD2-CB 4.01Å
56	H	54.9	Low	59.5	Low	63 Å²	63	97.7 Å²	97.7	29%	0.292	44%	0.441	S	S	.	.	H	α-helix	trans	-64	-41.2	178.3	-168.8	-99.9	0	0	0	111.9	Q49 W52 P53 H54 Y59 R60	Q49-H56 PolarHBondContact NE2-NE2 2.87Å; W52-H56 PolarHBondContact O-N 2.84Å; P53-H56 WeakPolarHBondContact O-CB 3.39Å; P53-H56 PolarHBondContact O-N 3.36Å; H54-H56 VanDerWaalsContact C-N 3.31Å; H56-Y59 PolarHBondContact O-N 2.88Å; H56-R60 PolarHBondContact O-N 2.93Å
57	L	56.2	Low	58.1	Low	98 Å²	98	97.6 Å²	97.6	51%	0.513	44%	0.442	S	S	.	.	H	α-helix	trans	-64.7	-43.6	174.9	-82.1	153.9	0	0	0	112.7	P53 H54 Y59 R60 H61	P53-L57 PolarHBondContact O-N 3.32Å; P53-L57 VanDerWaalsContact O-N 3.12Å; H54-L57 PolarHBondContact O-N 2.91Å; L57-Y59 VanDerWaalsContact C-N 3.32Å; L57-Y59 PolarHBondContact O-N 2.93Å; L57-R60 VanDerWaalsContact O-CB 3.27Å; L57-R60 WeakPolarHBondContact O-CB 3.29Å; L57-R60 PolarHBondContact O-N 3.36Å; L57-H61 PolarHBondContact O-N 3.36Å; L57-H61 VanDerWaalsContact O-N 3.11Å
58	K	53.9	Low	56.4	Low	118 Å²	118	101.9 Å²	101.9	51%	0.513	46%	0.459	S	S	.	.	H	α-helix	trans	-64.7	-38.2	176.5	-167.2	175.5	-176.5	176.8	0	111.7	H54 L55 H61 I62	H54-K58 PolarHBondContact O-N 3.47Å; H54-K58 VanDerWaalsContact O-N 3.14Å; L55-K58 PolarHBondContact O-N 3.49Å; K58-H61 WeakPolarHBondContact O-CB 3.37Å; K58-H61 PolarHBondContact O-N 3.02Å; K58-I62 HydrophobicContact CG-CD1 4.22Å; K58-I62 WeakPolarHBondContact O-CG1 3.45Å; K58-I62 PolarHBondContact O-N 3.28Å
59	Y	53.7	Low	55.4	Low	57 Å²	57	104.8 Å²	104.8	22%	0.224	48%	0.475	C	S	.	.	H	α-helix	trans	-67.2	-39.1	176.1	-164.8	-101.8	0	0	0	112.1	L55 H56 L57 H61 I62 Y63 F106 I439	L55-Y59 WeakPolarHBondContact O-CB 3.41Å; L55-Y59 PolarHBondContact O-N 3.42Å; H56-Y59 PolarHBondContact O-N 2.88Å; L57-Y59 VanDerWaalsContact C-N 3.32Å; L57-Y59 PolarHBondContact O-N 2.93Å; Y59-H61 VanDerWaalsContact C-N 3.29Å; Y59-H61 PolarHBondContact O-N 3.31Å; Y59-I62 PolarHBondContact O-N 2.93Å; Y59-Y63 HydrophobicContact CE1-CD2 4.4Å; Y59-Y63 VanDerWaalsContact O-CB 3.31Å; Y59-Y63 WeakPolarHBondContact O-CB 3.33Å; Y59-Y63 PolarHBondContact O-N 3.27Å; Y59-F106 HydrophobicContact CD1-CZ 4.49Å; Y59-F106 HydrophobicContact CE1-CZ 4.17Å; Y59-I439 HydrophobicContact CD2-CD1 3.81Å; Y59-I439 HydrophobicContact CD2-CG1 4.1Å; Y59-I439 HydrophobicContact CD2-CG2 3.98Å; Y59-I439 HydrophobicContact CE1-CD1 4.05Å; Y59-I439 HydrophobicContact CE2-CD1 3.08Å; Y59-I439 HydrophobicContact CE2-CG1 3.5Å; Y59-I439 VanDerWaalsContact CE2-CG1 3.5Å; Y59-I439 HydrophobicContact CE2-CG2 4.25Å; Y59-I439 VanDerWaalsContact OH-CD1 3.29Å; Y59-I439 WeakPolarHBondContact OH-CD1 3.5Å
60	R	55.4	Low	54.7	Low	128 Å²	128	103.5 Å²	103.5	48%	0.483	48%	0.475	S	S	.	.	H	α-helix	trans	-51.9	-53	170	-145.7	-176.2	176.2	178.9	-4	109.3	H56 L57 I62 Y63 Y64 E103	H56-R60 PolarHBondContact O-N 2.93Å; L57-R60 VanDerWaalsContact O-CB 3.27Å; L57-R60 WeakPolarHBondContact O-CB 3.29Å; L57-R60 PolarHBondContact O-N 3.36Å; R60-I62 PolarHBondContact O-N 2.97Å; R60-Y63 PolarHBondContact O-N 3.46Å; R60-Y64 HydrophobicContact CG-CD2 4.06Å; R60-Y64 HydrophobicContact CG-CE2 3.8Å; R60-Y64 WeakPolarHBondContact O-CB 3.24Å; R60-Y64 WeakPolarHBondContact O-CD2 3.26Å; R60-Y64 PolarHBondContact O-N 3.41Å; R60-E103 IonicContact CZ-OE1 2.67Å; R60-E103 IonicContact NE-OE1 3.96Å; R60-E103 PolarHBondContact NE-OE1 2.98Å; R60-E103 IonicContact NH2-OE1 3.17Å; R60-E103 PolarHBondContact NH2-OE1 3.4Å
61	H	53.7	Low	53.8	Low	144 Å²	144	98.1 Å²	98.1	67%	0.667	45%	0.452	S	S	*	.	H	α-helix	trans	-60.5	-43	177.9	-95.5	-82.9	0	0	0	114.7	L57 K58 Y59 Y64 H65	L57-H61 PolarHBondContact O-N 3.36Å; L57-H61 VanDerWaalsContact O-N 3.11Å; K58-H61 WeakPolarHBondContact O-CB 3.37Å; K58-H61 PolarHBondContact O-N 3.02Å; Y59-H61 VanDerWaalsContact C-N 3.29Å; Y59-H61 PolarHBondContact O-N 3.31Å; H61-Y64 WeakPolarHBondContact O-CB 3.46Å; H61-Y64 PolarHBondContact O-N 2.91Å; H61-H65 WeakPolarHBondContact O-CB 3.4Å; H61-H65 PolarHBondContact O-N 3.01Å
62	I	58.5	Low	53.3	Low	75 Å²	75	95.1 Å²	95.1	39%	0.385	44%	0.442	S	S	.	.	H	α-helix	trans	-69	-41.2	-179.7	-67.5	167	0	0	0	111.2	K58 Y59 R60 H65 H66	K58-I62 HydrophobicContact CG-CD1 4.22Å; K58-I62 WeakPolarHBondContact O-CG1 3.45Å; K58-I62 PolarHBondContact O-N 3.28Å; Y59-I62 PolarHBondContact O-N 2.93Å; R60-I62 PolarHBondContact O-N 2.97Å; I62-H65 PolarHBondContact O-N 3.42Å; I62-H65 VanDerWaalsContact O-N 3.17Å; I62-H66 WeakPolarHBondContact O-CB 3.42Å; I62-H66 PolarHBondContact O-N 3.35Å
63	Y	53.1	Low	52.6	Low	100 Å²	100	92.3 Å²	92.3	39%	0.392	44%	0.438	S	S	.	.	H	α-helix	trans	-63	-44.8	175.8	-167.3	-90	0	0	0	110.8	Y59 R60 H65 H66 Q67	Y59-Y63 HydrophobicContact CE1-CD2 4.4Å; Y59-Y63 VanDerWaalsContact O-CB 3.31Å; Y59-Y63 WeakPolarHBondContact O-CB 3.33Å; Y59-Y63 PolarHBondContact O-N 3.27Å; R60-Y63 PolarHBondContact O-N 3.46Å; Y63-H65 VanDerWaalsContact C-N 3.29Å; Y63-H65 PolarHBondContact O-N 2.98Å; Y63-H66 PolarHBondContact O-N 3.42Å; Y63-Q67 VanDerWaalsContact O-CB 3.28Å; Y63-Q67 WeakPolarHBondContact O-CB 3.23Å; Y63-Q67 PolarHBondContact O-N 2.98Å
64	Y	48.6	Very low	52	Low	88 Å²	88	93 Å²	93	35%	0.345	44%	0.441	S	S	.	.	H	α-helix	trans	-55.7	-42.2	170.7	-89.7	-71	0	0	0	112.1	R60 H61 K68 H99 E103	R60-Y64 HydrophobicContact CG-CD2 4.06Å; R60-Y64 HydrophobicContact CG-CE2 3.8Å; R60-Y64 WeakPolarHBondContact O-CB 3.24Å; R60-Y64 WeakPolarHBondContact O-CD2 3.26Å; R60-Y64 PolarHBondContact O-N 3.41Å; H61-Y64 WeakPolarHBondContact O-CB 3.46Å; H61-Y64 PolarHBondContact O-N 2.91Å; Y64-K68 WeakPolarHBondContact O-CB 3.41Å; Y64-K68 PolarHBondContact O-N 3.21Å; Y64-H99 AromaticContact CD1-CE1 3.26Å; Y64-H99 WeakPolarHBondContact CD1-CE1 3.4Å; Y64-H99 AromaticContact CD1-NE2 3.84Å; Y64-H99 AromaticContact CE1-CE1 3.12Å; Y64-H99 WeakPolarHBondContact CE1-CE1 3.29Å; Y64-H99 AromaticContact CE1-ND1 3.6Å; Y64-H99 AromaticContact CZ-CE1 3.94Å; Y64-E103 WeakPolarHBondContact CE2-OE1 3.38Å; Y64-E103 PolarHBondContact OH-OE1 3.46Å; Y64-E103 PolarHBondContact OH-OE2 3.08Å
65	H	53.3	Low	51.3	Low	126 Å²	126	89.3 Å²	89.3	58%	0.583	43%	0.426	S	S	*	.	H	α-helix	trans	-72.4	-39.5	-178.6	-154.5	-73.8	0	0	0	112.9	H61 I62 Y63 K68 L69	H61-H65 WeakPolarHBondContact O-CB 3.4Å; H61-H65 PolarHBondContact O-N 3.01Å; I62-H65 PolarHBondContact O-N 3.42Å; I62-H65 VanDerWaalsContact O-N 3.17Å; Y63-H65 VanDerWaalsContact C-N 3.29Å; Y63-H65 PolarHBondContact O-N 2.98Å; H65-K68 PolarHBondContact O-N 2.96Å; H65-L69 PolarHBondContact O-N 3.33Å
66	H	55.9	Low	50.6	Low	139 Å²	139	93.5 Å²	93.5	64%	0.644	45%	0.445	S	S	*	.	H	α-helix	trans	-73.7	-34.3	-179.1	-149.4	-57.8	0	0	0	112	I62 Y63 L69 S70	I62-H66 WeakPolarHBondContact O-CB 3.42Å; I62-H66 PolarHBondContact O-N 3.35Å; Y63-H66 PolarHBondContact O-N 3.42Å; H66-L69 PolarHBondContact O-N 3.44Å; H66-S70 PolarHBondContact O-N 3.38Å; H66-S70 PolarHBondContact O-OG 2.86Å
67	Q	52.8	Low	49.7	Very low	31 Å²	31	97.1 Å²	97.1	15%	0.145	47%	0.466	C	S	.	.	H	α-helix	trans	-72.4	-36.6	174.2	-165.4	162.2	18	0	0	111.4	Y63 S70 L71 H99	Y63-Q67 VanDerWaalsContact O-CB 3.28Å; Y63-Q67 WeakPolarHBondContact O-CB 3.23Å; Y63-Q67 PolarHBondContact O-N 2.98Å; Q67-S70 WeakPolarHBondContact CA-OG 3.46Å; Q67-S70 PolarHBondContact O-N 3.38Å; Q67-S70 PolarHBondContact O-OG 3.08Å; Q67-L71 HydrophobicContact CG-CD1 4.5Å; Q67-L71 PolarHBondContact O-N 2.91Å; Q67-L71 VanDerWaalsContact O-N 3.13Å; Q67-H99 PolarHBondContact OE1-CD2 3.16Å; Q67-H99 PolarHBondContact OE1-CE1 3.45Å; Q67-H99 PolarHBondContact OE1-NE2 3.1Å; Q67-H99 VanDerWaalsContact OE1-NE2 3.07Å
68	K	48.4	Very low	48.6	Very low	145 Å²	145	96.5 Å²	96.5	63%	0.63	47%	0.469	S	S	*	.	H	α-helix	trans	-63.3	-40.1	171.1	-166.4	175.7	-177.7	-175.3	0	111.9	Y64 H65 L71 I72	Y64-K68 WeakPolarHBondContact O-CB 3.41Å; Y64-K68 PolarHBondContact O-N 3.21Å; H65-K68 PolarHBondContact O-N 2.96Å; K68-L71 PolarHBondContact O-N 3.26Å; K68-I72 HydrophobicContact CG-CD1 4.45Å; K68-I72 WeakPolarHBondContact O-CD1 3.3Å; K68-I72 VanDerWaalsContact O-CG1 3.3Å; K68-I72 WeakPolarHBondContact O-CG1 3.5Å; K68-I72 PolarHBondContact O-N 3.16Å
69	L	51.2	Low	47.8	Very low	90 Å²	90	97.4 Å²	97.4	47%	0.471	48%	0.479	S	S	.	.	H	α-helix	trans	-67.1	-41.5	175.4	-122.5	82.3	0	0	0	113	H65 H66 L71 I72 N73	H65-L69 PolarHBondContact O-N 3.33Å; H66-L69 PolarHBondContact O-N 3.44Å; L69-L71 PolarHBondContact O-N 3.46Å; L69-I72 PolarHBondContact O-N 3.34Å; L69-N73 PolarHBondContact O-N 2.94Å; L69-N73 VanDerWaalsContact O-N 3.14Å
70	S	48.5	Very low	47	Very low	60 Å²	60	100.7 Å²	100.7	42%	0.42	51%	0.505	S	S	.	.	H	α-helix	trans	-64.7	-31.2	176.9	57.2	0	0	0	0	112.7	H66 Q67 T74	H66-S70 PolarHBondContact O-N 3.38Å; H66-S70 PolarHBondContact O-OG 2.86Å; Q67-S70 WeakPolarHBondContact CA-OG 3.46Å; Q67-S70 PolarHBondContact O-N 3.38Å; Q67-S70 PolarHBondContact O-OG 3.08Å; S70-T74 WeakPolarHBondContact O-CG2 3.49Å; S70-T74 PolarHBondContact O-N 3.42Å; S70-T74 VanDerWaalsContact O-N 3.16Å; S70-T74 PolarHBondContact O-OG1 2.72Å; S70-T74 VanDerWaalsContact O-OG1 3.12Å
71	L	45.4	Very low	45.9	Very low	45 Å²	45	97.7 Å²	97.7	24%	0.236	50%	0.504	C	S	.	.	H	α-helix	trans	-72	-34.1	175.6	-108.7	125	0	0	0	112.7	Q67 K68 L69 T74 N75 I95	Q67-L71 HydrophobicContact CG-CD1 4.5Å; Q67-L71 PolarHBondContact O-N 2.91Å; Q67-L71 VanDerWaalsContact O-N 3.13Å; K68-L71 PolarHBondContact O-N 3.26Å; L69-L71 PolarHBondContact O-N 3.46Å; L71-T74 WeakPolarHBondContact CA-OG1 3.32Å; L71-T74 PolarHBondContact O-OG1 3.13Å; L71-N75 WeakPolarHBondContact O-CB 3.39Å; L71-N75 PolarHBondContact O-N 2.71Å; L71-N75 VanDerWaalsContact O-N 3.12Å; L71-N75 PolarHBondContact O-ND2 2.81Å; L71-N75 PolarHBondContact O-OD1 3.27Å; L71-I95 HydrophobicContact CD1-CG2 3.99Å; L71-I95 HydrophobicContact CD2-CB 4.43Å; L71-I95 HydrophobicContact CD2-CD1 3.49Å; L71-I95 VanDerWaalsContact CD2-CD1 3.49Å; L71-I95 HydrophobicContact CD2-CG1 3.83Å; L71-I95 HydrophobicContact CD2-CG2 3.7Å
72	I	49.6	Very low	44.9	Very low	83 Å²	83	101.3 Å²	101.3	43%	0.426	51%	0.513	S	S	.	.	H	α-helix	trans	-67.5	-44.7	175.6	-66.9	162.9	0	0	0	109.8	K68 L69 T74 N75 E76	K68-I72 HydrophobicContact CG-CD1 4.45Å; K68-I72 WeakPolarHBondContact O-CD1 3.3Å; K68-I72 VanDerWaalsContact O-CG1 3.3Å; K68-I72 WeakPolarHBondContact O-CG1 3.5Å; K68-I72 PolarHBondContact O-N 3.16Å; L69-I72 PolarHBondContact O-N 3.34Å; I72-T74 PolarHBondContact O-N 3.39Å; I72-N75 PolarHBondContact O-N 3.32Å; I72-E76 PolarHBondContact O-N 2.95Å
73	N	44	Very low	43.5	Very low	95 Å²	95	106 Å²	106	51%	0.508	54%	0.538	S	S	.	.	H	α-helix	trans	-66.7	-33.6	177.8	-79.9	14.9	0	0	0	113.8	L69 N75 L77	L69-N73 PolarHBondContact O-N 2.94Å; L69-N73 VanDerWaalsContact O-N 3.14Å; N73-N75 VanDerWaalsContact C-N 3.35Å; N73-L77 WeakPolarHBondContact O-CD1 3.43Å; N73-L77 PolarHBondContact O-N 2.73Å
74	T	45.6	Very low	42.8	Very low	80 Å²	80	109.9 Å²	109.9	49%	0.491	56%	0.559	S	S	.	*	H	α-helix	trans	-72.7	-30.4	174.4	48.3	0	0	0	0	112.5	S70 L71 I72 C78	S70-T74 WeakPolarHBondContact O-CG2 3.49Å; S70-T74 PolarHBondContact O-N 3.42Å; S70-T74 VanDerWaalsContact O-N 3.16Å; S70-T74 PolarHBondContact O-OG1 2.72Å; S70-T74 VanDerWaalsContact O-OG1 3.12Å; L71-T74 WeakPolarHBondContact CA-OG1 3.32Å; L71-T74 PolarHBondContact O-OG1 3.13Å; I72-T74 PolarHBondContact O-N 3.39Å; T74-C78 PolarHBondContact O-N 2.82Å
75	N	40.8	Very low	42	Very low	68 Å²	68	114.6 Å²	114.6	36%	0.364	58%	0.584	S	S	.	*	H	α-helix	trans	-77.2	-31.4	177.1	-70	-3.6	0	0	0	111.7	L71 I72 N73 C78 N79	L71-N75 WeakPolarHBondContact O-CB 3.39Å; L71-N75 PolarHBondContact O-N 2.71Å; L71-N75 VanDerWaalsContact O-N 3.12Å; L71-N75 PolarHBondContact O-ND2 2.81Å; L71-N75 PolarHBondContact O-OD1 3.27Å; I72-N75 PolarHBondContact O-N 3.32Å; N73-N75 VanDerWaalsContact C-N 3.35Å; N75-C78 PolarHBondContact O-N 3.25Å; N75-N79 VanDerWaalsContact O-CB 3.26Å; N75-N79 WeakPolarHBondContact O-CB 3.33Å; N75-N79 PolarHBondContact O-N 3.26Å; N75-N79 PolarHBondContact O-ND2 2.85Å; N75-N79 PolarHBondContact O-OD1 3.15Å
76	E	39.1	Very low	41.2	Very low	130 Å²	130	115.4 Å²	115.4	61%	0.607	59%	0.593	S	S	*	*	H	α-helix	trans	-68.7	-32.7	172.4	-81.6	-174.6	155.1	0	0	113.3	I72	I72-E76 PolarHBondContact O-N 2.95Å
77	L	35.9	Very low	40.3	Very low	140 Å²	140	115 Å²	115	73%	0.733	60%	0.595	S	S	*	*	H	α-helix	trans	-77.2	-20.1	172.9	-93.6	100.4	0	0	0	114.1	N73	N73-L77 WeakPolarHBondContact O-CD1 3.43Å; N73-L77 PolarHBondContact O-N 2.73Å
78	C	33.9	Very low	39.7	Very low	85 Å²	85	116.5 Å²	116.5	57%	0.574	62%	0.62	S	S	*	*	H	α-helix	trans	-93.7	-21.4	175.4	-86.4	0	0	0	0	113.5	T74 N75 T80 S81	T74-C78 PolarHBondContact O-N 2.82Å; N75-C78 PolarHBondContact O-N 3.25Å; C78-T80 PolarHBondContact O-N 3.35Å; C78-S81 PolarHBondContact O-N 2.89Å
79	N	36.2	Very low	39.4	Very low	136 Å²	136	115.7 Å²	115.7	73%	0.727	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-1.3	-178.3	-79.1	-8.3	0	0	0	114.7	N75	N75-N79 VanDerWaalsContact O-CB 3.26Å; N75-N79 WeakPolarHBondContact O-CB 3.33Å; N75-N79 PolarHBondContact O-N 3.26Å; N75-N79 PolarHBondContact O-ND2 2.85Å; N75-N79 PolarHBondContact O-OD1 3.15Å
80	T	36.3	Very low	39	Very low	126 Å²	126	117.3 Å²	117.3	77%	0.773	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	5	173	46.7	0	0	0	0	113.5	C78	C78-T80 PolarHBondContact O-N 3.35Å
81	S	33.9	Very low	38.6	Very low	65 Å²	65	120.9 Å²	120.9	46%	0.455	64%	0.641	S	S	.	*	S	Bend	trans	-138	121.2	173.5	30.7	0	0	0	0	110	C78	C78-S81 PolarHBondContact O-N 2.89Å
82	Y	31.9	Very low	38.3	Very low	220 Å²	220	123.3 Å²	123.3	86%	0.863	65%	0.654	S	S	*	*			trans	87.1	83.6	174	-53.1	-79.5	0	0	0	117.5	H84	Y82-H84 PolarHBondContact O-N 2.9Å; Y82-H84 VanDerWaalsContact O-N 3.15Å
83	L	29.5	Very low	37.9	Very low	175 Å²	175	123.5 Å²	123.5	92%	0.916	66%	0.656	S	S	*	*			trans	-54.6	100	138.6	-87	136.6	0	0	0	108.9
84	H	37.8	Very low	37.7	Very low	180 Å²	180	124.8 Å²	124.8	83%	0.833	66%	0.659	S	S	*	*			trans	-159.9	115.7	147.6	-118	-82.3	0	0	0	109.2	Y82 D86	Y82-H84 PolarHBondContact O-N 2.9Å; Y82-H84 VanDerWaalsContact O-N 3.15Å; H84-D86 PolarHBondContact O-N 3.19Å
85	E	32.2	Very low	37.5	Very low	187 Å²	187	123.1 Å²	123.1	87%	0.874	65%	0.647	S	S	*	*			trans	-58.1	114.2	171.3	-68	173.8	128.7	0	0	109.8
86	D	35.8	Very low	37.6	Very low	143 Å²	143	123.9 Å²	123.9	77%	0.765	65%	0.65	S	S	*	*			trans	-161	116.6	151.9	-121.3	-33.8	0	0	0	113	H84	H84-D86 PolarHBondContact O-N 3.19Å
87	N	38.2	Very low	37.6	Very low	130 Å²	130	123.5 Å²	123.5	70%	0.695	65%	0.648	S	S	*	*			trans	57.4	78.9	157.5	-74.7	-57.7	0	0	0	120	N89	N87-N89 PolarHBondContact O-N 3.34Å
88	G	40.5	Very low	37.9	Very low	63 Å²	63	121.2 Å²	121.2	65%	0.649	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	22.3	177.3	0	0	0	0	0	119.2
89	N	42.2	Very low	38	Very low	129 Å²	129	118.8 Å²	118.8	69%	0.69	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-28	177.4	-99	-15.8	0	0	0	114.4	N87	N87-N89 PolarHBondContact O-N 3.34Å
90	N	41.7	Very low	38.2	Very low	123 Å²	123	115.7 Å²	115.7	66%	0.658	60%	0.597	S	S	*	*	H	α-helix	trans	-79.2	-26.3	-175.6	-81	-25.1	0	0	0	113.8	H94	N90-H94 PolarHBondContact O-N 3.4Å
91	H	39.8	Very low	38.3	Very low	136 Å²	136	112.8 Å²	112.8	63%	0.63	58%	0.581	S	S	*	*	H	α-helix	trans	-74.7	-39.3	-175.1	-134.3	-19.1	0	0	0	112.1	H94 I95	H91-H94 PolarHBondContact O-N 2.99Å; H91-I95 WeakPolarHBondContact O-CD1 3.46Å; H91-I95 VanDerWaalsContact O-CG1 3.29Å; H91-I95 WeakPolarHBondContact O-CG1 3.22Å; H91-I95 PolarHBondContact O-N 3.4Å
92	N	40.3	Very low	38.5	Very low	96 Å²	96	112.3 Å²	112.3	51%	0.513	57%	0.574	S	S	.	*	H	α-helix	trans	-66.6	-37.7	177	-70.3	-33.5	0	0	0	111.9	I95 I96	N92-I95 PolarHBondContact O-N 3.25Å; N92-I96 WeakPolarHBondContact O-CB 3.28Å; N92-I96 WeakPolarHBondContact O-CD1 3.39Å; N92-I96 WeakPolarHBondContact O-CG1 3.41Å; N92-I96 PolarHBondContact O-N 2.94Å
93	D	40.9	Very low	38.8	Very low	87 Å²	87	104 Å²	104	47%	0.465	54%	0.543	S	S	.	.	H	α-helix	trans	-67.9	-38	178.3	-83.3	-20.2	0	0	0	112.7	I96 Q97	D93-I96 PolarHBondContact O-N 3.06Å; D93-Q97 WeakPolarHBondContact O-CG 3.5Å; D93-Q97 PolarHBondContact O-N 3.41Å
94	H	39	Very low	39.2	Very low	121 Å²	121	100.2 Å²	100.2	56%	0.56	52%	0.521	S	S	*	.	H	α-helix	trans	-65.4	-39.9	175	-104.1	-69.3	0	0	0	112.5	N90 H91 Q97 I98	N90-H94 PolarHBondContact O-N 3.4Å; H91-H94 PolarHBondContact O-N 2.99Å; H94-Q97 PolarHBondContact O-N 3.44Å; H94-I98 WeakPolarHBondContact O-CD1 3.5Å; H94-I98 VanDerWaalsContact O-CG1 3.28Å; H94-I98 WeakPolarHBondContact O-CG1 3.44Å; H94-I98 PolarHBondContact O-N 3.47Å
95	I	41.8	Very low	39.1	Very low	46 Å²	46	95.1 Å²	95.1	24%	0.236	50%	0.499	C	S	.	.	H	α-helix	trans	-66.7	-42.7	177.7	-66	164.2	0	0	0	110.3	L71 H91 N92 Q97 I98 H99	L71-I95 HydrophobicContact CD1-CG2 3.99Å; L71-I95 HydrophobicContact CD2-CB 4.43Å; L71-I95 HydrophobicContact CD2-CD1 3.49Å; L71-I95 VanDerWaalsContact CD2-CD1 3.49Å; L71-I95 HydrophobicContact CD2-CG1 3.83Å; L71-I95 HydrophobicContact CD2-CG2 3.7Å; H91-I95 WeakPolarHBondContact O-CD1 3.46Å; H91-I95 VanDerWaalsContact O-CG1 3.29Å; H91-I95 WeakPolarHBondContact O-CG1 3.22Å; H91-I95 PolarHBondContact O-N 3.4Å; N92-I95 PolarHBondContact O-N 3.25Å; I95-Q97 PolarHBondContact O-N 3.39Å; I95-I98 PolarHBondContact O-N 3.12Å; I95-H99 WeakPolarHBondContact O-CB 3.28Å; I95-H99 PolarHBondContact O-N 3.01Å
96	I	42.3	Very low	39.3	Very low	83 Å²	83	89.9 Å²	89.9	43%	0.426	47%	0.473	S	S	.	.	H	α-helix	trans	-64.4	-38.8	177.2	-67.4	164.4	0	0	0	111.1	N92 D93 H99 E100	N92-I96 WeakPolarHBondContact O-CB 3.28Å; N92-I96 WeakPolarHBondContact O-CD1 3.39Å; N92-I96 WeakPolarHBondContact O-CG1 3.41Å; N92-I96 PolarHBondContact O-N 2.94Å; D93-I96 PolarHBondContact O-N 3.06Å; I96-H99 PolarHBondContact O-N 3.01Å; I96-E100 VanDerWaalsContact O-CB 3.3Å; I96-E100 WeakPolarHBondContact O-CB 3.47Å; I96-E100 PolarHBondContact O-N 3.37Å
97	Q	39.3	Very low	39.4	Very low	123 Å²	123	87 Å²	87	58%	0.575	46%	0.461	S	S	*	.	H	α-helix	trans	-68.2	-38	176	-76.2	-170.6	-2.1	0	0	113.5	D93 H94 I95 H99 S101	D93-Q97 WeakPolarHBondContact O-CG 3.5Å; D93-Q97 PolarHBondContact O-N 3.41Å; H94-Q97 PolarHBondContact O-N 3.44Å; I95-Q97 PolarHBondContact O-N 3.39Å; Q97-H99 VanDerWaalsContact C-N 3.3Å; Q97-S101 VanDerWaalsContact O-CB 3.29Å; Q97-S101 WeakPolarHBondContact O-CB 3.38Å; Q97-S101 PolarHBondContact O-N 3.12Å; Q97-S101 PolarHBondContact O-OG 2.99Å
98	I	43.1	Very low	39.5	Very low	91 Å²	91	88 Å²	88	47%	0.467	46%	0.459	S	S	.	.	H	α-helix	trans	-67.3	-35.7	173.9	-65.7	165.1	0	0	0	110.4	H94 I95 S101 N102	H94-I98 WeakPolarHBondContact O-CD1 3.5Å; H94-I98 VanDerWaalsContact O-CG1 3.28Å; H94-I98 WeakPolarHBondContact O-CG1 3.44Å; H94-I98 PolarHBondContact O-N 3.47Å; I95-I98 PolarHBondContact O-N 3.12Å; I98-S101 WeakPolarHBondContact CA-OG 3.46Å; I98-S101 PolarHBondContact O-OG 3.44Å; I98-N102 PolarHBondContact O-N 3.06Å; I98-N102 PolarHBondContact O-ND2 3.09Å
99	H	36.2	Very low	39.9	Very low	34 Å²	34	87.3 Å²	87.3	16%	0.157	44%	0.443	C	S	.	.	H	α-helix	trans	-69.9	-43.9	177.4	-142.5	-77.4	0	0	0	112	Y64 Q67 I95 I96 Q97 N102 E103	Y64-H99 AromaticContact CD1-CE1 3.26Å; Y64-H99 WeakPolarHBondContact CD1-CE1 3.4Å; Y64-H99 AromaticContact CD1-NE2 3.84Å; Y64-H99 AromaticContact CE1-CE1 3.12Å; Y64-H99 WeakPolarHBondContact CE1-CE1 3.29Å; Y64-H99 AromaticContact CE1-ND1 3.6Å; Y64-H99 AromaticContact CZ-CE1 3.94Å; Q67-H99 PolarHBondContact OE1-CD2 3.16Å; Q67-H99 PolarHBondContact OE1-CE1 3.45Å; Q67-H99 PolarHBondContact OE1-NE2 3.1Å; Q67-H99 VanDerWaalsContact OE1-NE2 3.07Å; I95-H99 WeakPolarHBondContact O-CB 3.28Å; I95-H99 PolarHBondContact O-N 3.01Å; I96-H99 PolarHBondContact O-N 3.01Å; Q97-H99 VanDerWaalsContact C-N 3.3Å; H99-N102 PolarHBondContact O-N 3.39Å; H99-E103 WeakPolarHBondContact O-CB 3.36Å; H99-E103 PolarHBondContact O-N 3.39Å
100	E	40.3	Very low	40.6	Very low	72 Å²	72	85.6 Å²	85.6	34%	0.336	44%	0.437	S	S	.	.	H	α-helix	trans	-71.1	-35.6	-179.2	-161.2	169	-175.9	0	0	111.8	I96 Q104 R486	I96-E100 VanDerWaalsContact O-CB 3.3Å; I96-E100 WeakPolarHBondContact O-CB 3.47Å; I96-E100 PolarHBondContact O-N 3.37Å; E100-Q104 WeakPolarHBondContact O-CB 3.47Å; E100-Q104 VanDerWaalsContact O-CG 3.24Å; E100-Q104 WeakPolarHBondContact O-CG 3.42Å; E100-Q104 PolarHBondContact O-N 3.16Å; E100-R486 IonicContact OE1-NH1 3.19Å; E100-R486 IonicContact OE2-NH1 3.01Å; E100-R486 PolarHBondContact OE2-NH1 3.21Å
101	S	37	Very low	42	Very low	64 Å²	64	81 Å²	81	45%	0.448	42%	0.419	S	S	.	.	H	α-helix	trans	-66.1	-39	175	61.5	0	0	0	0	112.8	Q97 I98 L105	Q97-S101 VanDerWaalsContact O-CB 3.29Å; Q97-S101 WeakPolarHBondContact O-CB 3.38Å; Q97-S101 PolarHBondContact O-N 3.12Å; Q97-S101 PolarHBondContact O-OG 2.99Å; I98-S101 WeakPolarHBondContact CA-OG 3.46Å; I98-S101 PolarHBondContact O-OG 3.44Å; S101-L105 VanDerWaalsContact O-CB 3.31Å; S101-L105 WeakPolarHBondContact O-CB 3.36Å; S101-L105 PolarHBondContact O-N 3.5Å
102	N	38.5	Very low	43.8	Very low	55 Å²	55	75.3 Å²	75.3	29%	0.294	39%	0.394	S	S	.	.	H	α-helix	trans	-75.1	-34.9	176.7	-74.5	-50.9	0	0	0	112.8	I98 H99 L105 F106	I98-N102 PolarHBondContact O-N 3.06Å; I98-N102 PolarHBondContact O-ND2 3.09Å; H99-N102 PolarHBondContact O-N 3.39Å; N102-L105 WeakPolarHBondContact O-CB 3.5Å; N102-L105 PolarHBondContact O-N 3.11Å; N102-F106 PolarHBondContact O-N 3.37Å
103	E	39.2	Very low	45.9	Very low	47 Å²	47	71.4 Å²	71.4	22%	0.22	37%	0.373	C	S	.	.	H	α-helix	trans	-70.9	-36.7	175.7	-133.1	-174.8	165.5	0	0	112	R60 Y64 H99 L105 F106 T107	R60-E103 IonicContact CZ-OE1 2.67Å; R60-E103 IonicContact NE-OE1 3.96Å; R60-E103 PolarHBondContact NE-OE1 2.98Å; R60-E103 IonicContact NH2-OE1 3.17Å; R60-E103 PolarHBondContact NH2-OE1 3.4Å; Y64-E103 WeakPolarHBondContact CE2-OE1 3.38Å; Y64-E103 PolarHBondContact OH-OE1 3.46Å; Y64-E103 PolarHBondContact OH-OE2 3.08Å; H99-E103 WeakPolarHBondContact O-CB 3.36Å; H99-E103 PolarHBondContact O-N 3.39Å; E103-L105 VanDerWaalsContact C-N 3.35Å; E103-F106 PolarHBondContact O-N 3.44Å; E103-T107 WeakPolarHBondContact O-CG2 3.41Å; E103-T107 PolarHBondContact O-N 3.02Å; E103-T107 PolarHBondContact O-OG1 3.35Å
104	Q	37	Very low	47.9	Very low	95 Å²	95	68.5 Å²	68.5	44%	0.444	36%	0.359	S	S	.	.	H	α-helix	trans	-70.1	-31.6	169.3	-70.1	-176.7	19.2	0	0	111.6	E100 K108	E100-Q104 WeakPolarHBondContact O-CB 3.47Å; E100-Q104 VanDerWaalsContact O-CG 3.24Å; E100-Q104 WeakPolarHBondContact O-CG 3.42Å; E100-Q104 PolarHBondContact O-N 3.16Å; Q104-K108 WeakPolarHBondContact O-CB 3.46Å; Q104-K108 PolarHBondContact O-N 2.99Å
105	L	36.5	Very low	50.3	Low	73 Å²	73	64.3 Å²	64.3	38%	0.382	34%	0.339	S	S	.	.	H	α-helix	trans	-66.3	-37.1	174.2	-159.2	79	0	0	0	112	S101 N102 E103 T109	S101-L105 VanDerWaalsContact O-CB 3.31Å; S101-L105 WeakPolarHBondContact O-CB 3.36Å; S101-L105 PolarHBondContact O-N 3.5Å; N102-L105 WeakPolarHBondContact O-CB 3.5Å; N102-L105 PolarHBondContact O-N 3.11Å; E103-L105 VanDerWaalsContact C-N 3.35Å; L105-T109 WeakPolarHBondContact O-CG2 3.23Å
106	F	35.7	Very low	52.7	Low	76 Å²	76	62.1 Å²	62.1	33%	0.333	33%	0.328	S	S	.	.	H	α-helix	trans	-79.2	-38.1	-178.7	-166	-101	0	0	0	112.7	Y59 N102 E103 T109	Y59-F106 HydrophobicContact CD1-CZ 4.49Å; Y59-F106 HydrophobicContact CE1-CZ 4.17Å; N102-F106 PolarHBondContact O-N 3.37Å; E103-F106 PolarHBondContact O-N 3.44Å; F106-T109 PolarHBondContact O-OG1 3.38Å
107	T	37.2	Very low	55	Low	83 Å²	83	58.8 Å²	58.8	51%	0.509	31%	0.311	S	S	.	.	H	α-helix	trans	-83	-21.4	179	53.8	0	0	0	0	114	E103 T109	E103-T107 WeakPolarHBondContact O-CG2 3.41Å; E103-T107 PolarHBondContact O-N 3.02Å; E103-T107 PolarHBondContact O-OG1 3.35Å; T107-T109 VanDerWaalsContact C-N 3.31Å; T107-T109 PolarHBondContact O-N 3Å
108	K	41.5	Very low	57.5	Low	151 Å²	151	55.1 Å²	55.1	66%	0.657	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	15.6	177	-155.4	178.9	-173	-179.9	0	113.3	Q104 T110	Q104-K108 WeakPolarHBondContact O-CB 3.46Å; Q104-K108 PolarHBondContact O-N 2.99Å; K108-T110 VanDerWaalsContact C-N 3.27Å; K108-T110 PolarHBondContact O-N 3.37Å
109	T	49.6	Very low	60	Low	48 Å²	48	51.6 Å²	51.6	29%	0.294	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	0.9	175.7	42.2	0	0	0	0	114.3	L105 F106 T107 G111 T114	L105-T109 WeakPolarHBondContact O-CG2 3.23Å; F106-T109 PolarHBondContact O-OG1 3.38Å; T107-T109 VanDerWaalsContact C-N 3.31Å; T107-T109 PolarHBondContact O-N 3Å; T109-G111 PolarHBondContact O-N 3.37Å; T109-T114 WeakPolarHBondContact O-CB 3.18Å; T109-T114 PolarHBondContact O-OG1 3.3Å
110	T	56.7	Low	62.8	Low	94 Å²	94	50.2 Å²	50.2	58%	0.577	27%	0.271	S	S	*	.			trans	-79.1	44.9	169.2	52.3	0	0	0	0	112.1	K108	K108-T110 VanDerWaalsContact C-N 3.27Å; K108-T110 PolarHBondContact O-N 3.37Å
111	G	69.4	Low	65.4	Low	26 Å²	26	46.8 Å²	46.8	27%	0.268	26%	0.255	S	S	.	.	S	Bend	trans	-75.9	173.9	173.5	0	0	0	0	0	111.8	T109 P113 T114 F115	T109-G111 PolarHBondContact O-N 3.37Å; G111-P113 VanDerWaalsContact C-N 3.27Å; G111-T114 PolarHBondContact O-N 2.83Å; G111-F115 PolarHBondContact O-N 3.12Å
112	T	79.5	Confident	68.2	Low	17 Å²	17	47 Å²	47	10%	0.104	26%	0.256	C	S	.	.	H	α-helix	trans	-50.9	-36.9	171.7	42.9	0	0	0	0	113.5	T114 F115 F116 E175 M190 A193	T112-T114 PolarHBondContact O-N 2.92Å; T112-F115 WeakPolarHBondContact O-CB 3.34Å; T112-F115 PolarHBondContact O-N 3.46Å; T112-F116 VanDerWaalsContact O-CD2 3.29Å; T112-F116 WeakPolarHBondContact O-CD2 3.42Å; T112-F116 PolarHBondContact O-N 3.03Å; T112-F116 VanDerWaalsContact O-N 3.07Å; T112-E175 WeakPolarHBondContact CB-OE1 3.49Å; T112-E175 PolarHBondContact OG1-OE1 3.24Å; T112-M190 WeakPolarHBondContact CA-SD 3.19Å; T112-M190 HydrophobicContact CG2-CG 4.38Å; T112-M190 HydrophobicContact CG2-SD 3.34Å; T112-M190 WeakPolarHBondContact CG2-SD 3.3Å; T112-M190 PolarHBondContact N-SD 2.65Å; T112-A193 HydrophobicContact CG2-CB 4.38Å
113	P	82.4	Confident	71	Confident	14 Å²	14	45.3 Å²	45.3	9%	0.091	25%	0.248	C	C	.	.	H	α-helix	trans	-62.3	-43.7	178	3.6	-8.4	0	0	0	113.1	G111 F115 F116 I117	G111-P113 VanDerWaalsContact C-N 3.27Å; P113-F115 VanDerWaalsContact C-N 3.26Å; P113-F115 PolarHBondContact O-N 2.98Å; P113-F116 PolarHBondContact O-N 3.02Å; P113-I117 VanDerWaalsContact O-CG1 3.28Å; P113-I117 WeakPolarHBondContact O-CG1 3.48Å; P113-I117 PolarHBondContact O-N 3.49Å
114	T	84.3	Confident	73.8	Confident	25 Å²	25	43.2 Å²	43.2	15%	0.153	24%	0.238	C	C	.	.	H	α-helix	trans	-67	-31.9	179.6	-63.4	0	0	0	0	111.5	Y46 T109 G111 T112 I117 L118	Y46-T114 HydrophobicContact CD1-CG2 3.49Å; Y46-T114 VanDerWaalsContact CD1-CG2 3.49Å; Y46-T114 HydrophobicContact CE1-CG2 3.76Å; Y46-T114 HydrophobicContact CG-CG2 4.44Å; T109-T114 WeakPolarHBondContact O-CB 3.18Å; T109-T114 PolarHBondContact O-OG1 3.3Å; G111-T114 PolarHBondContact O-N 2.83Å; T112-T114 PolarHBondContact O-N 2.92Å; T114-I117 PolarHBondContact O-N 2.99Å; T114-L118 HydrophobicContact CG2-CD1 4.39Å; T114-L118 WeakPolarHBondContact O-CB 3.47Å; T114-L118 WeakPolarHBondContact O-CG 3.3Å; T114-L118 PolarHBondContact O-N 3.39Å
115	F	88.9	Confident	76.7	Confident	34 Å²	34	40.1 Å²	40.1	15%	0.149	22%	0.224	C	C	.	.	H	α-helix	trans	-62	-48.9	170.7	168.2	-102.1	0	0	0	111.9	G111 T112 P113 I117 L118 V119 M190 A193 K194	G111-F115 PolarHBondContact O-N 3.12Å; T112-F115 WeakPolarHBondContact O-CB 3.34Å; T112-F115 PolarHBondContact O-N 3.46Å; P113-F115 VanDerWaalsContact C-N 3.26Å; P113-F115 PolarHBondContact O-N 2.98Å; F115-I117 VanDerWaalsContact C-N 3.34Å; F115-I117 PolarHBondContact O-N 3.03Å; F115-L118 WeakPolarHBondContact O-CB 3.34Å; F115-L118 PolarHBondContact O-N 2.83Å; F115-L118 VanDerWaalsContact O-N 3.16Å; F115-V119 HydrophobicContact CD1-CG2 4.39Å; F115-V119 HydrophobicContact CD2-CG2 4.22Å; F115-V119 HydrophobicContact CE1-CG2 3.93Å; F115-V119 HydrophobicContact CE2-CG2 3.73Å; F115-V119 HydrophobicContact CZ-CG2 3.57Å; F115-V119 WeakPolarHBondContact O-CG2 3.45Å; F115-V119 PolarHBondContact O-N 3.32Å; F115-M190 HydrophobicContact CB-CE 3.59Å; F115-M190 HydrophobicContact CG-CE 4.24Å; F115-A193 HydrophobicContact CD1-CB 4.11Å; F115-A193 HydrophobicContact CE1-CB 4.03Å; F115-K194 HydrophobicContact CD2-CG 4.29Å; F115-K194 HydrophobicContact CE1-CG 4.47Å; F115-K194 HydrophobicContact CE2-CG 3.64Å; F115-K194 HydrophobicContact CZ-CB 4.34Å; F115-K194 HydrophobicContact CZ-CG 3.75Å
116	F	91.8	Very high	79.5	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65	-35.6	177.7	-79.2	-74.1	0	0	0	113.1	T112 P113 L118 V119 L120 L168 A171 I172 E175 L188 A193	T112-F116 VanDerWaalsContact O-CD2 3.29Å; T112-F116 WeakPolarHBondContact O-CD2 3.42Å; T112-F116 PolarHBondContact O-N 3.03Å; T112-F116 VanDerWaalsContact O-N 3.07Å; P113-F116 PolarHBondContact O-N 3.02Å; F116-L118 VanDerWaalsContact C-N 3.33Å; F116-L118 PolarHBondContact O-N 3Å; F116-V119 PolarHBondContact O-N 3.5Å; F116-L120 WeakPolarHBondContact O-CG 3.29Å; F116-L120 PolarHBondContact O-N 3.27Å; F116-L168 HydrophobicContact CD1-CD1 4.09Å; F116-L168 HydrophobicContact CE1-CD1 4.17Å; F116-A171 HydrophobicContact CE1-CB 4.3Å; F116-I172 HydrophobicContact CB-CD1 4.5Å; F116-I172 HydrophobicContact CB-CG1 4.04Å; F116-I172 HydrophobicContact CD1-CD1 4.33Å; F116-I172 HydrophobicContact CD1-CG1 3.52Å; F116-I172 HydrophobicContact CE1-CG1 4.17Å; F116-I172 HydrophobicContact CG-CG1 3.88Å; F116-E175 HydrophobicContact CD2-CG 4.23Å; F116-E175 HydrophobicContact CE2-CB 3.94Å; F116-E175 HydrophobicContact CE2-CG 3.73Å; F116-E175 HydrophobicContact CZ-CB 4.44Å; F116-L188 HydrophobicContact CE2-CD2 4.37Å; F116-A193 HydrophobicContact CE2-CB 4.12Å; F116-A193 HydrophobicContact CZ-CB 4.29Å
117	I	90.9	Very high	82.5	Confident	13 Å²	13	37.7 Å²	37.7	7%	0.067	21%	0.213	C	C	.	.	H	α-helix	trans	-61.1	-41.9	172.5	-69.1	167.2	0	0	0	111.2	V42 Y46 P113 T114 F115 A121 L383 Y426	V42-I117 HydrophobicContact CG1-CG2 4.18Å; Y46-I117 HydrophobicContact CD2-CG2 4.19Å; Y46-I117 HydrophobicContact CE2-CG2 3.69Å; P113-I117 VanDerWaalsContact O-CG1 3.28Å; P113-I117 WeakPolarHBondContact O-CG1 3.48Å; P113-I117 PolarHBondContact O-N 3.49Å; T114-I117 PolarHBondContact O-N 2.99Å; F115-I117 VanDerWaalsContact C-N 3.34Å; F115-I117 PolarHBondContact O-N 3.03Å; I117-A121 WeakPolarHBondContact O-CB 3.45Å; I117-A121 PolarHBondContact O-N 3.18Å; I117-L383 HydrophobicContact CG1-CD2 4.42Å; I117-Y426 HydrophobicContact CD1-CE1 4.14Å; I117-Y426 HydrophobicContact CG1-CE1 3.95Å; I117-Y426 HydrophobicContact CG2-CE1 4.1Å; I117-Y426 HydrophobicContact CG2-CE2 4.07Å
118	L	92.2	Very high	85.4	Confident	45 Å²	45	33.7 Å²	33.7	24%	0.236	19%	0.189	C	C	.	.	H	α-helix	trans	-67.5	-41.2	176.1	-77.1	171.2	0	0	0	112	L43 Y46 I47 T114 F115 F116 A121 C122	L43-L118 HydrophobicContact CD2-CD2 3.97Å; Y46-L118 HydrophobicContact CG-CD2 4.4Å; I47-L118 HydrophobicContact CD1-CD2 4.28Å; I47-L118 HydrophobicContact CG1-CD2 3.94Å; T114-L118 HydrophobicContact CG2-CD1 4.39Å; T114-L118 WeakPolarHBondContact O-CB 3.47Å; T114-L118 WeakPolarHBondContact O-CG 3.3Å; T114-L118 PolarHBondContact O-N 3.39Å; F115-L118 WeakPolarHBondContact O-CB 3.34Å; F115-L118 PolarHBondContact O-N 2.83Å; F115-L118 VanDerWaalsContact O-N 3.16Å; F116-L118 VanDerWaalsContact C-N 3.33Å; F116-L118 PolarHBondContact O-N 3Å; L118-A121 PolarHBondContact O-N 2.8Å; L118-C122 PolarHBondContact O-N 3.06Å; L118-C122 PolarHBondContact O-SG 3.04Å; L118-C122 VanDerWaalsContact O-SG 3.42Å
119	V	94.5	Very high	88.1	Confident	17 Å²	17	28.9 Å²	28.9	10%	0.103	17%	0.173	C	C	.	.	H	α-helix	trans	-59.8	-48.9	175.4	170.8	0	0	0	0	110.3	F115 F116 A121 C122 V123 L168 T197	F115-V119 HydrophobicContact CD1-CG2 4.39Å; F115-V119 HydrophobicContact CD2-CG2 4.22Å; F115-V119 HydrophobicContact CE1-CG2 3.93Å; F115-V119 HydrophobicContact CE2-CG2 3.73Å; F115-V119 HydrophobicContact CZ-CG2 3.57Å; F115-V119 WeakPolarHBondContact O-CG2 3.45Å; F115-V119 PolarHBondContact O-N 3.32Å; F116-V119 PolarHBondContact O-N 3.5Å; V119-A121 PolarHBondContact O-N 3.27Å; V119-C122 PolarHBondContact O-N 3.18Å; V119-V123 HydrophobicContact CG1-CG2 4.16Å; V119-V123 WeakPolarHBondContact O-CB 3.35Å; V119-V123 WeakPolarHBondContact O-CG2 3.48Å; V119-V123 PolarHBondContact O-N 3.27Å; V119-L168 HydrophobicContact CG1-CD1 3.92Å; V119-L168 HydrophobicContact CG1-CD2 4Å; V119-T197 HydrophobicContact CG1-CG2 3.75Å; V119-T197 HydrophobicContact CG2-CG2 4.12Å
120	L	95	Very high	90.4	Very high	6 Å²	6	33 Å²	33	3%	0.031	19%	0.188	C	C	.	.	H	α-helix	trans	-54	-53.8	174.8	-76	168.4	0	0	0	110.8	F116 C122 V123 D124 L168 I172 L383 V386	F116-L120 WeakPolarHBondContact O-CG 3.29Å; F116-L120 PolarHBondContact O-N 3.27Å; L120-C122 VanDerWaalsContact C-N 3.29Å; L120-C122 PolarHBondContact O-N 3.49Å; L120-V123 PolarHBondContact O-N 2.98Å; L120-V123 VanDerWaalsContact O-N 3.09Å; L120-D124 WeakPolarHBondContact O-CB 3.38Å; L120-D124 PolarHBondContact O-N 2.98Å; L120-L168 HydrophobicContact CD2-CD2 3.78Å; L120-L168 HydrophobicContact CG-CD2 4.39Å; L120-I172 HydrophobicContact CD1-CD1 3.86Å; L120-I172 HydrophobicContact CD2-CD1 4.1Å; L120-I172 HydrophobicContact CG-CD1 4.05Å; L120-L383 HydrophobicContact CD1-CD2 4.16Å; L120-V386 HydrophobicContact CD1-CG1 4.31Å
121	A	95.7	Very high	92.3	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.1	-35.5	-178.7	0	0	0	0	0	113.6	V42 L43 I117 L118 V119 L125	V42-A121 HydrophobicContact CB-CB 4.05Å; V42-A121 HydrophobicContact CG1-CB 3.67Å; L43-A121 HydrophobicContact CD2-CB 3.8Å; L43-A121 HydrophobicContact CG-CB 3.95Å; I117-A121 WeakPolarHBondContact O-CB 3.45Å; I117-A121 PolarHBondContact O-N 3.18Å; L118-A121 PolarHBondContact O-N 2.8Å; V119-A121 PolarHBondContact O-N 3.27Å; A121-L125 WeakPolarHBondContact O-CB 3.3Å; A121-L125 PolarHBondContact O-N 2.94Å; A121-L125 VanDerWaalsContact O-N 3.11Å
122	C	96	Very high	93.7	Very high	69 Å²	69	27.4 Å²	27.4	47%	0.466	15%	0.148	S	C	.	.	H	α-helix	trans	-69	-43.2	174.6	-75	0	0	0	0	112.5	L118 V119 L120 M126	L118-C122 PolarHBondContact O-N 3.06Å; L118-C122 PolarHBondContact O-SG 3.04Å; L118-C122 VanDerWaalsContact O-SG 3.42Å; V119-C122 PolarHBondContact O-N 3.18Å; L120-C122 VanDerWaalsContact C-N 3.29Å; L120-C122 PolarHBondContact O-N 3.49Å; C122-M126 PolarHBondContact O-N 3.32Å
123	V	97.1	Very high	94.6	Very high	19 Å²	19	28.8 Å²	28.8	12%	0.115	16%	0.157	C	C	.	.	H	α-helix	trans	-69.8	-49	-177.4	172.4	0	0	0	0	110	V119 L120 L125 M126 V127 F164	V119-V123 HydrophobicContact CG1-CG2 4.16Å; V119-V123 WeakPolarHBondContact O-CB 3.35Å; V119-V123 WeakPolarHBondContact O-CG2 3.48Å; V119-V123 PolarHBondContact O-N 3.27Å; L120-V123 PolarHBondContact O-N 2.98Å; L120-V123 VanDerWaalsContact O-N 3.09Å; V123-L125 VanDerWaalsContact C-N 3.28Å; V123-L125 PolarHBondContact O-N 3.36Å; V123-M126 WeakPolarHBondContact O-CB 3.17Å; V123-M126 PolarHBondContact O-N 3.08Å; V123-M126 VanDerWaalsContact O-N 3.12Å; V123-V127 WeakPolarHBondContact O-CG2 3.45Å; V123-V127 PolarHBondContact O-N 3.36Å; V123-F164 HydrophobicContact CB-CE1 4.33Å; V123-F164 HydrophobicContact CG1-CD1 3.93Å; V123-F164 HydrophobicContact CG1-CE1 3.91Å; V123-F164 HydrophobicContact CG2-CD1 4.32Å; V123-F164 HydrophobicContact CG2-CE1 3.49Å; V123-F164 VanDerWaalsContact CG2-CE1 3.49Å; V123-F164 HydrophobicContact CG2-CZ 4.29Å
124	D	97.5	Very high	95.3	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.011	16%	0.158	C	C	.	.	H	α-helix	trans	-61.4	-38.1	177.2	-60	-34.2	0	0	0	111.3	N39 L120 V127 C128 N419 N422	N39-D124 WeakPolarHBondContact ND2-CB 3.49Å; L120-D124 WeakPolarHBondContact O-CB 3.38Å; L120-D124 PolarHBondContact O-N 2.98Å; D124-V127 PolarHBondContact O-N 3.13Å; D124-C128 WeakPolarHBondContact O-CB 3.24Å; D124-C128 PolarHBondContact O-N 3.45Å; D124-C128 PolarHBondContact O-SG 3.23Å; D124-N419 HydrophobicContact CB-CB 4.11Å; D124-N419 WeakPolarHBondContact CB-O 3.42Å; D124-N419 PolarHBondContact OD1-OD1 2.92Å; D124-N422 PolarHBondContact OD2-ND2 3.22Å
125	L	97.7	Very high	95.9	Very high	31 Å²	31	28 Å²	28	16%	0.162	15%	0.151	C	C	.	.	H	α-helix	trans	-62.5	-45.7	174.2	-179.8	64.8	0	0	0	111.4	T36 N39 L40 L43 A121 V123 V127 C128 C129	T36-L125 HydrophobicContact CG2-CD1 3.97Å; N39-L125 HydrophobicContact CB-CB 4Å; N39-L125 HydrophobicContact CB-CD1 4.42Å; L40-L125 HydrophobicContact CD2-CD1 4.18Å; L40-L125 HydrophobicContact CD2-CD2 3.82Å; L40-L125 HydrophobicContact CG-CD1 3.9Å; L40-L125 HydrophobicContact CG-CD2 4.4Å; L43-L125 HydrophobicContact CD1-CD2 3.65Å; A121-L125 WeakPolarHBondContact O-CB 3.3Å; A121-L125 PolarHBondContact O-N 2.94Å; A121-L125 VanDerWaalsContact O-N 3.11Å; V123-L125 VanDerWaalsContact C-N 3.28Å; V123-L125 PolarHBondContact O-N 3.36Å; L125-V127 VanDerWaalsContact C-N 3.28Å; L125-V127 PolarHBondContact O-N 3.42Å; L125-C128 PolarHBondContact O-N 3.04Å; L125-C129 VanDerWaalsContact O-CB 3.28Å; L125-C129 WeakPolarHBondContact O-CB 3.48Å; L125-C129 PolarHBondContact O-N 3.48Å; L125-C129 PolarHBondContact O-SG 2.88Å; L125-C129 VanDerWaalsContact O-SG 3.32Å
126	M	97	Very high	96.4	Very high	97 Å²	97	29.7 Å²	29.7	48%	0.478	16%	0.159	S	C	.	.	H	α-helix	trans	-59.6	-42.3	175.9	-176.3	-170.6	75.1	0	0	111.1	C122 V123 C129 F130	C122-M126 PolarHBondContact O-N 3.32Å; V123-M126 WeakPolarHBondContact O-CB 3.17Å; V123-M126 PolarHBondContact O-N 3.08Å; V123-M126 VanDerWaalsContact O-N 3.12Å; M126-C129 PolarHBondContact O-N 2.84Å; M126-F130 HydrophobicContact CG-CD2 4.06Å; M126-F130 WeakPolarHBondContact O-CB 3.46Å; M126-F130 WeakPolarHBondContact O-CD2 3.3Å; M126-F130 PolarHBondContact O-N 2.95Å
127	V	98.1	Very high	96.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.174	C	C	.	.	I	π-helix	trans	-64.4	-48.5	177.8	173.9	0	0	0	0	111.2	V123 D124 L125 C129 V131 V132 N161 Y416 N419	V123-V127 WeakPolarHBondContact O-CG2 3.45Å; V123-V127 PolarHBondContact O-N 3.36Å; D124-V127 PolarHBondContact O-N 3.13Å; L125-V127 VanDerWaalsContact C-N 3.28Å; L125-V127 PolarHBondContact O-N 3.42Å; V127-C129 VanDerWaalsContact C-N 3.32Å; V127-C129 PolarHBondContact O-N 2.84Å; V127-V131 HydrophobicContact CB-CB 4.43Å; V127-V131 HydrophobicContact CB-CG2 4.4Å; V127-V131 HydrophobicContact CG1-CB 4.05Å; V127-V131 HydrophobicContact CG1-CG2 4.48Å; V127-V131 HydrophobicContact CG2-CG2 4.23Å; V127-V131 PolarHBondContact O-N 3.48Å; V127-V132 HydrophobicContact CG1-CG2 3.99Å; V127-V132 PolarHBondContact O-N 3.38Å; V127-N161 WeakPolarHBondContact CG2-OD1 3.19Å; V127-Y416 HydrophobicContact CG1-CD1 4.23Å; V127-Y416 HydrophobicContact CG1-CE1 4.2Å; V127-N419 HydrophobicContact CB-CB 4.48Å; V127-N419 HydrophobicContact CG1-CB 4.18Å; V127-N419 VanDerWaalsContact CG1-CG 3.41Å; V127-N419 WeakPolarHBondContact CG1-ND2 3.45Å; V127-N419 WeakPolarHBondContact CG1-OD1 3.33Å
128	C	98.3	Very high	96.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.171	C	C	.	.	I	π-helix	trans	-65.4	-31.3	178.3	-70.9	0	0	0	0	113.4	S32 D124 L125 P133	S32-C128 PolarHBondContact OG-O 3.14Å; D124-C128 WeakPolarHBondContact O-CB 3.24Å; D124-C128 PolarHBondContact O-N 3.45Å; D124-C128 PolarHBondContact O-SG 3.23Å; L125-C128 PolarHBondContact O-N 3.04Å; C128-P133 VanDerWaalsContact O-CD 3.23Å; C128-P133 WeakPolarHBondContact O-CD 3.47Å; C128-P133 WeakPolarHBondContact O-CG 3.16Å
129	C	97.8	Very high	97	Very high	49 Å²	49	31.9 Å²	31.9	33%	0.331	16%	0.164	S	C	.	.	I	π-helix	trans	-85.4	-27.6	-179.6	-73	0	0	0	0	114.3	L125 M126 V127 P133	L125-C129 VanDerWaalsContact O-CB 3.28Å; L125-C129 WeakPolarHBondContact O-CB 3.48Å; L125-C129 PolarHBondContact O-N 3.48Å; L125-C129 PolarHBondContact O-SG 2.88Å; L125-C129 VanDerWaalsContact O-SG 3.32Å; M126-C129 PolarHBondContact O-N 2.84Å; V127-C129 VanDerWaalsContact C-N 3.32Å; V127-C129 PolarHBondContact O-N 2.84Å; C129-P133 WeakPolarHBondContact O-CG 3.3Å
130	F	97	Very high	97	Very high	136 Å²	136	37.8 Å²	37.8	60%	0.596	19%	0.186	S	C	*	.	I	π-helix	trans	-125.9	-50.9	-171.6	-61.1	-72.5	0	0	0	113.4	M126 L134	M126-F130 HydrophobicContact CG-CD2 4.06Å; M126-F130 WeakPolarHBondContact O-CB 3.46Å; M126-F130 WeakPolarHBondContact O-CD2 3.3Å; M126-F130 PolarHBondContact O-N 2.95Å; F130-L134 WeakPolarHBondContact O-CB 3.43Å; F130-L134 PolarHBondContact O-N 3.42Å; F130-L134 VanDerWaalsContact O-N 3.08Å
131	V	98.1	Very high	97	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.012	19%	0.193	C	C	.	.	I	π-helix	trans	-73.1	-46.6	-173.3	-174	0	0	0	0	111.3	V127 L134 T135 L157 Y416	V127-V131 HydrophobicContact CB-CB 4.43Å; V127-V131 HydrophobicContact CB-CG2 4.4Å; V127-V131 HydrophobicContact CG1-CB 4.05Å; V127-V131 HydrophobicContact CG1-CG2 4.48Å; V127-V131 HydrophobicContact CG2-CG2 4.23Å; V127-V131 PolarHBondContact O-N 3.48Å; V131-L134 PolarHBondContact O-N 3Å; V131-T135 WeakPolarHBondContact O-CB 3.32Å; V131-T135 PolarHBondContact O-N 2.88Å; V131-T135 PolarHBondContact O-OG1 3Å; V131-L157 HydrophobicContact CG1-CB 4.19Å; V131-L157 HydrophobicContact CG2-CB 4Å; V131-L157 HydrophobicContact CG2-CD1 4.3Å; V131-L157 HydrophobicContact CG2-CD2 4.3Å; V131-L157 HydrophobicContact CG2-CG 4.43Å; V131-Y416 HydrophobicContact CG1-CE1 4.08Å
132	V	98.2	Very high	96.8	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-66.7	-46.1	179.5	177.5	0	0	0	0	111.6	L28 V31 V127 L134 T135 F136 Y416	L28-V132 HydrophobicContact CB-CG1 4.26Å; L28-V132 HydrophobicContact CD2-CG1 4.17Å; L28-V132 WeakPolarHBondContact O-CG1 3.42Å; V31-V132 HydrophobicContact CB-CG1 4.15Å; V31-V132 HydrophobicContact CG1-CG1 4.28Å; V31-V132 HydrophobicContact CG1-CG2 3.96Å; V127-V132 HydrophobicContact CG1-CG2 3.99Å; V127-V132 PolarHBondContact O-N 3.38Å; V132-L134 VanDerWaalsContact C-N 3.34Å; V132-L134 PolarHBondContact O-N 2.97Å; V132-T135 PolarHBondContact O-N 3.3Å; V132-F136 WeakPolarHBondContact O-CB 3.38Å; V132-F136 PolarHBondContact O-N 2.98Å; V132-Y416 HydrophobicContact CG2-CD1 3.38Å; V132-Y416 HydrophobicContact CG2-CE1 3.66Å; V132-Y416 HydrophobicContact CG2-CG 4.04Å
133	P	98	Very high	96.7	Very high	46 Å²	46	43.7 Å²	43.7	30%	0.299	21%	0.208	S	C	.	.	H	α-helix	trans	-63.6	-37.3	175.4	-27	39.1	0	0	0	113.2	C128 C129 F136 Y137	C128-P133 VanDerWaalsContact O-CD 3.23Å; C128-P133 WeakPolarHBondContact O-CD 3.47Å; C128-P133 WeakPolarHBondContact O-CG 3.16Å; C129-P133 WeakPolarHBondContact O-CG 3.3Å; P133-F136 PolarHBondContact O-N 3.18Å; P133-Y137 WeakPolarHBondContact O-CB 3.12Å; P133-Y137 PolarHBondContact O-N 2.72Å
134	L	97.7	Very high	96.5	Very high	20 Å²	20	47.2 Å²	47.2	11%	0.105	22%	0.223	C	C	.	.	H	α-helix	trans	-63	-44.9	173.3	179.2	60.8	0	0	0	110.8	F130 V131 V132 F136 Y137 M138 W150 A153 H154 L157	F130-L134 WeakPolarHBondContact O-CB 3.43Å; F130-L134 PolarHBondContact O-N 3.42Å; F130-L134 VanDerWaalsContact O-N 3.08Å; V131-L134 PolarHBondContact O-N 3Å; V132-L134 VanDerWaalsContact C-N 3.34Å; V132-L134 PolarHBondContact O-N 2.97Å; L134-F136 PolarHBondContact O-N 3.39Å; L134-Y137 HydrophobicContact CD1-CD1 4.29Å; L134-Y137 WeakPolarHBondContact O-CB 3.24Å; L134-Y137 PolarHBondContact O-N 3.23Å; L134-M138 HydrophobicContact CD1-CG 4.23Å; L134-M138 HydrophobicContact CD1-SD 4.45Å; L134-M138 HydrophobicContact CG-CG 4.38Å; L134-M138 VanDerWaalsContact O-CG 3.28Å; L134-M138 WeakPolarHBondContact O-CG 3.42Å; L134-M138 PolarHBondContact O-N 3.12Å; L134-W150 HydrophobicContact CD1-CE3 3.61Å; L134-W150 HydrophobicContact CD1-CZ3 3.88Å; L134-A153 HydrophobicContact CD2-CB 4.27Å; L134-H154 HydrophobicContact CD2-CB 4.04Å; L134-H154 HydrophobicContact CG-CB 4.35Å; L134-L157 HydrophobicContact CD2-CD1 3.76Å
135	T	97.4	Very high	96.4	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.012	23%	0.225	C	C	.	.	H	α-helix	trans	-62.3	-43.9	176.7	-54.4	0	0	0	0	111.3	L28 V131 V132 Y137 M138 E139 H154 Y416	L28-T135 HydrophobicContact CD1-CG2 4.05Å; L28-T135 HydrophobicContact CD2-CG2 4.26Å; V131-T135 WeakPolarHBondContact O-CB 3.32Å; V131-T135 PolarHBondContact O-N 2.88Å; V131-T135 PolarHBondContact O-OG1 3Å; V132-T135 PolarHBondContact O-N 3.3Å; T135-Y137 VanDerWaalsContact C-N 3.29Å; T135-Y137 PolarHBondContact O-N 3.5Å; T135-M138 PolarHBondContact O-N 3Å; T135-E139 HydrophobicContact CG2-CG 4.21Å; T135-E139 WeakPolarHBondContact O-CB 3.32Å; T135-E139 VanDerWaalsContact O-CG 3.28Å; T135-E139 WeakPolarHBondContact O-CG 3.35Å; T135-E139 PolarHBondContact O-N 3.42Å; T135-H154 PolarHBondContact OG1-NE2 3.48Å; T135-Y416 HydrophobicContact CG2-CE2 3.91Å; T135-Y416 PolarHBondContact OG1-OH 3.41Å
136	F	98	Very high	96.1	Very high	70 Å²	70	50.7 Å²	50.7	31%	0.307	25%	0.251	S	S	.	.	H	α-helix	trans	-54.7	-46.7	173.3	-179.5	-75.7	0	0	0	111.2	L25 L28 V132 P133 L134 E139 Y140	L25-F136 HydrophobicContact CB-CD2 4.46Å; L25-F136 HydrophobicContact CB-CE2 3.82Å; L25-F136 HydrophobicContact CB-CZ 4.33Å; L25-F136 HydrophobicContact CD2-CD2 4.08Å; L25-F136 HydrophobicContact CD2-CE2 3.98Å; L25-F136 HydrophobicContact CD2-CG 4.42Å; L25-F136 HydrophobicContact CD2-CZ 4.22Å; L25-F136 HydrophobicContact CG-CE2 4.41Å; L25-F136 VanDerWaalsContact O-CE2 3.32Å; L25-F136 WeakPolarHBondContact O-CE2 3.41Å; L28-F136 HydrophobicContact CB-CB 4.18Å; L28-F136 HydrophobicContact CB-CD2 3.95Å; L28-F136 HydrophobicContact CD1-CB 4.4Å; V132-F136 WeakPolarHBondContact O-CB 3.38Å; V132-F136 PolarHBondContact O-N 2.98Å; P133-F136 PolarHBondContact O-N 3.18Å; L134-F136 PolarHBondContact O-N 3.39Å; F136-E139 PolarHBondContact O-N 2.99Å; F136-Y140 VanDerWaalsContact O-CB 3.24Å; F136-Y140 WeakPolarHBondContact O-CB 3.29Å; F136-Y140 PolarHBondContact O-N 3.36Å
137	Y	97.5	Very high	96	Very high	84 Å²	84	48.8 Å²	48.8	33%	0.329	25%	0.245	S	C	.	.	H	α-helix	trans	-61.6	-47.4	177.4	169.4	-107.2	0	0	0	111.7	P133 L134 T135 E139 Y140 I141 W150	P133-Y137 WeakPolarHBondContact O-CB 3.12Å; P133-Y137 PolarHBondContact O-N 2.72Å; L134-Y137 HydrophobicContact CD1-CD1 4.29Å; L134-Y137 WeakPolarHBondContact O-CB 3.24Å; L134-Y137 PolarHBondContact O-N 3.23Å; T135-Y137 VanDerWaalsContact C-N 3.29Å; T135-Y137 PolarHBondContact O-N 3.5Å; Y137-E139 PolarHBondContact O-N 3.37Å; Y137-Y140 PolarHBondContact O-N 2.98Å; Y137-I141 HydrophobicContact CD1-CD1 4.3Å; Y137-I141 HydrophobicContact CD2-CG2 4.2Å; Y137-I141 HydrophobicContact CE1-CD1 3.72Å; Y137-I141 HydrophobicContact CE2-CD1 4.37Å; Y137-I141 HydrophobicContact CE2-CG2 3.74Å; Y137-I141 WeakPolarHBondContact O-CG1 3.31Å; Y137-I141 PolarHBondContact O-N 2.91Å; Y137-W150 HydrophobicContact CE1-CD2 4.23Å; Y137-W150 HydrophobicContact CE1-CE3 4.48Å; Y137-W150 HydrophobicContact CE1-CG 4.42Å
138	M	95.8	Very high	95.8	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.5	-40.8	179.3	-66.6	-53.6	-65.7	0	0	112.2	L134 T135 I141 H142 L143 P145 W150 H154 C229	L134-M138 HydrophobicContact CD1-CG 4.23Å; L134-M138 HydrophobicContact CD1-SD 4.45Å; L134-M138 HydrophobicContact CG-CG 4.38Å; L134-M138 VanDerWaalsContact O-CG 3.28Å; L134-M138 WeakPolarHBondContact O-CG 3.42Å; L134-M138 PolarHBondContact O-N 3.12Å; T135-M138 PolarHBondContact O-N 3Å; M138-I141 WeakPolarHBondContact O-CG1 3.48Å; M138-I141 HydrophobicContact SD-CD1 4.19Å; M138-H142 PolarHBondContact O-N 3.41Å; M138-L143 HydrophobicContact CB-CD2 4.18Å; M138-L143 HydrophobicContact CE-CD2 4.17Å; M138-L143 PolarHBondContact O-N 2.88Å; M138-P145 HydrophobicContact CE-CB 4.35Å; M138-P145 HydrophobicContact CE-CG 3.94Å; M138-W150 HydrophobicContact SD-CB 3.98Å; M138-H154 HydrophobicContact CG-CB 4.02Å; M138-C229 WeakPolarHBondContact CE-SG 3.34Å
139	E	94.2	Very high	95.7	Very high	20 Å²	20	57 Å²	57	9%	0.093	29%	0.287	C	S	.	.	H	α-helix	trans	-71.4	-34.3	176.2	-66.1	-65.2	170.5	0	0	112.6	W21 L25 L28 T135 F136 Y137 I141 H142 L409	W21-E139 PolarHBondContact NE1-O 3.13Å; L25-E139 HydrophobicContact CD2-CB 4.13Å; L28-E139 HydrophobicContact CD1-CG 4.1Å; T135-E139 HydrophobicContact CG2-CG 4.21Å; T135-E139 WeakPolarHBondContact O-CB 3.32Å; T135-E139 VanDerWaalsContact O-CG 3.28Å; T135-E139 WeakPolarHBondContact O-CG 3.35Å; T135-E139 PolarHBondContact O-N 3.42Å; F136-E139 PolarHBondContact O-N 2.99Å; Y137-E139 PolarHBondContact O-N 3.37Å; E139-I141 VanDerWaalsContact C-N 3.35Å; E139-H142 PolarHBondContact O-N 3.22Å; E139-L409 WeakPolarHBondContact OE2-CD1 3.34Å
140	Y	95.7	Very high	95.6	Very high	140 Å²	140	59.6 Å²	59.6	55%	0.549	29%	0.29	S	S	.	.	H	α-helix	trans	-66	-37.5	176.7	176.8	-96.1	0	0	0	112.1	W21 L25 F136 Y137 H142	W21-Y140 HydrophobicContact CZ2-CD2 4.35Å; L25-Y140 HydrophobicContact CD1-CD2 4.22Å; F136-Y140 VanDerWaalsContact O-CB 3.24Å; F136-Y140 WeakPolarHBondContact O-CB 3.29Å; F136-Y140 PolarHBondContact O-N 3.36Å; Y137-Y140 PolarHBondContact O-N 2.98Å; Y140-H142 VanDerWaalsContact C-N 3.27Å
141	I	94	Very high	95.6	Very high	36 Å²	36	53.2 Å²	53.2	19%	0.185	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	13.4	175.1	69.9	178.3	0	0	0	113	Y137 M138 E139 L143 Q144 P145	Y137-I141 HydrophobicContact CD1-CD1 4.3Å; Y137-I141 HydrophobicContact CD2-CG2 4.2Å; Y137-I141 HydrophobicContact CE1-CD1 3.72Å; Y137-I141 HydrophobicContact CE2-CD1 4.37Å; Y137-I141 HydrophobicContact CE2-CG2 3.74Å; Y137-I141 WeakPolarHBondContact O-CG1 3.31Å; Y137-I141 PolarHBondContact O-N 2.91Å; M138-I141 WeakPolarHBondContact O-CG1 3.48Å; M138-I141 HydrophobicContact SD-CD1 4.19Å; E139-I141 VanDerWaalsContact C-N 3.35Å; I141-L143 VanDerWaalsContact C-N 3.26Å; I141-L143 PolarHBondContact O-N 3.42Å; I141-Q144 PolarHBondContact O-N 2.87Å; I141-P145 HydrophobicContact CD1-CB 3.8Å
142	H	92.1	Very high	95.6	Very high	107 Å²	107	57.1 Å²	57.1	50%	0.495	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	40.1	-179.2	-57.7	-76.7	0	0	0	114	W21 M138 E139 Y140 Q144	W21-H142 AromaticContact CD1-CE1 3.93Å; W21-H142 AromaticContact CE2-CE1 3.64Å; W21-H142 AromaticContact CZ2-CE1 3.96Å; W21-H142 AromaticContact CZ2-NE2 3.99Å; W21-H142 AromaticContact NE1-CE1 3.39Å; W21-H142 PolarHBondContact NE1-CE1 3.1Å; W21-H142 AromaticContact NE1-ND1 3.79Å; M138-H142 PolarHBondContact O-N 3.41Å; E139-H142 PolarHBondContact O-N 3.22Å; Y140-H142 VanDerWaalsContact C-N 3.27Å; H142-Q144 PolarHBondContact O-N 3.28Å
143	L	93	Very high	95.5	Very high	56 Å²	56	58.7 Å²	58.7	29%	0.293	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.1	21	-178.4	-67.6	159.8	0	0	0	114.9	M138 I141 P145 Q228 C229	M138-L143 HydrophobicContact CB-CD2 4.18Å; M138-L143 HydrophobicContact CE-CD2 4.17Å; M138-L143 PolarHBondContact O-N 2.88Å; I141-L143 VanDerWaalsContact C-N 3.26Å; I141-L143 PolarHBondContact O-N 3.42Å; L143-P145 WeakPolarHBondContact O-CD 3.4Å; L143-Q228 CarbonylContact O-C 3.59Å; L143-Q228 WeakPolarHBondContact O-CA 3.32Å; L143-Q228 WeakPolarHBondContact O-CB 3.33Å; L143-C229 HydrophobicContact CD2-CB 4.4Å; L143-C229 PolarHBondContact O-N 3.09Å
144	Q	93.8	Very high	95.5	Very high	93 Å²	93	57.9 Å²	57.9	44%	0.435	28%	0.284	S	S	.	.			trans	-109.7	69	179.2	-62.6	172.7	35.5	0	0	111.9	I141 H142 I226 Q227 Q228	I141-Q144 PolarHBondContact O-N 2.87Å; H142-Q144 PolarHBondContact O-N 3.28Å; Q144-I226 VanDerWaalsContact CD-CG2 3.47Å; Q144-I226 HydrophobicContact CG-CG2 4.09Å; Q144-I226 VanDerWaalsContact NE2-CG2 3.35Å; Q144-Q227 WeakPolarHBondContact CG-O 3.29Å; Q144-Q228 HydrophobicContact CG-CB 3.92Å
145	P	94.2	Very high	95.4	Very high	7 Å²	7	57.1 Å²	57.1	5%	0.045	28%	0.281	C	S	.	.			trans	-73.9	156.3	176.7	34.9	-37.9	0	0	0	111.9	M138 I141 L143 T147 W150 C151 L217 C229	M138-P145 HydrophobicContact CE-CB 4.35Å; M138-P145 HydrophobicContact CE-CG 3.94Å; I141-P145 HydrophobicContact CD1-CB 3.8Å; L143-P145 WeakPolarHBondContact O-CD 3.4Å; P145-T147 PolarHBondContact O-N 3.41Å; P145-W150 HydrophobicContact CB-CB 3.72Å; P145-W150 HydrophobicContact CB-CG 4.15Å; P145-W150 HydrophobicContact CG-CB 4.13Å; P145-C151 VanDerWaalsContact CG-SG 3.56Å; P145-L217 HydrophobicContact CG-CD1 4.1Å; P145-C229 VanDerWaalsContact CD-SG 3.55Å; P145-C229 VanDerWaalsContact CG-SG 3.55Å
146	S	92.1	Very high	95.4	Very high	100 Å²	100	59.7 Å²	59.7	70%	0.699	29%	0.292	S	S	*	.	S	Bend	trans	-68.9	-17.2	176.2	57	0	0	0	0	114.4
147	T	94.5	Very high	95.4	Very high	57 Å²	57	58.4 Å²	58.4	35%	0.35	29%	0.288	S	S	.	.	S	Bend	trans	-143.9	149.1	-176.2	62.7	0	0	0	0	112.1	P145 I149 W150	P145-T147 PolarHBondContact O-N 3.41Å; T147-I149 PolarHBondContact O-N 3.43Å; T147-W150 PolarHBondContact O-N 2.96Å; T147-W150 VanDerWaalsContact OG1-CD1 3.23Å
148	D	94.7	Very high	95.3	Very high	49 Å²	49	55.1 Å²	55.1	26%	0.262	28%	0.276	S	S	.	.	H	α-helix	trans	-60.1	-26.2	178.4	-176.3	61.6	0	0	0	114	W150 C151 K152 S216 L217	D148-W150 PolarHBondContact O-N 3.39Å; D148-C151 PolarHBondContact O-N 2.95Å; D148-C151 VanDerWaalsContact O-N 3.16Å; D148-K152 PolarHBondContact O-N 3.2Å; D148-K152 VanDerWaalsContact O-N 3.1Å; D148-K152 VanDerWaalsContact OD2-CD 3.3Å; D148-K152 WeakPolarHBondContact OD2-CD 3.46Å; D148-K152 WeakPolarHBondContact OD2-CE 3.48Å; D148-K152 IonicContact OD2-NZ 2.87Å; D148-K152 PolarHBondContact OD2-NZ 2.85Å; D148-S216 WeakPolarHBondContact OD1-CA 3.29Å; D148-S216 WeakPolarHBondContact OD1-CB 3.4Å; D148-L217 HydrophobicContact CB-CB 4.14Å; D148-L217 PolarHBondContact OD1-N 3.39Å
149	I	96.3	Very high	95.3	Very high	123 Å²	123	56 Å²	56	63%	0.631	28%	0.281	S	S	*	.	H	α-helix	trans	-57.3	-39.1	-179.5	-62.5	167.6	0	0	0	111	T147 K152 A153	T147-I149 PolarHBondContact O-N 3.43Å; I149-K152 PolarHBondContact O-N 3.17Å; I149-A153 VanDerWaalsContact O-CB 3.23Å; I149-A153 WeakPolarHBondContact O-CB 3.5Å; I149-A153 PolarHBondContact O-N 2.93Å
150	W	96.2	Very high	95.4	Very high	103 Å²	103	56 Å²	56	39%	0.39	28%	0.282	S	S	.	.	H	α-helix	trans	-68.3	-40.7	-179.8	-65.8	114.8	0	0	0	112.3	L134 Y137 M138 P145 T147 D148 A153 H154	L134-W150 HydrophobicContact CD1-CE3 3.61Å; L134-W150 HydrophobicContact CD1-CZ3 3.88Å; Y137-W150 HydrophobicContact CE1-CD2 4.23Å; Y137-W150 HydrophobicContact CE1-CE3 4.48Å; Y137-W150 HydrophobicContact CE1-CG 4.42Å; M138-W150 HydrophobicContact SD-CB 3.98Å; P145-W150 HydrophobicContact CB-CB 3.72Å; P145-W150 HydrophobicContact CB-CG 4.15Å; P145-W150 HydrophobicContact CG-CB 4.13Å; T147-W150 PolarHBondContact O-N 2.96Å; T147-W150 VanDerWaalsContact OG1-CD1 3.23Å; D148-W150 PolarHBondContact O-N 3.39Å; W150-A153 PolarHBondContact O-N 2.81Å; W150-H154 WeakPolarHBondContact O-CB 3.12Å; W150-H154 PolarHBondContact O-N 3.34Å
151	C	96.3	Very high	95.4	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.02	26%	0.258	C	S	.	.	H	α-helix	trans	-59.9	-48.5	174.9	-59	0	0	0	0	111	P145 D148 H154 A155 C229	P145-C151 VanDerWaalsContact CG-SG 3.56Å; D148-C151 PolarHBondContact O-N 2.95Å; D148-C151 VanDerWaalsContact O-N 3.16Å; C151-H154 PolarHBondContact O-N 2.82Å; C151-A155 WeakPolarHBondContact O-CB 3.26Å; C151-A155 PolarHBondContact O-N 3.15Å; C151-C229 WeakPolarHBondContact CA-SG 3.27Å; C151-C229 HydrophobicContact CB-CB 3.79Å; C151-C229 WeakPolarHBondContact CB-SG 3.21Å; C151-C229 WeakPolarHBondContact SG-CA 3.47Å; C151-C229 WeakPolarHBondContact SG-CB 3.28Å; C151-C229 CovalentContact SG-SG 2.04Å; C151-C229 PolarHBondContact SG-SG 3.39Å
152	K	97.1	Very high	95.5	Very high	83 Å²	83	49 Å²	49	36%	0.361	26%	0.255	S	S	.	.	H	α-helix	trans	-66.1	-42.5	-179.9	-71.4	-179.6	171.5	160	0	112.7	D148 I149 A155 F156 H215	D148-K152 PolarHBondContact O-N 3.2Å; D148-K152 VanDerWaalsContact O-N 3.1Å; D148-K152 VanDerWaalsContact OD2-CD 3.3Å; D148-K152 WeakPolarHBondContact OD2-CD 3.46Å; D148-K152 WeakPolarHBondContact OD2-CE 3.48Å; D148-K152 IonicContact OD2-NZ 2.87Å; D148-K152 PolarHBondContact OD2-NZ 2.85Å; I149-K152 PolarHBondContact O-N 3.17Å; K152-A155 PolarHBondContact O-N 2.88Å; K152-F156 WeakPolarHBondContact O-CB 3.4Å; K152-F156 PolarHBondContact O-N 3.45Å; K152-H215 WeakPolarHBondContact CG-O 3.48Å
153	A	97.2	Very high	95.7	Very high	33 Å²	33	44.3 Å²	44.3	27%	0.273	23%	0.233	S	C	.	.	H	α-helix	trans	-64.4	-43.4	177	0	0	0	0	0	111.5	L134 I149 W150 L157	L134-A153 HydrophobicContact CD2-CB 4.27Å; I149-A153 VanDerWaalsContact O-CB 3.23Å; I149-A153 WeakPolarHBondContact O-CB 3.5Å; I149-A153 PolarHBondContact O-N 2.93Å; W150-A153 PolarHBondContact O-N 2.81Å; A153-L157 WeakPolarHBondContact O-CB 3.42Å; A153-L157 VanDerWaalsContact O-CG 3.32Å; A153-L157 WeakPolarHBondContact O-CG 3.48Å; A153-L157 PolarHBondContact O-N 3.43Å
154	H	97.2	Very high	95.9	Very high	30 Å²	30	42.6 Å²	42.6	14%	0.139	22%	0.224	C	C	.	.	H	α-helix	trans	-61.5	-48.3	176.5	-178.4	-112.6	0	0	0	111.2	L134 T135 M138 W150 C151 N158	L134-H154 HydrophobicContact CD2-CB 4.04Å; L134-H154 HydrophobicContact CG-CB 4.35Å; T135-H154 PolarHBondContact OG1-NE2 3.48Å; M138-H154 HydrophobicContact CG-CB 4.02Å; W150-H154 WeakPolarHBondContact O-CB 3.12Å; W150-H154 PolarHBondContact O-N 3.34Å; C151-H154 PolarHBondContact O-N 2.82Å; H154-N158 PolarHBondContact CD2-ND2 3.26Å; H154-N158 PolarHBondContact CE1-ND2 3.01Å; H154-N158 PolarHBondContact NE2-ND2 2.94Å; H154-N158 WeakPolarHBondContact O-CB 3.33Å; H154-N158 PolarHBondContact O-N 3.04Å; H154-N158 PolarHBondContact O-ND2 2.94Å
155	A	96.5	Very high	96	Very high	3 Å²	3	38.7 Å²	38.7	3%	0.025	21%	0.206	C	C	.	.	H	α-helix	trans	-60.7	-50.4	176.4	0	0	0	0	0	112.3	C151 K152 L157 N158 I159 H215	C151-A155 WeakPolarHBondContact O-CB 3.26Å; C151-A155 PolarHBondContact O-N 3.15Å; K152-A155 PolarHBondContact O-N 2.88Å; A155-L157 PolarHBondContact O-N 2.9Å; A155-N158 PolarHBondContact O-N 3.1Å; A155-I159 HydrophobicContact CB-CD1 4.41Å; A155-I159 VanDerWaalsContact O-CB 3.31Å; A155-I159 WeakPolarHBondContact O-CB 3.36Å; A155-I159 VanDerWaalsContact O-CG1 3.22Å; A155-I159 WeakPolarHBondContact O-CG1 3.28Å; A155-I159 PolarHBondContact O-N 3.31Å; A155-H215 HydrophobicContact CB-CB 3.67Å
156	F	97.8	Very high	96.1	Very high	57 Å²	57	38.3 Å²	38.3	25%	0.25	20%	0.204	C	C	.	.	H	α-helix	trans	-52.1	-52.8	178	167.8	-109.1	0	0	0	111.7	K152 C160 I205 G208 I209 A212	K152-F156 WeakPolarHBondContact O-CB 3.4Å; K152-F156 PolarHBondContact O-N 3.45Å; F156-C160 WeakPolarHBondContact O-CB 3.21Å; F156-C160 PolarHBondContact O-N 3.19Å; F156-I205 HydrophobicContact CE2-CG2 4.36Å; F156-I205 HydrophobicContact CZ-CG2 4.38Å; F156-G208 VanDerWaalsContact CD2-C 3.48Å; F156-I209 HydrophobicContact CD2-CG1 4.06Å; F156-I209 HydrophobicContact CE2-CG1 3.81Å; F156-A212 HydrophobicContact CB-CB 3.87Å
157	L	97.1	Very high	96.4	Very high	43 Å²	43	35 Å²	35	23%	0.225	18%	0.178	C	C	.	.	H	α-helix	trans	-67	-42.1	-175.5	-74	179.5	0	0	0	112	V131 L134 A153 A155 N161	V131-L157 HydrophobicContact CG1-CB 4.19Å; V131-L157 HydrophobicContact CG2-CB 4Å; V131-L157 HydrophobicContact CG2-CD1 4.3Å; V131-L157 HydrophobicContact CG2-CD2 4.3Å; V131-L157 HydrophobicContact CG2-CG 4.43Å; L134-L157 HydrophobicContact CD2-CD1 3.76Å; A153-L157 WeakPolarHBondContact O-CB 3.42Å; A153-L157 VanDerWaalsContact O-CG 3.32Å; A153-L157 WeakPolarHBondContact O-CG 3.48Å; A153-L157 PolarHBondContact O-N 3.43Å; A155-L157 PolarHBondContact O-N 2.9Å; L157-N161 WeakPolarHBondContact O-CB 3.44Å; L157-N161 PolarHBondContact O-N 3.17Å
158	N	95.6	Very high	96.5	Very high	15 Å²	15	32.5 Å²	32.5	8%	0.08	16%	0.163	C	C	.	.	H	α-helix	trans	-65.8	-51.6	178.2	-84	-65.8	0	0	0	112.3	H154 A155 C160 N161 I162 Y415 Y416	H154-N158 PolarHBondContact CD2-ND2 3.26Å; H154-N158 PolarHBondContact CE1-ND2 3.01Å; H154-N158 PolarHBondContact NE2-ND2 2.94Å; H154-N158 WeakPolarHBondContact O-CB 3.33Å; H154-N158 PolarHBondContact O-N 3.04Å; H154-N158 PolarHBondContact O-ND2 2.94Å; A155-N158 PolarHBondContact O-N 3.1Å; N158-C160 VanDerWaalsContact C-N 3.34Å; N158-C160 PolarHBondContact O-N 3.4Å; N158-N161 PolarHBondContact O-N 3Å; N158-I162 WeakPolarHBondContact O-CB 3.25Å; N158-I162 VanDerWaalsContact O-CG1 3.23Å; N158-I162 WeakPolarHBondContact O-CG1 3.41Å; N158-I162 PolarHBondContact O-N 3.47Å; N158-Y415 PolarHBondContact OD1-OH 2.96Å; N158-Y416 PolarHBondContact OD1-OH 3.47Å
159	I	96	Very high	96.5	Very high	18 Å²	18	30.5 Å²	30.5	9%	0.092	15%	0.152	C	C	.	.	H	α-helix	trans	-62	-44.9	-178.4	-67	169.8	0	0	0	110.4	A155 M163 Y207	A155-I159 HydrophobicContact CB-CD1 4.41Å; A155-I159 VanDerWaalsContact O-CB 3.31Å; A155-I159 WeakPolarHBondContact O-CB 3.36Å; A155-I159 VanDerWaalsContact O-CG1 3.22Å; A155-I159 WeakPolarHBondContact O-CG1 3.28Å; A155-I159 PolarHBondContact O-N 3.31Å; I159-M163 WeakPolarHBondContact O-CB 3.47Å; I159-M163 PolarHBondContact O-N 2.89Å; I159-M163 VanDerWaalsContact O-N 3.12Å; I159-Y207 HydrophobicContact CG2-CD1 3.72Å; I159-Y207 HydrophobicContact CG2-CE1 3.87Å
160	C	96.5	Very high	96.6	Very high	19 Å²	19	25.6 Å²	25.6	13%	0.128	13%	0.127	C	C	.	.	H	α-helix	trans	-61	-46.9	176	-177.8	0	0	0	0	111.5	F156 N158 F164	F156-C160 WeakPolarHBondContact O-CB 3.21Å; F156-C160 PolarHBondContact O-N 3.19Å; N158-C160 VanDerWaalsContact C-N 3.34Å; N158-C160 PolarHBondContact O-N 3.4Å; C160-F164 WeakPolarHBondContact O-CB 3.37Å; C160-F164 PolarHBondContact O-N 3.44Å
161	N	95.9	Very high	96.5	Very high	9 Å²	9	21 Å²	21	5%	0.048	11%	0.111	C	C	.	.	H	α-helix	trans	-62.4	-44.4	-179.6	179	44.3	0	0	0	112.5	V127 L157 N158 S165	V127-N161 WeakPolarHBondContact CG2-OD1 3.19Å; L157-N161 WeakPolarHBondContact O-CB 3.44Å; L157-N161 PolarHBondContact O-N 3.17Å; N158-N161 PolarHBondContact O-N 3Å; N161-S165 WeakPolarHBondContact O-CB 3.19Å; N161-S165 PolarHBondContact O-N 3.33Å; N161-S165 PolarHBondContact O-OG 3.26Å; N161-S165 PolarHBondContact OD1-OG 3.44Å
162	I	94.7	Very high	96.4	Very high	22 Å²	22	21 Å²	21	11%	0.113	11%	0.111	C	C	.	.	H	α-helix	trans	-60.7	-52.4	179.3	-71.5	169.1	0	0	0	110.3	N158 S166 N253 F394	N158-I162 WeakPolarHBondContact O-CB 3.25Å; N158-I162 VanDerWaalsContact O-CG1 3.23Å; N158-I162 WeakPolarHBondContact O-CG1 3.41Å; N158-I162 PolarHBondContact O-N 3.47Å; I162-S166 PolarHBondContact O-N 3.03Å; I162-S166 VanDerWaalsContact O-N 3.12Å; I162-N253 HydrophobicContact CG2-CB 4.19Å; I162-F394 HydrophobicContact CB-CZ 4.15Å; I162-F394 HydrophobicContact CD1-CZ 4.29Å; I162-F394 HydrophobicContact CG1-CE2 4.05Å; I162-F394 HydrophobicContact CG1-CZ 3.8Å; I162-F394 HydrophobicContact CG2-CE1 4.38Å; I162-F394 HydrophobicContact CG2-CE2 4.31Å; I162-F394 HydrophobicContact CG2-CZ 3.55Å
163	M	96.4	Very high	96.3	Very high	8 Å²	8	17.1 Å²	17.1	4%	0.039	9%	0.094	C	C	.	.	H	α-helix	trans	-62.7	-49.1	-179.6	-177.4	57.2	72.8	0	0	110.9	I159 S165 S166 L167 F203 Y207 N253 S256	I159-M163 WeakPolarHBondContact O-CB 3.47Å; I159-M163 PolarHBondContact O-N 2.89Å; I159-M163 VanDerWaalsContact O-N 3.12Å; M163-S165 PolarHBondContact O-N 3.13Å; M163-S166 PolarHBondContact O-N 3.44Å; M163-S166 PolarHBondContact O-OG 3.5Å; M163-L167 HydrophobicContact CG-CD1 4Å; M163-L167 WeakPolarHBondContact O-CG 3.46Å; M163-L167 PolarHBondContact O-N 3.28Å; M163-L167 VanDerWaalsContact O-N 3.09Å; M163-L167 HydrophobicContact SD-CD1 3.89Å; M163-L167 HydrophobicContact SD-CG 4.08Å; M163-F203 HydrophobicContact CG-CE1 4.17Å; M163-F203 HydrophobicContact SD-CE1 4.32Å; M163-Y207 HydrophobicContact CB-CD1 4.3Å; M163-Y207 HydrophobicContact CE-CD1 4.12Å; M163-Y207 HydrophobicContact CE-CD2 4.43Å; M163-Y207 HydrophobicContact CE-CE1 3.62Å; M163-Y207 HydrophobicContact CE-CE2 3.93Å; M163-Y207 HydrophobicContact CE-CG 4.5Å; M163-Y207 VanDerWaalsContact CE-CZ 3.49Å; M163-Y207 HydrophobicContact CG-CD1 4.31Å; M163-N253 WeakPolarHBondContact CE-OD1 3.32Å; M163-S256 VanDerWaalsContact SD-CB 3.59Å
164	F	97.3	Very high	96.1	Very high	20 Å²	20	19.1 Å²	19.1	9%	0.088	10%	0.099	C	C	.	.	H	α-helix	trans	-62.5	-43.3	-178.7	-173	-103.4	0	0	0	112.4	V123 C160 S166 L167 L168 T197 L200 A201 C204	V123-F164 HydrophobicContact CB-CE1 4.33Å; V123-F164 HydrophobicContact CG1-CD1 3.93Å; V123-F164 HydrophobicContact CG1-CE1 3.91Å; V123-F164 HydrophobicContact CG2-CD1 4.32Å; V123-F164 HydrophobicContact CG2-CE1 3.49Å; V123-F164 VanDerWaalsContact CG2-CE1 3.49Å; V123-F164 HydrophobicContact CG2-CZ 4.29Å; C160-F164 WeakPolarHBondContact O-CB 3.37Å; C160-F164 PolarHBondContact O-N 3.44Å; F164-S166 VanDerWaalsContact C-N 3.35Å; F164-S166 PolarHBondContact O-N 3.17Å; F164-L167 PolarHBondContact O-N 3.11Å; F164-L168 HydrophobicContact CE1-CB 4.5Å; F164-L168 HydrophobicContact CE1-CD2 3.97Å; F164-L168 WeakPolarHBondContact O-CB 3.42Å; F164-L168 PolarHBondContact O-N 3.04Å; F164-T197 HydrophobicContact CZ-CG2 4.32Å; F164-L200 HydrophobicContact CD2-CB 4.45Å; F164-L200 HydrophobicContact CE2-CB 4.14Å; F164-A201 HydrophobicContact CD2-CB 4.32Å; F164-A201 HydrophobicContact CE2-CB 3.75Å; F164-A201 HydrophobicContact CZ-CB 4.43Å; F164-C204 WeakPolarHBondContact CA-SG 3.07Å; F164-C204 HydrophobicContact CB-CB 3.9Å; F164-C204 HydrophobicContact CD2-CB 4.25Å; F164-C204 PolarHBondContact N-SG 3.41Å
165	S	96.4	Very high	95.8	Very high	10 Å²	10	17.7 Å²	17.7	7%	0.07	9%	0.093	C	C	.	.	H	α-helix	trans	-58.6	-46.1	176.4	-65.1	0	0	0	0	111.6	N161 M163 L167 L168 I169	N161-S165 WeakPolarHBondContact O-CB 3.19Å; N161-S165 PolarHBondContact O-N 3.33Å; N161-S165 PolarHBondContact O-OG 3.26Å; N161-S165 PolarHBondContact OD1-OG 3.44Å; M163-S165 PolarHBondContact O-N 3.13Å; S165-L167 PolarHBondContact O-N 3.07Å; S165-L168 PolarHBondContact O-N 3.37Å; S165-I169 WeakPolarHBondContact O-CG1 3.49Å; S165-I169 PolarHBondContact O-N 2.98Å; S165-I169 VanDerWaalsContact O-N 3.07Å
166	S	96.8	Very high	95.6	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-61.7	-46.1	179.7	70.1	0	0	0	0	112.5	I162 M163 F164 I169 I170 S256 Y390	I162-S166 PolarHBondContact O-N 3.03Å; I162-S166 VanDerWaalsContact O-N 3.12Å; M163-S166 PolarHBondContact O-N 3.44Å; M163-S166 PolarHBondContact O-OG 3.5Å; F164-S166 VanDerWaalsContact C-N 3.35Å; F164-S166 PolarHBondContact O-N 3.17Å; S166-I169 PolarHBondContact O-N 3.48Å; S166-I170 WeakPolarHBondContact O-CG1 3.3Å; S166-I170 PolarHBondContact O-N 2.69Å; S166-S256 VanDerWaalsContact OG-CB 3.28Å; S166-S256 WeakPolarHBondContact OG-CB 3.47Å; S166-S256 PolarHBondContact OG-OG 2.98Å; S166-Y390 WeakPolarHBondContact CA-OH 3.28Å; S166-Y390 WeakPolarHBondContact CB-OH 3.22Å; S166-Y390 PolarHBondContact N-OH 2.87Å
167	L	97.2	Very high	95.3	Very high	30 Å²	30	17.3 Å²	17.3	16%	0.157	9%	0.09	C	C	.	.	H	α-helix	trans	-70.3	-35.2	-179.8	-64.1	176.9	0	0	0	112.2	M163 F164 S165 I170 A171 L200 F203	M163-L167 HydrophobicContact CG-CD1 4Å; M163-L167 WeakPolarHBondContact O-CG 3.46Å; M163-L167 PolarHBondContact O-N 3.28Å; M163-L167 VanDerWaalsContact O-N 3.09Å; M163-L167 HydrophobicContact SD-CD1 3.89Å; M163-L167 HydrophobicContact SD-CG 4.08Å; F164-L167 PolarHBondContact O-N 3.11Å; S165-L167 PolarHBondContact O-N 3.07Å; L167-I170 HydrophobicContact CD2-CD1 4.4Å; L167-I170 PolarHBondContact O-N 3.48Å; L167-A171 WeakPolarHBondContact O-CB 3.42Å; L167-A171 PolarHBondContact O-N 3.46Å; L167-L200 HydrophobicContact CB-CD1 4.3Å; L167-L200 HydrophobicContact CB-CD2 4.07Å; L167-L200 HydrophobicContact CD1-CD2 4Å; L167-F203 HydrophobicContact CD1-CD1 3.82Å; L167-F203 HydrophobicContact CD1-CE1 3.9Å
168	L	96.9	Very high	95	Very high	4 Å²	4	17 Å²	17	2%	0.021	9%	0.088	C	C	.	.	H	α-helix	trans	-65.4	-41.3	176.6	-175.8	63	0	0	0	111.4	F116 V119 L120 F164 S165 I170 A171 I172	F116-L168 HydrophobicContact CD1-CD1 4.09Å; F116-L168 HydrophobicContact CE1-CD1 4.17Å; V119-L168 HydrophobicContact CG1-CD1 3.92Å; V119-L168 HydrophobicContact CG1-CD2 4Å; L120-L168 HydrophobicContact CD2-CD2 3.78Å; L120-L168 HydrophobicContact CG-CD2 4.39Å; F164-L168 HydrophobicContact CE1-CB 4.5Å; F164-L168 HydrophobicContact CE1-CD2 3.97Å; F164-L168 WeakPolarHBondContact O-CB 3.42Å; F164-L168 PolarHBondContact O-N 3.04Å; S165-L168 PolarHBondContact O-N 3.37Å; L168-I170 VanDerWaalsContact C-N 3.34Å; L168-I170 PolarHBondContact O-N 2.86Å; L168-A171 PolarHBondContact O-N 3.48Å; L168-I172 HydrophobicContact CD1-CD1 4.5Å; L168-I172 HydrophobicContact CG-CD1 4.06Å; L168-I172 VanDerWaalsContact O-CG1 3.27Å; L168-I172 WeakPolarHBondContact O-CG1 3.43Å; L168-I172 PolarHBondContact O-N 2.84Å
169	I	96.1	Very high	94.4	Very high	7 Å²	7	18.1 Å²	18.1	4%	0.036	10%	0.095	C	C	.	.	H	α-helix	trans	-61.7	-42	175.1	-69	-65	0	0	0	111.3	S165 S166 I172 A173 V264 V386 A387 Y390	S165-I169 WeakPolarHBondContact O-CG1 3.49Å; S165-I169 PolarHBondContact O-N 2.98Å; S165-I169 VanDerWaalsContact O-N 3.07Å; S166-I169 PolarHBondContact O-N 3.48Å; I169-I172 PolarHBondContact O-N 3.38Å; I169-A173 WeakPolarHBondContact O-CB 3.08Å; I169-A173 PolarHBondContact O-N 3.41Å; I169-V264 HydrophobicContact CG2-CG2 3.62Å; I169-V386 HydrophobicContact CD1-CG1 4.22Å; I169-A387 HydrophobicContact CG2-CB 4.02Å; I169-Y390 HydrophobicContact CG1-CD1 3.99Å; I169-Y390 HydrophobicContact CG1-CE1 4.31Å; I169-Y390 HydrophobicContact CG1-CG 4.11Å; I169-Y390 HydrophobicContact CG2-CD1 4.46Å
170	I	96.7	Very high	94	Very high	21 Å²	21	17.6 Å²	17.6	11%	0.108	9%	0.092	C	C	.	.	H	α-helix	trans	-61	-46.9	174.1	-64.7	164.4	0	0	0	110.6	S166 L167 L168 I172 A173 L174 L259	S166-I170 WeakPolarHBondContact O-CG1 3.3Å; S166-I170 PolarHBondContact O-N 2.69Å; L167-I170 HydrophobicContact CD2-CD1 4.4Å; L167-I170 PolarHBondContact O-N 3.48Å; L168-I170 VanDerWaalsContact C-N 3.34Å; L168-I170 PolarHBondContact O-N 2.86Å; I170-I172 VanDerWaalsContact C-N 3.32Å; I170-I172 PolarHBondContact O-N 2.82Å; I170-A173 PolarHBondContact O-N 3.21Å; I170-L174 HydrophobicContact CG2-CD1 3.92Å; I170-L174 HydrophobicContact CG2-CG 4.36Å; I170-L174 WeakPolarHBondContact O-CB 3.34Å; I170-L174 WeakPolarHBondContact O-CG 3.41Å; I170-L174 PolarHBondContact O-N 3.34Å; I170-L259 HydrophobicContact CD1-CB 4.31Å; I170-L259 HydrophobicContact CD1-CD2 3.96Å; I170-L259 HydrophobicContact CD1-CG 3.84Å
171	A	95.3	Very high	93.5	Very high	6 Å²	6	17.7 Å²	17.7	5%	0.05	9%	0.093	C	C	.	.	H	α-helix	trans	-60.7	-40.6	179.2	0	0	0	0	0	112.2	F116 L167 L168 E175 L196 L200	F116-A171 HydrophobicContact CE1-CB 4.3Å; L167-A171 WeakPolarHBondContact O-CB 3.42Å; L167-A171 PolarHBondContact O-N 3.46Å; L168-A171 PolarHBondContact O-N 3.48Å; A171-E175 VanDerWaalsContact O-CB 3.3Å; A171-E175 WeakPolarHBondContact O-CB 2.89Å; A171-E175 PolarHBondContact O-N 2.91Å; A171-L196 HydrophobicContact CB-CD2 4.13Å; A171-L200 HydrophobicContact CB-CD1 4.11Å
172	I	94.3	Very high	92.8	Very high	4 Å²	4	20.3 Å²	20.3	2%	0.021	11%	0.105	C	C	.	.	H	α-helix	trans	-63	-48.7	174.9	-71.1	166.7	0	0	0	110.6	F116 L120 L168 I169 I170 L174 E175 R176 L383	F116-I172 HydrophobicContact CB-CD1 4.5Å; F116-I172 HydrophobicContact CB-CG1 4.04Å; F116-I172 HydrophobicContact CD1-CD1 4.33Å; F116-I172 HydrophobicContact CD1-CG1 3.52Å; F116-I172 HydrophobicContact CE1-CG1 4.17Å; F116-I172 HydrophobicContact CG-CG1 3.88Å; L120-I172 HydrophobicContact CD1-CD1 3.86Å; L120-I172 HydrophobicContact CD2-CD1 4.1Å; L120-I172 HydrophobicContact CG-CD1 4.05Å; L168-I172 HydrophobicContact CD1-CD1 4.5Å; L168-I172 HydrophobicContact CG-CD1 4.06Å; L168-I172 VanDerWaalsContact O-CG1 3.27Å; L168-I172 WeakPolarHBondContact O-CG1 3.43Å; L168-I172 PolarHBondContact O-N 2.84Å; I169-I172 PolarHBondContact O-N 3.38Å; I170-I172 VanDerWaalsContact C-N 3.32Å; I170-I172 PolarHBondContact O-N 2.82Å; I172-L174 PolarHBondContact O-N 2.71Å; I172-E175 PolarHBondContact O-N 3.45Å; I172-R176 WeakPolarHBondContact O-CG 3.34Å; I172-R176 PolarHBondContact O-N 2.96Å; I172-L383 HydrophobicContact CG2-CB 3.89Å; I172-L383 HydrophobicContact CG2-CD1 3.95Å; I172-L383 HydrophobicContact CG2-CD2 4.03Å; I172-L383 HydrophobicContact CG2-CG 4.16Å
173	A	94.7	Very high	91.8	Very high	1 Å²	1	24 Å²	24	1%	0.008	13%	0.13	C	C	.	.	H	α-helix	trans	-61.1	-43.6	179.9	0	0	0	0	0	111.8	I169 I170 R176 Y177 V264 L267 Y268	I169-A173 WeakPolarHBondContact O-CB 3.08Å; I169-A173 PolarHBondContact O-N 3.41Å; I170-A173 PolarHBondContact O-N 3.21Å; A173-R176 PolarHBondContact O-N 3.4Å; A173-Y177 WeakPolarHBondContact O-CB 3.44Å; A173-Y177 PolarHBondContact O-N 3.49Å; A173-V264 HydrophobicContact CB-CG2 4.42Å; A173-L267 HydrophobicContact CB-CB 4.4Å; A173-L267 HydrophobicContact CB-CD1 3.72Å; A173-Y268 HydrophobicContact CB-CD2 4.47Å; A173-Y268 HydrophobicContact CB-CE2 3.96Å
174	L	93.6	Very high	90.4	Very high	74 Å²	74	30.6 Å²	30.6	39%	0.387	17%	0.165	S	C	.	.	H	α-helix	trans	-62.2	-43.4	175.9	-76.2	172.1	0	0	0	111.6	I170 I172 R176 Y177 L178 L267	I170-L174 HydrophobicContact CG2-CD1 3.92Å; I170-L174 HydrophobicContact CG2-CG 4.36Å; I170-L174 WeakPolarHBondContact O-CB 3.34Å; I170-L174 WeakPolarHBondContact O-CG 3.41Å; I170-L174 PolarHBondContact O-N 3.34Å; I172-L174 PolarHBondContact O-N 2.71Å; L174-R176 PolarHBondContact O-N 2.93Å; L174-Y177 PolarHBondContact O-N 3.07Å; L174-L178 WeakPolarHBondContact O-CB 3.5Å; L174-L178 VanDerWaalsContact O-CG 3.24Å; L174-L178 WeakPolarHBondContact O-CG 3.35Å; L174-L178 PolarHBondContact O-N 3.25Å; L174-L267 HydrophobicContact CB-CD1 4.45Å; L174-L267 HydrophobicContact CD2-CD1 3.6Å; L174-L267 HydrophobicContact CD2-CD2 3.96Å; L174-L267 HydrophobicContact CD2-CG 4.45Å; L174-L267 HydrophobicContact CG-CD1 3.78Å
175	E	91.2	Very high	88.8	Confident	1 Å²	1	38 Å²	38	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-66	-39.3	179.6	-176.7	-86.2	162.9	0	0	112.4	T112 F116 A171 I172 T179 L188	T112-E175 WeakPolarHBondContact CB-OE1 3.49Å; T112-E175 PolarHBondContact OG1-OE1 3.24Å; F116-E175 HydrophobicContact CD2-CG 4.23Å; F116-E175 HydrophobicContact CE2-CB 3.94Å; F116-E175 HydrophobicContact CE2-CG 3.73Å; F116-E175 HydrophobicContact CZ-CB 4.44Å; A171-E175 VanDerWaalsContact O-CB 3.3Å; A171-E175 WeakPolarHBondContact O-CB 2.89Å; A171-E175 PolarHBondContact O-N 2.91Å; I172-E175 PolarHBondContact O-N 3.45Å; E175-T179 VanDerWaalsContact O-CB 3.3Å; E175-T179 WeakPolarHBondContact O-CB 3.47Å; E175-T179 PolarHBondContact O-N 2.97Å; E175-T179 PolarHBondContact O-OG1 2.56Å; E175-T179 PolarHBondContact OE1-OG1 3.11Å; E175-L188 HydrophobicContact CB-CD2 3.56Å; E175-L188 HydrophobicContact CG-CD2 3.31Å
176	R	91.8	Very high	87.2	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-61.4	-46.3	172.4	-69.6	-59.5	100.7	-160.5	4.2	111.4	I172 A173 L174 T179 I180 I271 E376 S379 A380 L383	I172-R176 WeakPolarHBondContact O-CG 3.34Å; I172-R176 PolarHBondContact O-N 2.96Å; A173-R176 PolarHBondContact O-N 3.4Å; L174-R176 PolarHBondContact O-N 2.93Å; R176-T179 PolarHBondContact O-N 2.9Å; R176-I180 WeakPolarHBondContact O-CB 3.28Å; R176-I180 WeakPolarHBondContact O-CG1 3.33Å; R176-I180 PolarHBondContact O-N 2.93Å; R176-I271 HydrophobicContact CB-CD1 3.91Å; R176-E376 IonicContact NH1-OE2 3.39Å; R176-E376 PolarHBondContact NH1-OE2 2.96Å; R176-S379 PolarHBondContact NH1-OG 3.49Å; R176-S379 VanDerWaalsContact NH1-OG 3.1Å; R176-A380 HydrophobicContact CB-CB 4.36Å; R176-A380 HydrophobicContact CG-CB 4.18Å; R176-L383 HydrophobicContact CG-CD1 4.09Å
177	Y	91.6	Very high	86.1	Confident	52 Å²	52	50.4 Å²	50.4	20%	0.204	24%	0.242	C	C	.	.	H	α-helix	trans	-59.5	-51.5	177.7	170.1	-103.5	0	0	0	111.6	A173 L174 T179 I180 C181 H182 L267 L270 I271	A173-Y177 WeakPolarHBondContact O-CB 3.44Å; A173-Y177 PolarHBondContact O-N 3.49Å; L174-Y177 PolarHBondContact O-N 3.07Å; Y177-T179 VanDerWaalsContact C-N 3.32Å; Y177-T179 PolarHBondContact O-N 3.37Å; Y177-I180 PolarHBondContact O-N 3.26Å; Y177-C181 HydrophobicContact CD2-CB 3.99Å; Y177-C181 WeakPolarHBondContact CD2-SG 3.33Å; Y177-C181 HydrophobicContact CE2-CB 3.73Å; Y177-C181 VanDerWaalsContact CE2-SG 3.58Å; Y177-C181 VanDerWaalsContact O-CB 3.23Å; Y177-C181 WeakPolarHBondContact O-CB 3.45Å; Y177-C181 PolarHBondContact O-N 3.36Å; Y177-H182 AromaticContact CZ-NE2 3.9Å; Y177-H182 PolarHBondContact OH-NE2 2.63Å; Y177-L267 HydrophobicContact CD1-CD2 4.02Å; Y177-L267 HydrophobicContact CD2-CD2 4.3Å; Y177-L267 HydrophobicContact CG-CD2 3.84Å; Y177-L270 HydrophobicContact CD2-CB 4Å; Y177-L270 HydrophobicContact CD2-CD1 4.3Å; Y177-L270 HydrophobicContact CE2-CB 3.72Å; Y177-L270 HydrophobicContact CE2-CD1 3.68Å; Y177-L270 HydrophobicContact CE2-CG 4.35Å; Y177-I271 HydrophobicContact CD2-CG1 4.4Å
178	L	89.8	Confident	85.1	Confident	36 Å²	36	50.7 Å²	50.7	19%	0.188	24%	0.244	C	C	.	.	H	α-helix	trans	-61.9	-40.1	-179.5	-67.8	173.6	0	0	0	112.1	L174 H182 I187 L188	L174-L178 WeakPolarHBondContact O-CB 3.5Å; L174-L178 VanDerWaalsContact O-CG 3.24Å; L174-L178 WeakPolarHBondContact O-CG 3.35Å; L174-L178 PolarHBondContact O-N 3.25Å; L178-H182 CarbonylContact O-C 3.6Å; L178-H182 VanDerWaalsContact O-C 3.31Å; L178-H182 WeakPolarHBondContact O-CA 3.48Å; L178-H182 WeakPolarHBondContact O-CB 3.36Å; L178-H182 PolarHBondContact O-N 3.06Å; L178-H182 VanDerWaalsContact O-N 3.12Å; L178-I187 HydrophobicContact CD1-CB 4.42Å; L178-I187 HydrophobicContact CD1-CG2 4.09Å; L178-I187 HydrophobicContact CD2-CD1 3.92Å; L178-L188 HydrophobicContact CD1-CB 4.29Å
179	T	84.3	Confident	84.4	Confident	39 Å²	39	52 Å²	52	24%	0.239	25%	0.252	C	S	.	.	H	α-helix	trans	-69.5	-38.9	-179.1	-59.7	0	0	0	0	112.5	E175 R176 Y177 E376	E175-T179 VanDerWaalsContact O-CB 3.3Å; E175-T179 WeakPolarHBondContact O-CB 3.47Å; E175-T179 PolarHBondContact O-N 2.97Å; E175-T179 PolarHBondContact O-OG1 2.56Å; E175-T179 PolarHBondContact OE1-OG1 3.11Å; R176-T179 PolarHBondContact O-N 2.9Å; Y177-T179 VanDerWaalsContact C-N 3.32Å; Y177-T179 PolarHBondContact O-N 3.37Å; T179-E376 HydrophobicContact CG2-CG 4.14Å
180	I	86.1	Confident	83.7	Confident	6 Å²	6	54.4 Å²	54.4	3%	0.031	26%	0.264	C	S	.	.	H	α-helix	trans	-87	-46.2	-176.4	-68.2	169.4	0	0	0	112	R176 Y177 I271 L373 E376 A380	R176-I180 WeakPolarHBondContact O-CB 3.28Å; R176-I180 WeakPolarHBondContact O-CG1 3.33Å; R176-I180 PolarHBondContact O-N 2.93Å; Y177-I180 PolarHBondContact O-N 3.26Å; I180-I271 HydrophobicContact CD1-CG2 3.89Å; I180-I271 HydrophobicContact CG2-CG2 4.23Å; I180-L373 HydrophobicContact CG2-CD1 4.11Å; I180-E376 HydrophobicContact CG1-CB 4.09Å; I180-A380 HydrophobicContact CD1-CB 3.47Å; I180-A380 VanDerWaalsContact CD1-CB 3.47Å
181	C	85.9	Confident	83.1	Confident	22 Å²	22	61 Å²	61	15%	0.149	29%	0.291	C	S	.	.	H	α-helix	trans	-83.6	-23.8	-174.1	-58.6	0	0	0	0	112.4	Y177 P183 V274	Y177-C181 HydrophobicContact CD2-CB 3.99Å; Y177-C181 WeakPolarHBondContact CD2-SG 3.33Å; Y177-C181 HydrophobicContact CE2-CB 3.73Å; Y177-C181 VanDerWaalsContact CE2-SG 3.58Å; Y177-C181 VanDerWaalsContact O-CB 3.23Å; Y177-C181 WeakPolarHBondContact O-CB 3.45Å; Y177-C181 PolarHBondContact O-N 3.36Å; C181-P183 VanDerWaalsContact C-CD 3.49Å; C181-V274 HydrophobicContact CB-CG2 4.31Å
182	H	82.5	Confident	82.9	Confident	63 Å²	63	67.6 Å²	67.6	29%	0.292	32%	0.315	S	S	.	.			trans	-131.1	58.4	-179.5	-59.6	-63.9	0	0	0	113.3	Y177 L178 L184 R185	Y177-H182 AromaticContact CZ-NE2 3.9Å; Y177-H182 PolarHBondContact OH-NE2 2.63Å; L178-H182 CarbonylContact O-C 3.6Å; L178-H182 VanDerWaalsContact O-C 3.31Å; L178-H182 WeakPolarHBondContact O-CA 3.48Å; L178-H182 WeakPolarHBondContact O-CB 3.36Å; L178-H182 PolarHBondContact O-N 3.06Å; L178-H182 VanDerWaalsContact O-N 3.12Å; H182-L184 PolarHBondContact O-N 2.95Å; H182-L184 VanDerWaalsContact O-N 3.08Å; H182-R185 HydrophobicContact CB-CB 4.13Å; H182-R185 CarbonylContact O-C 3.54Å; H182-R185 PolarHBondContact O-N 2.72Å; H182-R185 VanDerWaalsContact O-O 3.13Å
183	P	72.4	Confident	82.6	Confident	99 Å²	99	67.4 Å²	67.4	64%	0.643	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-25.4	-174.5	26	-35.6	0	0	0	113.8	C181	C181-P183 VanDerWaalsContact C-CD 3.49Å
184	L	67.3	Low	82.5	Confident	148 Å²	148	73.1 Å²	73.1	78%	0.775	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-19.7	178.7	-60.1	179.1	0	0	0	113	H182 R186	H182-L184 PolarHBondContact O-N 2.95Å; H182-L184 VanDerWaalsContact O-N 3.08Å; L184-R186 PolarHBondContact O-N 3.44Å
185	R	62.9	Low	82.5	Confident	176 Å²	176	77.4 Å²	77.4	66%	0.664	35%	0.351	S	S	*	.			trans	-96.6	95.2	175	-57.7	-173.1	174.3	-169.9	-2	107.8	H182 I187	H182-R185 HydrophobicContact CB-CB 4.13Å; H182-R185 CarbonylContact O-C 3.54Å; H182-R185 PolarHBondContact O-N 2.72Å; H182-R185 VanDerWaalsContact O-O 3.13Å; R185-I187 HydrophobicContact CB-CD1 3.67Å; R185-I187 HydrophobicContact CB-CG1 3.77Å; R185-I187 PolarHBondContact O-N 3.48Å
186	R	64.6	Low	82.6	Confident	201 Å²	201	80.2 Å²	80.2	76%	0.758	37%	0.366	S	S	*	.			trans	-70.1	58	176.3	-163.8	-170.3	-179.9	-179.2	-2.1	111.7	L184 T189	L184-R186 PolarHBondContact O-N 3.44Å; R186-T189 HydrophobicContact CG-CG2 4.06Å
187	I	72.7	Confident	82.8	Confident	69 Å²	69	80.9 Å²	80.9	35%	0.354	37%	0.37	S	S	.	.			trans	-69.4	-49.1	-172.7	-65.6	162.1	0	0	0	109.7	L178 R185 R192	L178-I187 HydrophobicContact CD1-CB 4.42Å; L178-I187 HydrophobicContact CD1-CG2 4.09Å; L178-I187 HydrophobicContact CD2-CD1 3.92Å; R185-I187 HydrophobicContact CB-CD1 3.67Å; R185-I187 HydrophobicContact CB-CG1 3.77Å; R185-I187 PolarHBondContact O-N 3.48Å; I187-R192 WeakPolarHBondContact O-CD 3.48Å; I187-R192 PolarHBondContact O-NH1 3.06Å
188	L	76.9	Confident	83	Confident	35 Å²	35	83.2 Å²	83.2	18%	0.183	39%	0.385	C	S	.	.	S	Bend	trans	-99.9	92.8	178.2	-152.6	78.3	0	0	0	111	F116 E175 L178 R192 A193 L196	F116-L188 HydrophobicContact CE2-CD2 4.37Å; E175-L188 HydrophobicContact CB-CD2 3.56Å; E175-L188 HydrophobicContact CG-CD2 3.31Å; L178-L188 HydrophobicContact CD1-CB 4.29Å; L188-R192 HydrophobicContact CD1-CB 4.22Å; L188-A193 HydrophobicContact CD2-CB 4.07Å; L188-A193 HydrophobicContact CG-CB 4.25Å; L188-L196 HydrophobicContact CD1-CD2 4.44Å
189	T	81.6	Confident	83.3	Confident	31 Å²	31	84.6 Å²	84.6	19%	0.19	40%	0.398	C	S	.	.			trans	-77.6	160.1	170.5	67.1	0	0	0	0	110.5	R186 K191 R192 A193	R186-T189 HydrophobicContact CG-CG2 4.06Å; T189-K191 PolarHBondContact O-N 2.78Å; T189-K191 VanDerWaalsContact O-N 3.16Å; T189-R192 PolarHBondContact O-N 2.87Å; T189-R192 WeakPolarHBondContact OG1-CG 3.28Å; T189-R192 PolarHBondContact OG1-N 2.64Å; T189-A193 PolarHBondContact O-N 3.48Å
190	M	80.7	Confident	84	Confident	59 Å²	59	84.1 Å²	84.1	29%	0.291	39%	0.394	S	S	.	.	H	α-helix	trans	-51.5	-38.2	173	-65.7	-58.8	-68.9	0	0	113.3	T112 F115 K194	T112-M190 WeakPolarHBondContact CA-SD 3.19Å; T112-M190 HydrophobicContact CG2-CG 4.38Å; T112-M190 HydrophobicContact CG2-SD 3.34Å; T112-M190 WeakPolarHBondContact CG2-SD 3.3Å; T112-M190 PolarHBondContact N-SD 2.65Å; F115-M190 HydrophobicContact CB-CE 3.59Å; F115-M190 HydrophobicContact CG-CE 4.24Å; M190-K194 WeakPolarHBondContact O-CG 3.37Å; M190-K194 PolarHBondContact O-N 3.07Å; M190-K194 VanDerWaalsContact O-N 3.08Å
191	K	85.2	Confident	84.5	Confident	158 Å²	158	85.2 Å²	85.2	69%	0.687	40%	0.404	S	S	*	.	H	α-helix	trans	-64.4	-48.8	177.2	-67.4	-173.2	177.3	-173.6	0	110.6	T189 A193 K194 Y195	T189-K191 PolarHBondContact O-N 2.78Å; T189-K191 VanDerWaalsContact O-N 3.16Å; K191-A193 PolarHBondContact O-N 3.26Å; K191-K194 PolarHBondContact O-N 3.38Å; K191-Y195 HydrophobicContact CB-CE2 4.29Å; K191-Y195 WeakPolarHBondContact O-CD2 3.5Å; K191-Y195 PolarHBondContact O-N 3.49Å
192	R	89.8	Confident	85.1	Confident	145 Å²	145	88.7 Å²	88.7	55%	0.547	42%	0.42	S	S	.	.	H	α-helix	trans	-62.7	-40.9	177.9	-70.5	178.3	179.2	-180	-4.5	112.2	I187 L188 T189 K194 Y195 L196	I187-R192 WeakPolarHBondContact O-CD 3.48Å; I187-R192 PolarHBondContact O-NH1 3.06Å; L188-R192 HydrophobicContact CD1-CB 4.22Å; T189-R192 PolarHBondContact O-N 2.87Å; T189-R192 WeakPolarHBondContact OG1-CG 3.28Å; T189-R192 PolarHBondContact OG1-N 2.64Å; R192-K194 PolarHBondContact O-N 3.44Å; R192-Y195 PolarHBondContact O-N 3.23Å; R192-L196 VanDerWaalsContact O-CB 3.29Å; R192-L196 WeakPolarHBondContact O-CB 3.29Å; R192-L196 PolarHBondContact O-N 3.02Å
193	A	89.5	Confident	85.8	Confident	0 Å²	0	90.8 Å²	90.8	0%	0	43%	0.428	C	S	.	.	H	α-helix	trans	-60.4	-43.6	175.3	0	0	0	0	0	111.9	T112 F115 F116 L188 T189 K191 L196 T197	T112-A193 HydrophobicContact CG2-CB 4.38Å; F115-A193 HydrophobicContact CD1-CB 4.11Å; F115-A193 HydrophobicContact CE1-CB 4.03Å; F116-A193 HydrophobicContact CE2-CB 4.12Å; F116-A193 HydrophobicContact CZ-CB 4.29Å; L188-A193 HydrophobicContact CD2-CB 4.07Å; L188-A193 HydrophobicContact CG-CB 4.25Å; T189-A193 PolarHBondContact O-N 3.48Å; K191-A193 PolarHBondContact O-N 3.26Å; A193-L196 PolarHBondContact O-N 2.99Å; A193-T197 PolarHBondContact O-N 2.93Å; A193-T197 PolarHBondContact O-OG1 3.02Å; A193-T197 VanDerWaalsContact O-OG1 3.1Å
194	K	91.9	Very high	87	Confident	121 Å²	121	86 Å²	86	53%	0.526	40%	0.398	S	S	.	.	H	α-helix	trans	-61.4	-48.1	174.8	-73.4	177.2	176.9	-165.9	0	112.6	F115 M190 K191 R192 L196 T197 L198	F115-K194 HydrophobicContact CD2-CG 4.29Å; F115-K194 HydrophobicContact CE1-CG 4.47Å; F115-K194 HydrophobicContact CE2-CG 3.64Å; F115-K194 HydrophobicContact CZ-CB 4.34Å; F115-K194 HydrophobicContact CZ-CG 3.75Å; M190-K194 WeakPolarHBondContact O-CG 3.37Å; M190-K194 PolarHBondContact O-N 3.07Å; M190-K194 VanDerWaalsContact O-N 3.08Å; K191-K194 PolarHBondContact O-N 3.38Å; R192-K194 PolarHBondContact O-N 3.44Å; K194-L196 VanDerWaalsContact C-N 3.34Å; K194-T197 PolarHBondContact O-N 3.48Å; K194-L198 WeakPolarHBondContact O-CB 3.37Å; K194-L198 PolarHBondContact O-N 3.46Å
195	Y	93.5	Very high	88.5	Confident	165 Å²	165	82.8 Å²	82.8	65%	0.647	38%	0.38	S	S	*	.	H	α-helix	trans	-62.9	-41	178.1	-70.2	-58.4	0	0	0	111.9	K191 R192 L198 S199	K191-Y195 HydrophobicContact CB-CE2 4.29Å; K191-Y195 WeakPolarHBondContact O-CD2 3.5Å; K191-Y195 PolarHBondContact O-N 3.49Å; R192-Y195 PolarHBondContact O-N 3.23Å; Y195-L198 PolarHBondContact O-N 3.05Å; Y195-S199 WeakPolarHBondContact O-CB 3.49Å; Y195-S199 PolarHBondContact O-N 3.43Å; Y195-S199 PolarHBondContact O-OG 3.13Å
196	L	94.2	Very high	90.2	Very high	60 Å²	60	78.2 Å²	78.2	31%	0.314	37%	0.371	S	S	.	.	H	α-helix	trans	-59.8	-52.5	175.5	177.7	65.9	0	0	0	111.3	A171 L188 R192 A193 K194 L198 S199 L200	A171-L196 HydrophobicContact CB-CD2 4.13Å; L188-L196 HydrophobicContact CD1-CD2 4.44Å; R192-L196 VanDerWaalsContact O-CB 3.29Å; R192-L196 WeakPolarHBondContact O-CB 3.29Å; R192-L196 PolarHBondContact O-N 3.02Å; A193-L196 PolarHBondContact O-N 2.99Å; K194-L196 VanDerWaalsContact C-N 3.34Å; L196-L198 VanDerWaalsContact C-N 3.31Å; L196-L198 PolarHBondContact O-N 3.42Å; L196-S199 WeakPolarHBondContact CA-OG 3.41Å; L196-S199 PolarHBondContact O-N 3.4Å; L196-S199 PolarHBondContact O-OG 2.82Å; L196-L200 HydrophobicContact CD1-CD1 4.38Å; L196-L200 HydrophobicContact CD1-CG 4.41Å; L196-L200 HydrophobicContact CG-CD1 4.27Å; L196-L200 VanDerWaalsContact O-CG 3.29Å; L196-L200 WeakPolarHBondContact O-CG 3.05Å; L196-L200 PolarHBondContact O-N 2.74Å
197	T	95	Very high	91.7	Very high	14 Å²	14	69.9 Å²	69.9	9%	0.086	34%	0.34	C	S	.	.	H	α-helix	trans	-60.4	-41.3	178.8	-58	0	0	0	0	111.7	V119 F164 A193 K194 L200 A201	V119-T197 HydrophobicContact CG1-CG2 3.75Å; V119-T197 HydrophobicContact CG2-CG2 4.12Å; F164-T197 HydrophobicContact CZ-CG2 4.32Å; A193-T197 PolarHBondContact O-N 2.93Å; A193-T197 PolarHBondContact O-OG1 3.02Å; A193-T197 VanDerWaalsContact O-OG1 3.1Å; K194-T197 PolarHBondContact O-N 3.48Å; T197-L200 PolarHBondContact O-N 3.01Å; T197-A201 PolarHBondContact O-N 3.29Å
198	L	95.9	Very high	92.9	Very high	101 Å²	101	66.6 Å²	66.6	53%	0.529	32%	0.323	S	S	.	.	H	α-helix	trans	-64.6	-44.1	176.9	-178.8	62.7	0	0	0	111.9	K194 Y195 L196 L200 A201 I202	K194-L198 WeakPolarHBondContact O-CB 3.37Å; K194-L198 PolarHBondContact O-N 3.46Å; Y195-L198 PolarHBondContact O-N 3.05Å; L196-L198 VanDerWaalsContact C-N 3.31Å; L196-L198 PolarHBondContact O-N 3.42Å; L198-L200 VanDerWaalsContact C-N 3.32Å; L198-L200 PolarHBondContact O-N 3.01Å; L198-A201 PolarHBondContact O-N 3.49Å; L198-I202 HydrophobicContact CD1-CD1 4.25Å; L198-I202 HydrophobicContact CD1-CG1 4.48Å; L198-I202 HydrophobicContact CG-CD1 4.06Å; L198-I202 WeakPolarHBondContact O-CG1 3.33Å; L198-I202 PolarHBondContact O-N 3.18Å
199	S	97.3	Very high	93.9	Very high	64 Å²	64	69.1 Å²	69.1	45%	0.448	34%	0.336	S	S	.	.	H	α-helix	trans	-63.7	-38.6	177.7	58.5	0	0	0	0	112.1	Y195 L196 I202 F203	Y195-S199 WeakPolarHBondContact O-CB 3.49Å; Y195-S199 PolarHBondContact O-N 3.43Å; Y195-S199 PolarHBondContact O-OG 3.13Å; L196-S199 WeakPolarHBondContact CA-OG 3.41Å; L196-S199 PolarHBondContact O-N 3.4Å; L196-S199 PolarHBondContact O-OG 2.82Å; S199-I202 PolarHBondContact O-N 2.98Å; S199-F203 WeakPolarHBondContact O-CB 3.48Å; S199-F203 PolarHBondContact O-N 3.33Å
200	L	97.4	Very high	94.6	Very high	29 Å²	29	71.7 Å²	71.7	15%	0.152	35%	0.348	C	S	.	.	H	α-helix	trans	-64.2	-41.9	175.1	-68.2	176	0	0	0	111.1	F164 L167 A171 L196 T197 L198 F203 C204	F164-L200 HydrophobicContact CD2-CB 4.45Å; F164-L200 HydrophobicContact CE2-CB 4.14Å; L167-L200 HydrophobicContact CB-CD1 4.3Å; L167-L200 HydrophobicContact CB-CD2 4.07Å; L167-L200 HydrophobicContact CD1-CD2 4Å; A171-L200 HydrophobicContact CB-CD1 4.11Å; L196-L200 HydrophobicContact CD1-CD1 4.38Å; L196-L200 HydrophobicContact CD1-CG 4.41Å; L196-L200 HydrophobicContact CG-CD1 4.27Å; L196-L200 VanDerWaalsContact O-CG 3.29Å; L196-L200 WeakPolarHBondContact O-CG 3.05Å; L196-L200 PolarHBondContact O-N 2.74Å; T197-L200 PolarHBondContact O-N 3.01Å; L198-L200 VanDerWaalsContact C-N 3.32Å; L198-L200 PolarHBondContact O-N 3.01Å; L200-F203 PolarHBondContact O-N 3.02Å; L200-C204 WeakPolarHBondContact O-CB 3.31Å; L200-C204 PolarHBondContact O-N 3.11Å; L200-C204 PolarHBondContact O-SG 3.36Å
201	A	97.4	Very high	95.4	Very high	29 Å²	29	69 Å²	69	24%	0.24	34%	0.335	C	S	.	.	H	α-helix	trans	-62.9	-46.3	178.1	0	0	0	0	0	111.8	F164 T197 L198 F203 C204 I205	F164-A201 HydrophobicContact CD2-CB 4.32Å; F164-A201 HydrophobicContact CE2-CB 3.75Å; F164-A201 HydrophobicContact CZ-CB 4.43Å; T197-A201 PolarHBondContact O-N 3.29Å; L198-A201 PolarHBondContact O-N 3.49Å; A201-F203 PolarHBondContact O-N 3.38Å; A201-C204 PolarHBondContact O-N 3.43Å; A201-I205 VanDerWaalsContact O-CG1 3.29Å; A201-I205 WeakPolarHBondContact O-CG1 3.4Å; A201-I205 PolarHBondContact O-N 2.89Å
202	I	98.1	Very high	95.9	Very high	96 Å²	96	62 Å²	62	49%	0.492	31%	0.307	S	S	.	.	H	α-helix	trans	-61.1	-46.1	177.5	-65.5	166.5	0	0	0	110.7	L198 S199 C204 I205 V206	L198-I202 HydrophobicContact CD1-CD1 4.25Å; L198-I202 HydrophobicContact CD1-CG1 4.48Å; L198-I202 HydrophobicContact CG-CD1 4.06Å; L198-I202 WeakPolarHBondContact O-CG1 3.33Å; L198-I202 PolarHBondContact O-N 3.18Å; S199-I202 PolarHBondContact O-N 2.98Å; I202-C204 VanDerWaalsContact C-N 3.33Å; I202-C204 PolarHBondContact O-N 2.89Å; I202-I205 PolarHBondContact O-N 3.48Å; I202-V206 WeakPolarHBondContact O-CG2 3.38Å; I202-V206 PolarHBondContact O-N 3.27Å; I202-V206 VanDerWaalsContact O-N 3.08Å
203	F	98.1	Very high	96.2	Very high	106 Å²	106	60.9 Å²	60.9	47%	0.465	31%	0.311	S	S	.	.	H	α-helix	trans	-56.4	-46.5	175.7	171.4	-100.4	0	0	0	111.8	M163 L167 S199 L200 A201 I205 V206 Y207	M163-F203 HydrophobicContact CG-CE1 4.17Å; M163-F203 HydrophobicContact SD-CE1 4.32Å; L167-F203 HydrophobicContact CD1-CD1 3.82Å; L167-F203 HydrophobicContact CD1-CE1 3.9Å; S199-F203 WeakPolarHBondContact O-CB 3.48Å; S199-F203 PolarHBondContact O-N 3.33Å; L200-F203 PolarHBondContact O-N 3.02Å; A201-F203 PolarHBondContact O-N 3.38Å; F203-I205 PolarHBondContact O-N 3.12Å; F203-V206 PolarHBondContact O-N 3.17Å; F203-Y207 HydrophobicContact CZ-CD2 4.15Å; F203-Y207 WeakPolarHBondContact O-CB 3.06Å; F203-Y207 PolarHBondContact O-N 3Å
204	C	98	Very high	96.4	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-68.6	-32.6	-179.1	-62.9	0	0	0	0	113	F164 L200 A201 I202 Y207 G208	F164-C204 WeakPolarHBondContact CA-SG 3.07Å; F164-C204 HydrophobicContact CB-CB 3.9Å; F164-C204 HydrophobicContact CD2-CB 4.25Å; F164-C204 PolarHBondContact N-SG 3.41Å; L200-C204 WeakPolarHBondContact O-CB 3.31Å; L200-C204 PolarHBondContact O-N 3.11Å; L200-C204 PolarHBondContact O-SG 3.36Å; A201-C204 PolarHBondContact O-N 3.43Å; I202-C204 VanDerWaalsContact C-N 3.33Å; I202-C204 PolarHBondContact O-N 2.89Å; C204-Y207 PolarHBondContact O-N 3.47Å; C204-G208 PolarHBondContact O-N 3.41Å
205	I	97.9	Very high	96.6	Very high	79 Å²	79	57.6 Å²	57.6	41%	0.405	30%	0.298	S	S	.	.	H	α-helix	trans	-64.3	-48	173.5	-70	164.1	0	0	0	110.1	F156 A201 I202 F203 Y207 G208 I209	F156-I205 HydrophobicContact CE2-CG2 4.36Å; F156-I205 HydrophobicContact CZ-CG2 4.38Å; A201-I205 VanDerWaalsContact O-CG1 3.29Å; A201-I205 WeakPolarHBondContact O-CG1 3.4Å; A201-I205 PolarHBondContact O-N 2.89Å; I202-I205 PolarHBondContact O-N 3.48Å; F203-I205 PolarHBondContact O-N 3.12Å; I205-Y207 VanDerWaalsContact C-N 3.33Å; I205-Y207 PolarHBondContact O-N 3.43Å; I205-G208 PolarHBondContact O-N 2.98Å; I205-I209 HydrophobicContact CG2-CD1 4Å; I205-I209 VanDerWaalsContact O-CG1 3.32Å; I205-I209 WeakPolarHBondContact O-CG1 3.2Å; I205-I209 PolarHBondContact O-N 2.79Å
206	V	97.8	Very high	96.6	Very high	80 Å²	80	51.4 Å²	51.4	49%	0.485	28%	0.279	S	S	.	.	H	α-helix	trans	-61.2	-44.8	176.9	176.3	0	0	0	0	110.6	I202 F203 G208 I209 L210	I202-V206 WeakPolarHBondContact O-CG2 3.38Å; I202-V206 PolarHBondContact O-N 3.27Å; I202-V206 VanDerWaalsContact O-N 3.08Å; F203-V206 PolarHBondContact O-N 3.17Å; V206-G208 PolarHBondContact O-N 2.97Å; V206-I209 PolarHBondContact O-N 3.47Å; V206-L210 HydrophobicContact CG1-CD1 4.48Å; V206-L210 WeakPolarHBondContact O-CG 3.4Å; V206-L210 PolarHBondContact O-N 3.06Å; V206-L210 VanDerWaalsContact O-N 3.09Å
207	Y	97.5	Very high	96.6	Very high	27 Å²	27	49.8 Å²	49.8	11%	0.106	27%	0.27	C	S	.	.	H	α-helix	trans	-59.5	-44.2	176.7	-165.6	-89.6	0	0	0	112.5	I159 M163 F203 C204 I205 L210 G211 L249 G252 N253	I159-Y207 HydrophobicContact CG2-CD1 3.72Å; I159-Y207 HydrophobicContact CG2-CE1 3.87Å; M163-Y207 HydrophobicContact CB-CD1 4.3Å; M163-Y207 HydrophobicContact CE-CD1 4.12Å; M163-Y207 HydrophobicContact CE-CD2 4.43Å; M163-Y207 HydrophobicContact CE-CE1 3.62Å; M163-Y207 HydrophobicContact CE-CE2 3.93Å; M163-Y207 HydrophobicContact CE-CG 4.5Å; M163-Y207 VanDerWaalsContact CE-CZ 3.49Å; M163-Y207 HydrophobicContact CG-CD1 4.31Å; F203-Y207 HydrophobicContact CZ-CD2 4.15Å; F203-Y207 WeakPolarHBondContact O-CB 3.06Å; F203-Y207 PolarHBondContact O-N 3Å; C204-Y207 PolarHBondContact O-N 3.47Å; I205-Y207 VanDerWaalsContact C-N 3.33Å; I205-Y207 PolarHBondContact O-N 3.43Å; Y207-L210 PolarHBondContact O-N 3.27Å; Y207-G211 PolarHBondContact O-N 3.47Å; Y207-L249 HydrophobicContact CD1-CD2 4.42Å; Y207-L249 HydrophobicContact CD2-CD2 4.06Å; Y207-L249 HydrophobicContact CE1-CD2 4.02Å; Y207-L249 HydrophobicContact CE2-CD2 3.65Å; Y207-L249 HydrophobicContact CG-CD2 4.43Å; Y207-L249 WeakPolarHBondContact OH-CA 3.27Å; Y207-L249 PolarHBondContact OH-O 3.07Å; Y207-G252 WeakPolarHBondContact OH-CA 3.37Å; Y207-N253 PolarHBondContact OH-N 3.17Å
208	G	97.7	Very high	96.4	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.2	-39.5	176.4	0	0	0	0	0	112.8	F156 C204 I205 V206 G211 A212	F156-G208 VanDerWaalsContact CD2-C 3.48Å; C204-G208 PolarHBondContact O-N 3.41Å; I205-G208 PolarHBondContact O-N 2.98Å; V206-G208 PolarHBondContact O-N 2.97Å; G208-G211 PolarHBondContact O-N 2.98Å; G208-A212 WeakPolarHBondContact O-CB 3.21Å; G208-A212 PolarHBondContact O-N 3.3Å
209	I	97.6	Very high	96.1	Very high	87 Å²	87	47.5 Å²	47.5	45%	0.446	26%	0.263	S	S	.	.	H	α-helix	trans	-61.9	-46.3	176.2	-69.6	164.8	0	0	0	109.9	F156 I205 V206 G211 A212 L213	F156-I209 HydrophobicContact CD2-CG1 4.06Å; F156-I209 HydrophobicContact CE2-CG1 3.81Å; I205-I209 HydrophobicContact CG2-CD1 4Å; I205-I209 VanDerWaalsContact O-CG1 3.32Å; I205-I209 WeakPolarHBondContact O-CG1 3.2Å; I205-I209 PolarHBondContact O-N 2.79Å; V206-I209 PolarHBondContact O-N 3.47Å; I209-G211 VanDerWaalsContact C-N 3.31Å; I209-G211 PolarHBondContact O-N 3.17Å; I209-A212 PolarHBondContact O-N 2.86Å; I209-L213 PolarHBondContact O-N 3.35Å
210	L	96.6	Very high	95.6	Very high	85 Å²	85	45.2 Å²	45.2	45%	0.445	25%	0.246	S	C	.	.	H	α-helix	trans	-60.2	-41.5	175.8	-66.5	173.5	0	0	0	111.7	V206 Y207 L213 L249	V206-L210 HydrophobicContact CG1-CD1 4.48Å; V206-L210 WeakPolarHBondContact O-CG 3.4Å; V206-L210 PolarHBondContact O-N 3.06Å; V206-L210 VanDerWaalsContact O-N 3.09Å; Y207-L210 PolarHBondContact O-N 3.27Å; L210-L213 HydrophobicContact CD2-CD1 4.49Å; L210-L213 WeakPolarHBondContact O-CB 3.23Å; L210-L213 PolarHBondContact O-N 3.21Å; L210-L249 HydrophobicContact CB-CD1 4.25Å; L210-L249 HydrophobicContact CB-CD2 4.25Å
211	G	96.3	Very high	94.7	Very high	2 Å²	2	51.2 Å²	51.2	2%	0.021	27%	0.271	C	S	.	.	H	α-helix	trans	-61.6	-40.5	174.3	0	0	0	0	0	114.1	Y207 G208 I209 L213 H214 H215	Y207-G211 PolarHBondContact O-N 3.47Å; G208-G211 PolarHBondContact O-N 2.98Å; I209-G211 VanDerWaalsContact C-N 3.31Å; I209-G211 PolarHBondContact O-N 3.17Å; G211-L213 PolarHBondContact O-N 2.91Å; G211-H214 WeakPolarHBondContact O-CB 3.18Å; G211-H214 PolarHBondContact O-N 2.95Å; G211-H214 VanDerWaalsContact O-N 3.08Å; G211-H215 PolarHBondContact O-ND1 3.03Å
212	A	96.7	Very high	93.8	Very high	11 Å²	11	57 Å²	57	9%	0.091	30%	0.298	C	S	.	.	H	α-helix	trans	-66.6	-25.3	179.6	0	0	0	0	0	113.2	F156 G208 I209 H214 H215	F156-A212 HydrophobicContact CB-CB 3.87Å; G208-A212 WeakPolarHBondContact O-CB 3.21Å; G208-A212 PolarHBondContact O-N 3.3Å; I209-A212 PolarHBondContact O-N 2.86Å; A212-H214 PolarHBondContact O-N 3.48Å; A212-H215 PolarHBondContact O-N 3.49Å
213	L	95.3	Very high	93.1	Very high	123 Å²	123	56.7 Å²	56.7	64%	0.644	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-21.9	173.9	-62.5	176.4	0	0	0	112.6	I209 L210 G211	I209-L213 PolarHBondContact O-N 3.35Å; L210-L213 HydrophobicContact CD2-CD1 4.49Å; L210-L213 WeakPolarHBondContact O-CB 3.23Å; L210-L213 PolarHBondContact O-N 3.21Å; G211-L213 PolarHBondContact O-N 2.91Å
214	H	95.1	Very high	92.4	Very high	22 Å²	22	55.5 Å²	55.5	10%	0.102	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	4.6	179.8	-76.2	-63.4	0	0	0	114.9	G211 A212 T232 E242 T245 Y246	G211-H214 WeakPolarHBondContact O-CB 3.18Å; G211-H214 PolarHBondContact O-N 2.95Å; G211-H214 VanDerWaalsContact O-N 3.08Å; A212-H214 PolarHBondContact O-N 3.48Å; H214-T232 VanDerWaalsContact CA-OG1 3.26Å; H214-T232 WeakPolarHBondContact CA-OG1 3.29Å; H214-T232 WeakPolarHBondContact CB-OG1 3.32Å; H214-T232 PolarHBondContact ND1-OG1 3.16Å; H214-T232 PolarHBondContact O-N 2.86Å; H214-T232 PolarHBondContact O-OG1 3.07Å; H214-E242 PolarHBondContact CE1-O 3.45Å; H214-E242 PolarHBondContact ND1-O 2.93Å; H214-T245 PolarHBondContact CE1-OG1 2.89Å; H214-T245 WeakPolarHBondContact NE2-CB 3.35Å; H214-T245 PolarHBondContact NE2-OG1 3.4Å; H214-Y246 HydrophobicContact CB-CD2 3.94Å
215	H	94.4	Very high	91.9	Very high	29 Å²	29	63.1 Å²	63.1	13%	0.134	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	133.4	177.6	-63.1	65.3	0	0	0	109.1	K152 A155 G211 A212 C230 D231	K152-H215 WeakPolarHBondContact CG-O 3.48Å; A155-H215 HydrophobicContact CB-CB 3.67Å; G211-H215 PolarHBondContact O-ND1 3.03Å; A212-H215 PolarHBondContact O-N 3.49Å; H215-C230 WeakPolarHBondContact CA-O 3.48Å; H215-D231 IonicContact CD2-OD1 3.78Å; H215-D231 PolarHBondContact CD2-OD1 3.24Å; H215-D231 IonicContact CE1-OD1 2.89Å; H215-D231 IonicContact CG-OD1 2.67Å; H215-D231 IonicContact NE2-OD1 3.81Å; H215-D231 PolarHBondContact NE2-OD1 2.95Å; H215-D231 IonicContact NE2-OD2 3.01Å
216	S	94.3	Very high	91.4	Very high	35 Å²	35	62 Å²	62	25%	0.245	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	160.1	177.6	58.3	0	0	0	0	111.9	D148 G218 C230 I235	D148-S216 WeakPolarHBondContact OD1-CA 3.29Å; D148-S216 WeakPolarHBondContact OD1-CB 3.4Å; S216-G218 PolarHBondContact O-N 3.08Å; S216-C230 PolarHBondContact N-O 2.71Å; S216-C230 VanDerWaalsContact N-O 3.12Å; S216-C230 PolarHBondContact O-N 2.79Å; S216-I235 WeakPolarHBondContact OG-CD1 3.34Å
217	L	94.3	Very high	91	Very high	26 Å²	26	63.6 Å²	63.6	14%	0.136	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	111.4	170	-174.1	64.5	0	0	0	109.7	P145 D148 Q227	P145-L217 HydrophobicContact CG-CD1 4.1Å; D148-L217 HydrophobicContact CB-CB 4.14Å; D148-L217 PolarHBondContact OD1-N 3.39Å; L217-Q227 HydrophobicContact CD1-CG 3.77Å; L217-Q227 HydrophobicContact CD2-CG 4.22Å; L217-Q227 HydrophobicContact CG-CG 3.61Å
218	G	91.4	Very high	90.8	Very high	13 Å²	13	64.1 Å²	64.1	13%	0.134	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	-174.1	-173.1	0	0	0	0	0	112.9	S216 Q227 Q228	S216-G218 PolarHBondContact O-N 3.08Å; G218-Q227 CarbonylContact O-C 3.59Å; G218-Q227 WeakPolarHBondContact O-CA 3.46Å; G218-Q228 PolarHBondContact N-O 2.91Å; G218-Q228 PolarHBondContact O-N 3.03Å; G218-Q228 VanDerWaalsContact O-O 3.05Å
219	V	89.8	Confident	90.6	Very high	54 Å²	54	65 Å²	65	33%	0.327	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	140.2	174.3	-63	0	0	0	0	109	P224	V219-P224 WeakPolarHBondContact CG1-O 3.23Å
220	T	85.5	Confident	90.4	Very high	17 Å²	17	60.9 Å²	60.9	10%	0.104	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-84.4	167.4	177.4	70.1	0	0	0	0	110.5	D222 E223 Q228 E234	T220-D222 VanDerWaalsContact C-N 3.26Å; T220-D222 PolarHBondContact O-N 3.38Å; T220-D222 PolarHBondContact OG1-N 3.48Å; T220-E223 PolarHBondContact OG1-N 3.36Å; T220-Q228 HydrophobicContact CG2-CG 4.35Å; T220-Q228 VanDerWaalsContact CG2-NE2 3.28Å; T220-E234 HydrophobicContact CG2-CB 4.43Å
221	K	78.4	Confident	90.2	Very high	154 Å²	154	58.7 Å²	58.7	67%	0.67	31%	0.312	S	S	*	.	S	Bend	trans	-67.3	-29	173.5	-66.9	177.9	-176	168.1	0	112.8
222	D	79.2	Confident	90	Very high	151 Å²	151	59 Å²	59	81%	0.807	31%	0.313	S	S	*	.	S	Bend	trans	-87.7	-29.8	-175	-60.7	-35.6	0	0	0	111.7	T220	T220-D222 VanDerWaalsContact C-N 3.26Å; T220-D222 PolarHBondContact O-N 3.38Å; T220-D222 PolarHBondContact OG1-N 3.48Å
223	E	82.8	Confident	89.6	Confident	89 Å²	89	61 Å²	61	42%	0.416	33%	0.325	S	S	.	.			trans	-129.4	75.5	-177.8	-64.1	177.9	165.1	0	0	110.6	T220 D225 I226	T220-E223 PolarHBondContact OG1-N 3.36Å; E223-D225 PolarHBondContact O-N 3.46Å; E223-I226 HydrophobicContact CB-CB 4.32Å; E223-I226 HydrophobicContact CB-CD1 4.4Å; E223-I226 PolarHBondContact O-N 3.13Å
224	P	83.7	Confident	89.2	Confident	82 Å²	82	59.2 Å²	59.2	53%	0.532	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-18.4	-176.5	27.9	-35.5	0	0	0	113.8	V219	V219-P224 WeakPolarHBondContact CG1-O 3.23Å
225	D	87.2	Confident	88.8	Confident	159 Å²	159	59.8 Å²	59.8	85%	0.85	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-7.1	-177.1	-62.8	-38.6	0	0	0	113.3	E223	E223-D225 PolarHBondContact O-N 3.46Å
226	I	87.2	Confident	88	Confident	57 Å²	57	61.3 Å²	61.3	29%	0.292	33%	0.331	S	S	.	.			trans	-115.8	120.2	-174.5	-58	177.7	0	0	0	109.6	Q144 E223	Q144-I226 VanDerWaalsContact CD-CG2 3.47Å; Q144-I226 HydrophobicContact CG-CG2 4.09Å; Q144-I226 VanDerWaalsContact NE2-CG2 3.35Å; E223-I226 HydrophobicContact CB-CB 4.32Å; E223-I226 HydrophobicContact CB-CD1 4.4Å; E223-I226 PolarHBondContact O-N 3.13Å
227	Q	90.5	Very high	87.5	Confident	112 Å²	112	67.5 Å²	67.5	52%	0.523	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	114.9	175.4	-164.1	-179	20.4	0	0	110.3	Q144 L217 G218	Q144-Q227 WeakPolarHBondContact CG-O 3.29Å; L217-Q227 HydrophobicContact CD1-CG 3.77Å; L217-Q227 HydrophobicContact CD2-CG 4.22Å; L217-Q227 HydrophobicContact CG-CG 3.61Å; G218-Q227 CarbonylContact O-C 3.59Å; G218-Q227 WeakPolarHBondContact O-CA 3.46Å
228	Q	92.7	Very high	87.2	Confident	38 Å²	38	68.2 Å²	68.2	18%	0.178	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	166	-177.5	68.2	-174.6	18.7	0	0	112	L143 Q144 G218 T220 C230	L143-Q228 CarbonylContact O-C 3.59Å; L143-Q228 WeakPolarHBondContact O-CA 3.32Å; L143-Q228 WeakPolarHBondContact O-CB 3.33Å; Q144-Q228 HydrophobicContact CG-CB 3.92Å; G218-Q228 PolarHBondContact N-O 2.91Å; G218-Q228 PolarHBondContact O-N 3.03Å; G218-Q228 VanDerWaalsContact O-O 3.05Å; T220-Q228 HydrophobicContact CG2-CG 4.35Å; T220-Q228 VanDerWaalsContact CG2-NE2 3.28Å; Q228-C230 PolarHBondContact O-N 3.49Å; Q228-C230 PolarHBondContact O-SG 2.89Å
229	C	94.4	Very high	87.3	Confident	19 Å²	19	71.6 Å²	71.6	13%	0.128	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	117.7	170.9	-62.5	0	0	0	0	109.4	M138 L143 P145 C151	M138-C229 WeakPolarHBondContact CE-SG 3.34Å; L143-C229 HydrophobicContact CD2-CB 4.4Å; L143-C229 PolarHBondContact O-N 3.09Å; P145-C229 VanDerWaalsContact CD-SG 3.55Å; P145-C229 VanDerWaalsContact CG-SG 3.55Å; C151-C229 WeakPolarHBondContact CA-SG 3.27Å; C151-C229 HydrophobicContact CB-CB 3.79Å; C151-C229 WeakPolarHBondContact CB-SG 3.21Å; C151-C229 WeakPolarHBondContact SG-CA 3.47Å; C151-C229 WeakPolarHBondContact SG-CB 3.28Å; C151-C229 CovalentContact SG-SG 2.04Å; C151-C229 PolarHBondContact SG-SG 3.39Å
230	C	93	Very high	87.4	Confident	0 Å²	0	77.5 Å²	77.5	0%	0	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	145.6	-178.9	-58.9	0	0	0	0	110.1	H215 S216 Q228 E234 I235	H215-C230 WeakPolarHBondContact CA-O 3.48Å; S216-C230 PolarHBondContact N-O 2.71Å; S216-C230 VanDerWaalsContact N-O 3.12Å; S216-C230 PolarHBondContact O-N 2.79Å; Q228-C230 PolarHBondContact O-N 3.49Å; Q228-C230 PolarHBondContact O-SG 2.89Å; C230-E234 WeakPolarHBondContact CA-OE2 3.41Å; C230-E234 HydrophobicContact CB-CB 4.21Å; C230-I235 HydrophobicContact CB-CD1 4.29Å; C230-I235 HydrophobicContact CB-CG1 3.78Å
231	D	92.5	Very high	87.8	Confident	39 Å²	39	81.9 Å²	81.9	21%	0.209	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	154.5	166.2	-71.9	7.6	0	0	0	109.7	H215 P233 E234 Y246	H215-D231 IonicContact CD2-OD1 3.78Å; H215-D231 PolarHBondContact CD2-OD1 3.24Å; H215-D231 IonicContact CE1-OD1 2.89Å; H215-D231 IonicContact CG-OD1 2.67Å; H215-D231 IonicContact NE2-OD1 3.81Å; H215-D231 PolarHBondContact NE2-OD1 2.95Å; H215-D231 IonicContact NE2-OD2 3.01Å; D231-P233 VanDerWaalsContact C-N 3.31Å; D231-P233 VanDerWaalsContact O-N 3.08Å; D231-E234 PolarHBondContact N-OE2 3.44Å; D231-E234 WeakPolarHBondContact O-CB 3.41Å; D231-E234 PolarHBondContact O-N 3.21Å; D231-Y246 HydrophobicContact CB-CE2 3.75Å; D231-Y246 WeakPolarHBondContact OD2-CE2 3.45Å; D231-Y246 PolarHBondContact OD2-OH 3.36Å
232	T	92.2	Very high	88.5	Confident	8 Å²	8	78.4 Å²	78.4	5%	0.049	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-45	-44.2	-178.9	-61.4	0	0	0	0	114.6	H214 E234 I235 V238 E242 I243	H214-T232 VanDerWaalsContact CA-OG1 3.26Å; H214-T232 WeakPolarHBondContact CA-OG1 3.29Å; H214-T232 WeakPolarHBondContact CB-OG1 3.32Å; H214-T232 PolarHBondContact ND1-OG1 3.16Å; H214-T232 PolarHBondContact O-N 2.86Å; H214-T232 PolarHBondContact O-OG1 3.07Å; T232-E234 PolarHBondContact O-N 2.87Å; T232-I235 PolarHBondContact O-N 3.39Å; T232-V238 HydrophobicContact CG2-CB 4.24Å; T232-V238 HydrophobicContact CG2-CG1 4.12Å; T232-V238 WeakPolarHBondContact O-CG1 3.35Å; T232-E242 HydrophobicContact CG2-CB 3.6Å; T232-I243 HydrophobicContact CG2-CG1 4.41Å
233	P	88.1	Confident	89.1	Confident	54 Å²	54	74.4 Å²	74.4	35%	0.351	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-66.6	-18.3	-179.2	-21	34.8	0	0	0	115.3	D231 Y246	D231-P233 VanDerWaalsContact C-N 3.31Å; D231-P233 VanDerWaalsContact O-N 3.08Å; P233-Y246 HydrophobicContact CG-CD1 3.46Å; P233-Y246 VanDerWaalsContact CG-CD1 3.46Å; P233-Y246 HydrophobicContact CG-CE1 3.48Å; P233-Y246 VanDerWaalsContact CG-CE1 3.48Å; P233-Y246 HydrophobicContact CG-CG 4.13Å
234	E	86.8	Confident	89.7	Confident	86 Å²	86	73.3 Å²	73.3	40%	0.402	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-85.8	-22.3	-177	-62.2	176.3	165.2	0	0	112.4	T220 C230 D231 T232	T220-E234 HydrophobicContact CG2-CB 4.43Å; C230-E234 WeakPolarHBondContact CA-OE2 3.41Å; C230-E234 HydrophobicContact CB-CB 4.21Å; D231-E234 PolarHBondContact N-OE2 3.44Å; D231-E234 WeakPolarHBondContact O-CB 3.41Å; D231-E234 PolarHBondContact O-N 3.21Å; T232-E234 PolarHBondContact O-N 2.87Å
235	I	87.3	Confident	90.2	Very high	34 Å²	34	71.8 Å²	71.8	17%	0.174	37%	0.374	C	S	.	.	B	Isolated β-bridge	trans	-78.6	143	-176	-56.9	169.9	0	0	0	110.3	S216 C230 T232 V238	S216-I235 WeakPolarHBondContact OG-CD1 3.34Å; C230-I235 HydrophobicContact CB-CD1 4.29Å; C230-I235 HydrophobicContact CB-CG1 3.78Å; T232-I235 PolarHBondContact O-N 3.39Å; I235-V238 HydrophobicContact CB-CG1 3.8Å; I235-V238 HydrophobicContact CG2-CG1 4.05Å
236	S	77.8	Confident	90.6	Very high	60 Å²	60	66.1 Å²	66.1	42%	0.42	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	146.7	171.9	58.3	0	0	0	0	111.5	V238	S236-V238 PolarHBondContact O-N 3.42Å
237	N	83	Confident	90.9	Very high	166 Å²	166	66.2 Å²	66.2	89%	0.888	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	33.9	176.5	-53.7	-37.8	0	0	0	116.8
238	V	87.9	Confident	91.2	Very high	41 Å²	41	65.7 Å²	65.7	25%	0.248	34%	0.342	C	S	.	.			trans	-82.1	149.7	173.1	-66.6	0	0	0	0	113.2	T232 I235 S236 I243	T232-V238 HydrophobicContact CG2-CB 4.24Å; T232-V238 HydrophobicContact CG2-CG1 4.12Å; T232-V238 WeakPolarHBondContact O-CG1 3.35Å; I235-V238 HydrophobicContact CB-CG1 3.8Å; I235-V238 HydrophobicContact CG2-CG1 4.05Å; S236-V238 PolarHBondContact O-N 3.42Å; V238-I243 HydrophobicContact CG2-CD1 3.77Å; V238-I243 HydrophobicContact CG2-CG1 3.85Å
239	T	93.1	Very high	91.3	Very high	83 Å²	83	65 Å²	65	51%	0.509	34%	0.34	S	S	.	.			trans	-78.4	145.8	178.2	-51.6	0	0	0	0	110.4	L241 E242 I243	T239-L241 HydrophobicContact CG2-CB 4.08Å; T239-L241 PolarHBondContact O-N 3.26Å; T239-L241 VanDerWaalsContact O-N 3.14Å; T239-E242 WeakPolarHBondContact CB-OE2 3.47Å; T239-E242 PolarHBondContact N-OE2 3.12Å; T239-E242 WeakPolarHBondContact O-CB 3.4Å; T239-E242 PolarHBondContact O-N 3.19Å; T239-E242 PolarHBondContact OG1-OE2 3.07Å; T239-I243 PolarHBondContact O-N 3.48Å
240	Y	92.5	Very high	91.2	Very high	178 Å²	178	66.8 Å²	66.8	70%	0.698	35%	0.346	S	S	*	.	H	α-helix	trans	-52.8	-37.2	173.9	178.1	-100	0	0	0	112.8	E242 I243 L244	Y240-E242 VanDerWaalsContact C-N 3.31Å; Y240-E242 PolarHBondContact O-N 3.14Å; Y240-I243 PolarHBondContact O-N 3.16Å; Y240-L244 HydrophobicContact CE1-CD2 4.31Å; Y240-L244 WeakPolarHBondContact O-CB 3.28Å; Y240-L244 PolarHBondContact O-N 2.93Å
241	L	93.7	Very high	91.2	Very high	109 Å²	109	72.4 Å²	72.4	57%	0.571	37%	0.371	S	S	*	.	H	α-helix	trans	-59.8	-40.2	176.7	-175.5	62.7	0	0	0	112.1	T239 L244 T245	T239-L241 HydrophobicContact CG2-CB 4.08Å; T239-L241 PolarHBondContact O-N 3.26Å; T239-L241 VanDerWaalsContact O-N 3.14Å; L241-L244 PolarHBondContact O-N 3.5Å; L241-T245 HydrophobicContact CD1-CG2 4.46Å; L241-T245 WeakPolarHBondContact O-CG2 3.49Å; L241-T245 PolarHBondContact O-N 2.91Å; L241-T245 PolarHBondContact O-OG1 2.89Å; L241-T245 VanDerWaalsContact O-OG1 3.06Å
242	E	93.1	Very high	91.4	Very high	82 Å²	82	71.7 Å²	71.7	38%	0.383	37%	0.372	S	S	.	.	H	α-helix	trans	-70.2	-40.1	-179	-61	172	126.7	0	0	111.4	H214 T232 T239 Y240 L244 T245 Y246	H214-E242 PolarHBondContact CE1-O 3.45Å; H214-E242 PolarHBondContact ND1-O 2.93Å; T232-E242 HydrophobicContact CG2-CB 3.6Å; T239-E242 WeakPolarHBondContact CB-OE2 3.47Å; T239-E242 PolarHBondContact N-OE2 3.12Å; T239-E242 WeakPolarHBondContact O-CB 3.4Å; T239-E242 PolarHBondContact O-N 3.19Å; T239-E242 PolarHBondContact OG1-OE2 3.07Å; Y240-E242 VanDerWaalsContact C-N 3.31Å; Y240-E242 PolarHBondContact O-N 3.14Å; E242-L244 VanDerWaalsContact C-N 3.33Å; E242-T245 PolarHBondContact O-N 3.23Å; E242-T245 PolarHBondContact O-OG1 3.44Å; E242-T245 VanDerWaalsContact O-OG1 3.08Å; E242-Y246 WeakPolarHBondContact O-CB 3.36Å; E242-Y246 PolarHBondContact O-N 3.38Å
243	I	92.6	Very high	91.5	Very high	67 Å²	67	71.9 Å²	71.9	34%	0.344	37%	0.373	S	S	.	.	H	α-helix	trans	-63	-43.6	173.8	-63.7	172.5	0	0	0	110.2	T232 V238 T239 Y240 Y246 D247	T232-I243 HydrophobicContact CG2-CG1 4.41Å; V238-I243 HydrophobicContact CG2-CD1 3.77Å; V238-I243 HydrophobicContact CG2-CG1 3.85Å; T239-I243 PolarHBondContact O-N 3.48Å; Y240-I243 PolarHBondContact O-N 3.16Å; I243-Y246 PolarHBondContact O-N 3.01Å; I243-D247 WeakPolarHBondContact O-CB 3.46Å; I243-D247 PolarHBondContact O-N 3.43Å
244	L	94.8	Very high	91.8	Very high	65 Å²	65	70.2 Å²	70.2	34%	0.34	36%	0.362	S	S	.	.	H	α-helix	trans	-62.6	-45.3	179.5	179.4	64.4	0	0	0	111.6	Y240 L241 E242 D247 I248	Y240-L244 HydrophobicContact CE1-CD2 4.31Å; Y240-L244 WeakPolarHBondContact O-CB 3.28Å; Y240-L244 PolarHBondContact O-N 2.93Å; L241-L244 PolarHBondContact O-N 3.5Å; E242-L244 VanDerWaalsContact C-N 3.33Å; L244-D247 PolarHBondContact O-N 3.32Å; L244-I248 HydrophobicContact CD1-CD1 4.32Å; L244-I248 HydrophobicContact CG-CD1 4.07Å; L244-I248 VanDerWaalsContact O-CG1 3.27Å; L244-I248 WeakPolarHBondContact O-CG1 3.11Å; L244-I248 PolarHBondContact O-N 3.5Å
245	T	94.6	Very high	92.2	Very high	50 Å²	50	68.8 Å²	68.8	31%	0.307	37%	0.365	S	S	.	.	H	α-helix	trans	-68.7	-37.2	179.2	50.8	0	0	0	0	112	H214 L241 E242 I248 L249	H214-T245 PolarHBondContact CE1-OG1 2.89Å; H214-T245 WeakPolarHBondContact NE2-CB 3.35Å; H214-T245 PolarHBondContact NE2-OG1 3.4Å; L241-T245 HydrophobicContact CD1-CG2 4.46Å; L241-T245 WeakPolarHBondContact O-CG2 3.49Å; L241-T245 PolarHBondContact O-N 2.91Å; L241-T245 PolarHBondContact O-OG1 2.89Å; L241-T245 VanDerWaalsContact O-OG1 3.06Å; E242-T245 PolarHBondContact O-N 3.23Å; E242-T245 PolarHBondContact O-OG1 3.44Å; E242-T245 VanDerWaalsContact O-OG1 3.08Å; T245-I248 PolarHBondContact O-N 3.22Å; T245-L249 WeakPolarHBondContact O-CG 3.45Å; T245-L249 PolarHBondContact O-N 3.35Å; T245-L249 VanDerWaalsContact O-N 3.09Å
246	Y	94.6	Very high	92.7	Very high	41 Å²	41	67.6 Å²	67.6	16%	0.161	36%	0.36	C	S	.	.	H	α-helix	trans	-58.3	-48.9	170.1	171.3	-92.7	0	0	0	111.7	H214 D231 P233 E242 I243 I248 L249 Q250	H214-Y246 HydrophobicContact CB-CD2 3.94Å; D231-Y246 HydrophobicContact CB-CE2 3.75Å; D231-Y246 WeakPolarHBondContact OD2-CE2 3.45Å; D231-Y246 PolarHBondContact OD2-OH 3.36Å; P233-Y246 HydrophobicContact CG-CD1 3.46Å; P233-Y246 VanDerWaalsContact CG-CD1 3.46Å; P233-Y246 HydrophobicContact CG-CE1 3.48Å; P233-Y246 VanDerWaalsContact CG-CE1 3.48Å; P233-Y246 HydrophobicContact CG-CG 4.13Å; E242-Y246 WeakPolarHBondContact O-CB 3.36Å; E242-Y246 PolarHBondContact O-N 3.38Å; I243-Y246 PolarHBondContact O-N 3.01Å; Y246-I248 VanDerWaalsContact C-N 3.34Å; Y246-I248 PolarHBondContact O-N 3.05Å; Y246-L249 PolarHBondContact O-N 3.23Å; Y246-L249 VanDerWaalsContact O-N 3.15Å; Y246-Q250 HydrophobicContact CE1-CB 4.49Å; Y246-Q250 WeakPolarHBondContact O-CB 3.5Å; Y246-Q250 PolarHBondContact O-N 3Å
247	D	94.2	Very high	93.5	Very high	58 Å²	58	64.8 Å²	64.8	31%	0.31	34%	0.34	S	S	.	.	H	α-helix	trans	-62.7	-39.8	-179.5	-178.7	62.5	0	0	0	112	I243 L244 L249 Q250 K251	I243-D247 WeakPolarHBondContact O-CB 3.46Å; I243-D247 PolarHBondContact O-N 3.43Å; L244-D247 PolarHBondContact O-N 3.32Å; D247-L249 PolarHBondContact O-N 3.4Å; D247-Q250 PolarHBondContact O-N 3.48Å; D247-K251 VanDerWaalsContact CG-NZ 3.33Å; D247-K251 VanDerWaalsContact O-CB 3.25Å; D247-K251 WeakPolarHBondContact O-CB 3.34Å; D247-K251 VanDerWaalsContact O-CG 3.31Å; D247-K251 WeakPolarHBondContact O-CG 3.32Å; D247-K251 PolarHBondContact O-N 2.98Å; D247-K251 WeakPolarHBondContact OD1-CE 3.49Å; D247-K251 IonicContact OD1-NZ 2.85Å; D247-K251 PolarHBondContact OD1-NZ 2.76Å; D247-K251 WeakPolarHBondContact OD2-CD 3.49Å; D247-K251 VanDerWaalsContact OD2-CE 3.29Å; D247-K251 WeakPolarHBondContact OD2-CE 3.23Å; D247-K251 IonicContact OD2-NZ 3.54Å; D247-K251 PolarHBondContact OD2-NZ 3.42Å
248	I	95.7	Very high	94.1	Very high	102 Å²	102	60.7 Å²	60.7	52%	0.523	32%	0.317	S	S	.	.	H	α-helix	trans	-59.6	-45.5	173.7	-70.3	165.6	0	0	0	110.9	L244 T245 Y246 G252	L244-I248 HydrophobicContact CD1-CD1 4.32Å; L244-I248 HydrophobicContact CG-CD1 4.07Å; L244-I248 VanDerWaalsContact O-CG1 3.27Å; L244-I248 WeakPolarHBondContact O-CG1 3.11Å; L244-I248 PolarHBondContact O-N 3.5Å; T245-I248 PolarHBondContact O-N 3.22Å; Y246-I248 VanDerWaalsContact C-N 3.34Å; Y246-I248 PolarHBondContact O-N 3.05Å; I248-G252 PolarHBondContact O-N 3.06Å
249	L	95	Very high	94.5	Very high	22 Å²	22	63.1 Å²	63.1	12%	0.115	33%	0.328	C	S	.	.	H	α-helix	trans	-68.5	-39.9	-179.8	-70.6	164.5	0	0	0	112.1	Y207 L210 T245 Y246 D247 G252 N253	Y207-L249 HydrophobicContact CD1-CD2 4.42Å; Y207-L249 HydrophobicContact CD2-CD2 4.06Å; Y207-L249 HydrophobicContact CE1-CD2 4.02Å; Y207-L249 HydrophobicContact CE2-CD2 3.65Å; Y207-L249 HydrophobicContact CG-CD2 4.43Å; Y207-L249 WeakPolarHBondContact OH-CA 3.27Å; Y207-L249 PolarHBondContact OH-O 3.07Å; L210-L249 HydrophobicContact CB-CD1 4.25Å; L210-L249 HydrophobicContact CB-CD2 4.25Å; T245-L249 WeakPolarHBondContact O-CG 3.45Å; T245-L249 PolarHBondContact O-N 3.35Å; T245-L249 VanDerWaalsContact O-N 3.09Å; Y246-L249 PolarHBondContact O-N 3.23Å; Y246-L249 VanDerWaalsContact O-N 3.15Å; D247-L249 PolarHBondContact O-N 3.4Å; L249-G252 PolarHBondContact O-N 2.65Å; L249-N253 PolarHBondContact O-N 3.01Å; L249-N253 VanDerWaalsContact O-N 3.17Å
250	Q	92.6	Very high	94.7	Very high	58 Å²	58	59.1 Å²	59.1	27%	0.271	30%	0.304	S	S	.	.	H	α-helix	trans	-68.7	-43.9	178.2	-176.4	64.3	-6.5	0	0	111.8	Y246 D247 G252 N253 T254	Y246-Q250 HydrophobicContact CE1-CB 4.49Å; Y246-Q250 WeakPolarHBondContact O-CB 3.5Å; Y246-Q250 PolarHBondContact O-N 3Å; D247-Q250 PolarHBondContact O-N 3.48Å; Q250-G252 VanDerWaalsContact C-N 3.29Å; Q250-G252 PolarHBondContact O-N 3.05Å; Q250-N253 PolarHBondContact O-N 3.31Å; Q250-T254 PolarHBondContact O-N 3.12Å; Q250-T254 VanDerWaalsContact O-N 3.09Å; Q250-T254 PolarHBondContact O-OG1 3.19Å
251	K	94.2	Very high	94.8	Very high	118 Å²	118	52.5 Å²	52.5	51%	0.513	28%	0.28	S	S	.	.	H	α-helix	trans	-66.2	-31.8	174	-73.9	175	176.3	162.5	0	112	D247 T254 A255	D247-K251 VanDerWaalsContact CG-NZ 3.33Å; D247-K251 VanDerWaalsContact O-CB 3.25Å; D247-K251 WeakPolarHBondContact O-CB 3.34Å; D247-K251 VanDerWaalsContact O-CG 3.31Å; D247-K251 WeakPolarHBondContact O-CG 3.32Å; D247-K251 PolarHBondContact O-N 2.98Å; D247-K251 WeakPolarHBondContact OD1-CE 3.49Å; D247-K251 IonicContact OD1-NZ 2.85Å; D247-K251 PolarHBondContact OD1-NZ 2.76Å; D247-K251 WeakPolarHBondContact OD2-CD 3.49Å; D247-K251 VanDerWaalsContact OD2-CE 3.29Å; D247-K251 WeakPolarHBondContact OD2-CE 3.23Å; D247-K251 IonicContact OD2-NZ 3.54Å; D247-K251 PolarHBondContact OD2-NZ 3.42Å; K251-T254 PolarHBondContact O-N 2.67Å; K251-A255 VanDerWaalsContact O-CB 3.23Å; K251-A255 WeakPolarHBondContact O-CB 3.49Å; K251-A255 PolarHBondContact O-N 3.21Å
252	G	95.6	Very high	95	Very high	23 Å²	23	51.6 Å²	51.6	24%	0.237	28%	0.275	C	S	.	.	H	α-helix	trans	-62.3	-44.4	173.6	0	0	0	0	0	112.9	Y207 I248 L249 Q250 A255 S256	Y207-G252 WeakPolarHBondContact OH-CA 3.37Å; I248-G252 PolarHBondContact O-N 3.06Å; L249-G252 PolarHBondContact O-N 2.65Å; Q250-G252 VanDerWaalsContact C-N 3.29Å; Q250-G252 PolarHBondContact O-N 3.05Å; G252-A255 PolarHBondContact O-N 3.11Å; G252-S256 WeakPolarHBondContact O-CB 3.44Å; G252-S256 PolarHBondContact O-N 3.39Å
253	N	94.2	Very high	95.2	Very high	13 Å²	13	48.7 Å²	48.7	7%	0.07	26%	0.264	C	S	.	.	H	α-helix	trans	-63.2	-42.2	173.1	-80.9	-26.9	0	0	0	112	I162 M163 Y207 L249 Q250 S256 F257	I162-N253 HydrophobicContact CG2-CB 4.19Å; M163-N253 WeakPolarHBondContact CE-OD1 3.32Å; Y207-N253 PolarHBondContact OH-N 3.17Å; L249-N253 PolarHBondContact O-N 3.01Å; L249-N253 VanDerWaalsContact O-N 3.17Å; Q250-N253 PolarHBondContact O-N 3.31Å; N253-S256 PolarHBondContact O-N 3.32Å; N253-S256 PolarHBondContact O-OG 3.32Å; N253-F257 PolarHBondContact O-N 3.32Å; N253-F257 VanDerWaalsContact O-N 3.13Å
254	T	94.8	Very high	95.3	Very high	19 Å²	19	45.6 Å²	45.6	12%	0.117	25%	0.248	C	C	.	.	H	α-helix	trans	-62.2	-45.6	176.2	-66.3	0	0	0	0	111	Q250 K251 F257 I258 L398 N402	Q250-T254 PolarHBondContact O-N 3.12Å; Q250-T254 VanDerWaalsContact O-N 3.09Å; Q250-T254 PolarHBondContact O-OG1 3.19Å; K251-T254 PolarHBondContact O-N 2.67Å; T254-F257 PolarHBondContact O-N 3.15Å; T254-I258 HydrophobicContact CG2-CD1 3.97Å; T254-I258 WeakPolarHBondContact O-CG1 3.37Å; T254-I258 PolarHBondContact O-N 3.09Å; T254-L398 HydrophobicContact CG2-CD1 3.98Å; T254-N402 PolarHBondContact OG1-ND2 2.67Å
255	A	96.2	Very high	95.4	Very high	56 Å²	56	47.2 Å²	47.2	46%	0.463	26%	0.256	S	S	.	.	H	α-helix	trans	-65.3	-40.1	179.1	0	0	0	0	0	112.2	K251 G252 F257 I258 L259	K251-A255 VanDerWaalsContact O-CB 3.23Å; K251-A255 WeakPolarHBondContact O-CB 3.49Å; K251-A255 PolarHBondContact O-N 3.21Å; G252-A255 PolarHBondContact O-N 3.11Å; A255-F257 VanDerWaalsContact C-N 3.33Å; A255-F257 PolarHBondContact O-N 3.04Å; A255-I258 PolarHBondContact O-N 3.29Å; A255-L259 VanDerWaalsContact O-CB 3.25Å; A255-L259 WeakPolarHBondContact O-CB 3.45Å; A255-L259 PolarHBondContact O-N 3.48Å
256	S	96	Very high	95.5	Very high	9 Å²	9	49.5 Å²	49.5	6%	0.063	27%	0.265	C	S	.	.	H	α-helix	trans	-65.1	-37.9	177.8	75.8	0	0	0	0	111.7	M163 S166 G252 N253 L259 S260	M163-S256 VanDerWaalsContact SD-CB 3.59Å; S166-S256 VanDerWaalsContact OG-CB 3.28Å; S166-S256 WeakPolarHBondContact OG-CB 3.47Å; S166-S256 PolarHBondContact OG-OG 2.98Å; G252-S256 WeakPolarHBondContact O-CB 3.44Å; G252-S256 PolarHBondContact O-N 3.39Å; N253-S256 PolarHBondContact O-N 3.32Å; N253-S256 PolarHBondContact O-OG 3.32Å; S256-L259 PolarHBondContact O-N 3.11Å; S256-S260 WeakPolarHBondContact O-CB 3.32Å; S256-S260 PolarHBondContact O-N 3.42Å
257	F	94.9	Very high	95.5	Very high	1 Å²	1	48.3 Å²	48.3	0%	0.004	26%	0.262	C	S	.	.	H	α-helix	trans	-65.8	-47.4	174	-174.8	-108.4	0	0	0	112.2	N253 T254 A255 L259 S260 I261 Y390 F394 L398	N253-F257 PolarHBondContact O-N 3.32Å; N253-F257 VanDerWaalsContact O-N 3.13Å; T254-F257 PolarHBondContact O-N 3.15Å; A255-F257 VanDerWaalsContact C-N 3.33Å; A255-F257 PolarHBondContact O-N 3.04Å; F257-L259 VanDerWaalsContact C-N 3.31Å; F257-L259 PolarHBondContact O-N 3.26Å; F257-S260 WeakPolarHBondContact O-CB 3.43Å; F257-S260 PolarHBondContact O-N 3.15Å; F257-S260 VanDerWaalsContact O-N 3.07Å; F257-S260 PolarHBondContact O-OG 2.95Å; F257-I261 HydrophobicContact CD1-CD1 3.8Å; F257-I261 HydrophobicContact CE1-CD1 3.35Å; F257-I261 HydrophobicContact CE1-CG1 4.23Å; F257-I261 HydrophobicContact CZ-CD1 3.79Å; F257-I261 HydrophobicContact CZ-CG1 4.26Å; F257-I261 PolarHBondContact O-N 3.03Å; F257-Y390 AromaticContact CD2-CE1 3.7Å; F257-Y390 HydrophobicContact CD2-CE1 3.7Å; F257-Y390 AromaticContact CD2-CZ 3.78Å; F257-Y390 WeakPolarHBondContact CD2-OH 2.97Å; F257-Y390 HydrophobicContact CE2-CD1 4.15Å; F257-Y390 AromaticContact CE2-CE1 3.51Å; F257-Y390 HydrophobicContact CE2-CE1 3.51Å; F257-Y390 AromaticContact CE2-CZ 3.81Å; F257-F394 HydrophobicContact CD1-CD1 4.23Å; F257-F394 HydrophobicContact CD2-CB 4.3Å; F257-F394 AromaticContact CD2-CD1 3.43Å; F257-F394 HydrophobicContact CD2-CD1 3.43Å; F257-F394 VanDerWaalsContact CD2-CD1 3.43Å; F257-F394 AromaticContact CD2-CE1 3.98Å; F257-F394 HydrophobicContact CD2-CE1 3.98Å; F257-F394 AromaticContact CD2-CG 3.91Å; F257-F394 HydrophobicContact CD2-CG 3.91Å; F257-F394 HydrophobicContact CE1-CD1 4.16Å; F257-F394 HydrophobicContact CE2-CB 3.43Å; F257-F394 VanDerWaalsContact CE2-CB 3.43Å; F257-F394 AromaticContact CE2-CD1 3.4Å; F257-F394 HydrophobicContact CE2-CD1 3.4Å; F257-F394 VanDerWaalsContact CE2-CD1 3.4Å; F257-F394 HydrophobicContact CE2-CE1 4.38Å; F257-F394 AromaticContact CE2-CG 3.53Å; F257-F394 HydrophobicContact CE2-CG 3.53Å; F257-F394 AromaticContact CG-CD1 3.86Å; F257-F394 HydrophobicContact CG-CD1 3.86Å; F257-F394 HydrophobicContact CG-CE1 4.19Å; F257-F394 HydrophobicContact CZ-CB 3.65Å; F257-F394 AromaticContact CZ-CD1 3.77Å; F257-F394 HydrophobicContact CZ-CD1 3.77Å; F257-F394 HydrophobicContact CZ-CG 4.05Å; F257-L398 HydrophobicContact CB-CD1 4.23Å; F257-L398 HydrophobicContact CD1-CB 4.11Å; F257-L398 HydrophobicContact CD1-CD1 3.63Å; F257-L398 HydrophobicContact CD1-CD2 3.57Å; F257-L398 HydrophobicContact CD1-CG 3.94Å; F257-L398 HydrophobicContact CE1-CB 4.1Å; F257-L398 HydrophobicContact CE1-CD1 4.43Å; F257-L398 HydrophobicContact CE1-CD2 3.72Å; F257-L398 HydrophobicContact CE1-CG 4.27Å; F257-L398 HydrophobicContact CG-CD1 4.26Å
258	I	95.8	Very high	95.5	Very high	80 Å²	80	46.1 Å²	46.1	41%	0.41	25%	0.249	S	C	.	.	H	α-helix	trans	-59.4	-44.5	175.8	-67.2	168.3	0	0	0	110.6	T254 A255 S260 I261 L262	T254-I258 HydrophobicContact CG2-CD1 3.97Å; T254-I258 WeakPolarHBondContact O-CG1 3.37Å; T254-I258 PolarHBondContact O-N 3.09Å; A255-I258 PolarHBondContact O-N 3.29Å; I258-S260 VanDerWaalsContact C-N 3.25Å; I258-S260 PolarHBondContact O-N 3.42Å; I258-I261 PolarHBondContact O-N 2.91Å; I258-L262 HydrophobicContact CG2-CD1 4.02Å; I258-L262 HydrophobicContact CG2-CG 4.37Å; I258-L262 WeakPolarHBondContact O-CG 3.27Å; I258-L262 PolarHBondContact O-N 3.44Å
259	L	96.6	Very high	95.4	Very high	91 Å²	91	44.3 Å²	44.3	48%	0.476	25%	0.246	S	C	.	.	H	α-helix	trans	-60.1	-37.3	176.1	-178	63.8	0	0	0	111.6	I170 A255 S256 F257 S263	I170-L259 HydrophobicContact CD1-CB 4.31Å; I170-L259 HydrophobicContact CD1-CD2 3.96Å; I170-L259 HydrophobicContact CD1-CG 3.84Å; A255-L259 VanDerWaalsContact O-CB 3.25Å; A255-L259 WeakPolarHBondContact O-CB 3.45Å; A255-L259 PolarHBondContact O-N 3.48Å; S256-L259 PolarHBondContact O-N 3.11Å; F257-L259 VanDerWaalsContact C-N 3.31Å; F257-L259 PolarHBondContact O-N 3.26Å; L259-S263 WeakPolarHBondContact O-CB 3.38Å; L259-S263 PolarHBondContact O-N 3.19Å; L259-S263 PolarHBondContact O-OG 2.87Å
260	S	96.7	Very high	95.4	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64.7	-44	176.5	81.8	0	0	0	0	112.1	S256 F257 I258 S263 V264	S256-S260 WeakPolarHBondContact O-CB 3.32Å; S256-S260 PolarHBondContact O-N 3.42Å; F257-S260 WeakPolarHBondContact O-CB 3.43Å; F257-S260 PolarHBondContact O-N 3.15Å; F257-S260 VanDerWaalsContact O-N 3.07Å; F257-S260 PolarHBondContact O-OG 2.95Å; I258-S260 VanDerWaalsContact C-N 3.25Å; I258-S260 PolarHBondContact O-N 3.42Å; S260-S263 PolarHBondContact O-N 3.13Å; S260-V264 WeakPolarHBondContact O-CB 3.35Å; S260-V264 WeakPolarHBondContact O-CG2 3.48Å; S260-V264 PolarHBondContact O-N 3.38Å
261	I	96.1	Very high	95.4	Very high	38 Å²	38	43.8 Å²	43.8	20%	0.195	24%	0.244	C	C	.	.	H	α-helix	trans	-60.4	-52.5	175.8	-68.7	165.6	0	0	0	110.1	F257 I258 S263 V264 I265 I391	F257-I261 HydrophobicContact CD1-CD1 3.8Å; F257-I261 HydrophobicContact CE1-CD1 3.35Å; F257-I261 HydrophobicContact CE1-CG1 4.23Å; F257-I261 HydrophobicContact CZ-CD1 3.79Å; F257-I261 HydrophobicContact CZ-CG1 4.26Å; F257-I261 PolarHBondContact O-N 3.03Å; I258-I261 PolarHBondContact O-N 2.91Å; I261-S263 VanDerWaalsContact C-N 3.33Å; I261-S263 PolarHBondContact O-N 3.49Å; I261-V264 PolarHBondContact O-N 2.79Å; I261-I265 HydrophobicContact CG2-CD1 3.65Å; I261-I265 HydrophobicContact CG2-CG1 4.41Å; I261-I265 WeakPolarHBondContact O-CG1 3.29Å; I261-I265 PolarHBondContact O-N 3.15Å; I261-I391 HydrophobicContact CD1-CG2 4.27Å; I261-I391 HydrophobicContact CG1-CD1 4.08Å; I261-I391 HydrophobicContact CG1-CG1 3.88Å; I261-I391 HydrophobicContact CG1-CG2 4.04Å
262	L	96.8	Very high	95.3	Very high	90 Å²	90	43 Å²	43	47%	0.471	25%	0.245	S	C	.	.	H	α-helix	trans	-60.2	-44	-179.2	-66.9	176.7	0	0	0	111.4	I258 I265 I266	I258-L262 HydrophobicContact CG2-CD1 4.02Å; I258-L262 HydrophobicContact CG2-CG 4.37Å; I258-L262 WeakPolarHBondContact O-CG 3.27Å; I258-L262 PolarHBondContact O-N 3.44Å; L262-I265 PolarHBondContact O-N 3.34Å; L262-I266 WeakPolarHBondContact O-CB 3.4Å; L262-I266 WeakPolarHBondContact O-CD1 3.36Å; L262-I266 WeakPolarHBondContact O-CG1 3.13Å; L262-I266 PolarHBondContact O-N 2.67Å
263	S	96.8	Very high	95.1	Very high	21 Å²	21	50.8 Å²	50.8	15%	0.147	27%	0.267	C	S	.	.	H	α-helix	trans	-62.2	-46.1	177.8	-61.9	0	0	0	0	111.6	L259 S260 I261 L267	L259-S263 WeakPolarHBondContact O-CB 3.38Å; L259-S263 PolarHBondContact O-N 3.19Å; L259-S263 PolarHBondContact O-OG 2.87Å; S260-S263 PolarHBondContact O-N 3.13Å; I261-S263 VanDerWaalsContact C-N 3.33Å; I261-S263 PolarHBondContact O-N 3.49Å; S263-L267 WeakPolarHBondContact O-CB 3.37Å; S263-L267 WeakPolarHBondContact O-CD1 3.41Å; S263-L267 WeakPolarHBondContact O-CG 3.35Å; S263-L267 PolarHBondContact O-N 3.14Å
264	V	95.6	Very high	94.8	Very high	3 Å²	3	52.5 Å²	52.5	2%	0.018	28%	0.278	C	S	.	.	H	α-helix	trans	-61.1	-50	177.7	169.1	0	0	0	0	110.2	I169 A173 S260 I261 I266 Y268 F384 A387 I391	I169-V264 HydrophobicContact CG2-CG2 3.62Å; A173-V264 HydrophobicContact CB-CG2 4.42Å; S260-V264 WeakPolarHBondContact O-CB 3.35Å; S260-V264 WeakPolarHBondContact O-CG2 3.48Å; S260-V264 PolarHBondContact O-N 3.38Å; I261-V264 PolarHBondContact O-N 2.79Å; V264-I266 PolarHBondContact O-N 3.47Å; V264-Y268 HydrophobicContact CB-CD2 4.45Å; V264-Y268 HydrophobicContact CG1-CD2 3.83Å; V264-Y268 HydrophobicContact CG1-CE2 4.24Å; V264-Y268 VanDerWaalsContact O-CB 3.3Å; V264-Y268 WeakPolarHBondContact O-CB 3.46Å; V264-Y268 VanDerWaalsContact O-CD2 3.32Å; V264-Y268 WeakPolarHBondContact O-CD2 3.36Å; V264-Y268 PolarHBondContact O-N 3.42Å; V264-F384 HydrophobicContact CG1-CE2 4.43Å; V264-A387 HydrophobicContact CG1-CB 3.98Å; V264-A387 HydrophobicContact CG2-CB 3.89Å; V264-I391 HydrophobicContact CB-CD1 4.37Å; V264-I391 HydrophobicContact CG1-CD1 4.19Å
265	I	95.7	Very high	94.5	Very high	98 Å²	98	53 Å²	53	50%	0.503	28%	0.281	S	S	.	.	H	α-helix	trans	-58.9	-50.8	-179.9	-67.7	170.6	0	0	0	110.7	I261 L262 S269	I261-I265 HydrophobicContact CG2-CD1 3.65Å; I261-I265 HydrophobicContact CG2-CG1 4.41Å; I261-I265 WeakPolarHBondContact O-CG1 3.29Å; I261-I265 PolarHBondContact O-N 3.15Å; L262-I265 PolarHBondContact O-N 3.34Å; I265-S269 WeakPolarHBondContact O-CB 3.29Å; I265-S269 PolarHBondContact O-N 3.19Å; I265-S269 PolarHBondContact O-OG 3.44Å
266	I	96.6	Very high	94.1	Very high	99 Å²	99	54.4 Å²	54.4	51%	0.508	28%	0.28	S	S	.	.	H	α-helix	trans	-65.1	-53.6	-176.7	-66.9	166.6	0	0	0	110.5	L262 V264 Y268 S269 L270	L262-I266 WeakPolarHBondContact O-CB 3.4Å; L262-I266 WeakPolarHBondContact O-CD1 3.36Å; L262-I266 WeakPolarHBondContact O-CG1 3.13Å; L262-I266 PolarHBondContact O-N 2.67Å; V264-I266 PolarHBondContact O-N 3.47Å; I266-Y268 PolarHBondContact O-N 2.87Å; I266-S269 PolarHBondContact O-N 3.36Å; I266-L270 HydrophobicContact CG2-CD1 4.27Å; I266-L270 WeakPolarHBondContact O-CG 3.06Å; I266-L270 PolarHBondContact O-N 3.45Å
267	L	96	Very high	93.7	Very high	16 Å²	16	61.7 Å²	61.7	8%	0.084	31%	0.31	C	S	.	.	H	α-helix	trans	-67	-41.6	-172.9	-64.3	169.9	0	0	0	111.9	A173 L174 Y177 S263 L270 I271	A173-L267 HydrophobicContact CB-CB 4.4Å; A173-L267 HydrophobicContact CB-CD1 3.72Å; L174-L267 HydrophobicContact CB-CD1 4.45Å; L174-L267 HydrophobicContact CD2-CD1 3.6Å; L174-L267 HydrophobicContact CD2-CD2 3.96Å; L174-L267 HydrophobicContact CD2-CG 4.45Å; L174-L267 HydrophobicContact CG-CD1 3.78Å; Y177-L267 HydrophobicContact CD1-CD2 4.02Å; Y177-L267 HydrophobicContact CD2-CD2 4.3Å; Y177-L267 HydrophobicContact CG-CD2 3.84Å; S263-L267 WeakPolarHBondContact O-CB 3.37Å; S263-L267 WeakPolarHBondContact O-CD1 3.41Å; S263-L267 WeakPolarHBondContact O-CG 3.35Å; S263-L267 PolarHBondContact O-N 3.14Å; L267-L270 PolarHBondContact O-N 3.42Å; L267-I271 VanDerWaalsContact O-CG1 3.3Å; L267-I271 WeakPolarHBondContact O-CG1 3.46Å; L267-I271 PolarHBondContact O-N 3.4Å
268	Y	94	Very high	93	Very high	12 Å²	12	63.8 Å²	63.8	5%	0.047	32%	0.324	C	S	.	.	H	α-helix	trans	-71.8	-30.8	176.5	-78.7	-82	0	0	0	112.8	A173 V264 I266 L270 I271 L272 F384	A173-Y268 HydrophobicContact CB-CD2 4.47Å; A173-Y268 HydrophobicContact CB-CE2 3.96Å; V264-Y268 HydrophobicContact CB-CD2 4.45Å; V264-Y268 HydrophobicContact CG1-CD2 3.83Å; V264-Y268 HydrophobicContact CG1-CE2 4.24Å; V264-Y268 VanDerWaalsContact O-CB 3.3Å; V264-Y268 WeakPolarHBondContact O-CB 3.46Å; V264-Y268 VanDerWaalsContact O-CD2 3.32Å; V264-Y268 WeakPolarHBondContact O-CD2 3.36Å; V264-Y268 PolarHBondContact O-N 3.42Å; I266-Y268 PolarHBondContact O-N 2.87Å; Y268-L270 VanDerWaalsContact C-N 3.34Å; Y268-L270 PolarHBondContact O-N 2.96Å; Y268-I271 HydrophobicContact CD1-CD1 3.88Å; Y268-I271 HydrophobicContact CE1-CD1 4.11Å; Y268-I271 HydrophobicContact CG-CD1 4.38Å; Y268-I271 PolarHBondContact O-N 2.97Å; Y268-L272 WeakPolarHBondContact O-CB 3.25Å; Y268-L272 VanDerWaalsContact O-CG 3.28Å; Y268-L272 WeakPolarHBondContact O-CG 3.31Å; Y268-L272 PolarHBondContact O-N 3.01Å; Y268-F384 HydrophobicContact CD1-CB 3.91Å; Y268-F384 AromaticContact CD1-CD2 3.53Å; Y268-F384 HydrophobicContact CD1-CD2 3.53Å; Y268-F384 HydrophobicContact CD1-CE2 4.4Å; Y268-F384 HydrophobicContact CD1-CG 4.01Å; Y268-F384 AromaticContact CD2-CD2 3.68Å; Y268-F384 HydrophobicContact CD2-CD2 3.68Å; Y268-F384 HydrophobicContact CD2-CE2 4.3Å; Y268-F384 HydrophobicContact CE1-CB 3.47Å; Y268-F384 VanDerWaalsContact CE1-CB 3.47Å; Y268-F384 AromaticContact CE1-CD2 3.87Å; Y268-F384 HydrophobicContact CE1-CD2 3.87Å; Y268-F384 HydrophobicContact CE1-CG 4.07Å; Y268-F384 HydrophobicContact CE2-CB 4.49Å; Y268-F384 AromaticContact CE2-CD2 3.99Å; Y268-F384 HydrophobicContact CE2-CD2 3.99Å; Y268-F384 AromaticContact CG-CD2 3.42Å; Y268-F384 HydrophobicContact CG-CD2 3.42Å; Y268-F384 VanDerWaalsContact CG-CD2 3.42Å; Y268-F384 AromaticContact CG-CE2 3.98Å; Y268-F384 HydrophobicContact CG-CE2 3.98Å; Y268-F384 HydrophobicContact CG-CG 4.34Å; Y268-F384 WeakPolarHBondContact OH-CA 3.02Å; Y268-F384 PolarHBondContact OH-N 2.87Å; Y268-F384 VanDerWaalsContact OH-N 3.15Å
269	S	93.8	Very high	92.3	Very high	64 Å²	64	63.6 Å²	63.6	45%	0.448	32%	0.321	S	S	.	.	H	α-helix	trans	-62.6	-41	170.5	-63.5	0	0	0	0	111.8	I265 I266 L272 R273	I265-S269 WeakPolarHBondContact O-CB 3.29Å; I265-S269 PolarHBondContact O-N 3.19Å; I265-S269 PolarHBondContact O-OG 3.44Å; I266-S269 PolarHBondContact O-N 3.36Å; S269-L272 PolarHBondContact O-N 3.44Å; S269-R273 WeakPolarHBondContact O-CB 3.35Å; S269-R273 PolarHBondContact O-N 2.97Å
270	L	94.4	Very high	91.7	Very high	60 Å²	60	67 Å²	67	31%	0.314	33%	0.327	S	S	.	.	H	α-helix	trans	-65.2	-41.3	174.4	-65.6	175.1	0	0	0	112	Y177 I266 L267 Y268 R273 V274	Y177-L270 HydrophobicContact CD2-CB 4Å; Y177-L270 HydrophobicContact CD2-CD1 4.3Å; Y177-L270 HydrophobicContact CE2-CB 3.72Å; Y177-L270 HydrophobicContact CE2-CD1 3.68Å; Y177-L270 HydrophobicContact CE2-CG 4.35Å; I266-L270 HydrophobicContact CG2-CD1 4.27Å; I266-L270 WeakPolarHBondContact O-CG 3.06Å; I266-L270 PolarHBondContact O-N 3.45Å; L267-L270 PolarHBondContact O-N 3.42Å; Y268-L270 VanDerWaalsContact C-N 3.34Å; Y268-L270 PolarHBondContact O-N 2.96Å; L270-R273 PolarHBondContact O-N 3.26Å; L270-V274 WeakPolarHBondContact O-CG2 3.29Å; L270-V274 PolarHBondContact O-N 3.38Å; L270-V274 VanDerWaalsContact O-N 3.08Å
271	I	92.7	Very high	90.7	Very high	8 Å²	8	70 Å²	70	4%	0.041	35%	0.352	C	S	.	.	H	α-helix	trans	-58.8	-50.2	173.5	-68.3	166.4	0	0	0	110	R176 Y177 I180 L267 Y268 R273 V274 V275	R176-I271 HydrophobicContact CB-CD1 3.91Å; Y177-I271 HydrophobicContact CD2-CG1 4.4Å; I180-I271 HydrophobicContact CD1-CG2 3.89Å; I180-I271 HydrophobicContact CG2-CG2 4.23Å; L267-I271 VanDerWaalsContact O-CG1 3.3Å; L267-I271 WeakPolarHBondContact O-CG1 3.46Å; L267-I271 PolarHBondContact O-N 3.4Å; Y268-I271 HydrophobicContact CD1-CD1 3.88Å; Y268-I271 HydrophobicContact CE1-CD1 4.11Å; Y268-I271 HydrophobicContact CG-CD1 4.38Å; Y268-I271 PolarHBondContact O-N 2.97Å; I271-R273 VanDerWaalsContact C-N 3.32Å; I271-R273 PolarHBondContact O-N 3.41Å; I271-V274 PolarHBondContact O-N 2.87Å; I271-V274 VanDerWaalsContact O-N 3.16Å; I271-V275 HydrophobicContact CG2-CG2 4.27Å; I271-V275 VanDerWaalsContact O-CG2 3.32Å; I271-V275 WeakPolarHBondContact O-CG2 3.46Å; I271-V275 PolarHBondContact O-N 3.1Å
272	L	91.9	Very high	89.5	Confident	101 Å²	101	70.7 Å²	70.7	53%	0.529	36%	0.355	S	S	.	.	H	α-helix	trans	-58.6	-42.6	178.7	-72.4	171.6	0	0	0	111.7	Y268 S269 V274 V275 I276	Y268-L272 WeakPolarHBondContact O-CB 3.25Å; Y268-L272 VanDerWaalsContact O-CG 3.28Å; Y268-L272 WeakPolarHBondContact O-CG 3.31Å; Y268-L272 PolarHBondContact O-N 3.01Å; S269-L272 PolarHBondContact O-N 3.44Å; L272-V274 VanDerWaalsContact C-N 3.34Å; L272-V274 PolarHBondContact O-N 3.02Å; L272-V275 PolarHBondContact O-N 3.27Å; L272-I276 WeakPolarHBondContact O-CB 3.37Å; L272-I276 VanDerWaalsContact O-CG1 3.24Å; L272-I276 WeakPolarHBondContact O-CG1 3.41Å; L272-I276 PolarHBondContact O-N 3.18Å
273	R	92.2	Very high	87.9	Confident	188 Å²	188	75.8 Å²	75.8	71%	0.709	37%	0.368	S	S	*	.	H	α-helix	trans	-58	-45.3	175.9	-174.4	-178.8	-179.2	-172.8	1.3	111.9	S269 L270 I271 K277	S269-R273 WeakPolarHBondContact O-CB 3.35Å; S269-R273 PolarHBondContact O-N 2.97Å; L270-R273 PolarHBondContact O-N 3.26Å; I271-R273 VanDerWaalsContact C-N 3.32Å; I271-R273 PolarHBondContact O-N 3.41Å; R273-K277 WeakPolarHBondContact O-CB 3.41Å; R273-K277 PolarHBondContact O-N 3.09Å
274	V	87.6	Confident	86	Confident	49 Å²	49	84.2 Å²	84.2	30%	0.297	40%	0.397	S	S	.	.	H	α-helix	trans	-65.9	-44	177.6	171.2	0	0	0	0	111	C181 L270 I271 L272 I276 K277 T278	C181-V274 HydrophobicContact CB-CG2 4.31Å; L270-V274 WeakPolarHBondContact O-CG2 3.29Å; L270-V274 PolarHBondContact O-N 3.38Å; L270-V274 VanDerWaalsContact O-N 3.08Å; I271-V274 PolarHBondContact O-N 2.87Å; I271-V274 VanDerWaalsContact O-N 3.16Å; L272-V274 VanDerWaalsContact C-N 3.34Å; L272-V274 PolarHBondContact O-N 3.02Å; V274-I276 PolarHBondContact O-N 3.27Å; V274-K277 PolarHBondContact O-N 3.35Å; V274-T278 PolarHBondContact O-N 2.96Å; V274-T278 PolarHBondContact O-OG1 3.26Å
275	V	87.4	Confident	83.6	Confident	30 Å²	30	87.3 Å²	87.3	18%	0.182	42%	0.42	C	S	.	.	H	α-helix	trans	-60.8	-45.4	178	172.9	0	0	0	0	111.3	I271 L272 T278 H279 I377	I271-V275 HydrophobicContact CG2-CG2 4.27Å; I271-V275 VanDerWaalsContact O-CG2 3.32Å; I271-V275 WeakPolarHBondContact O-CG2 3.46Å; I271-V275 PolarHBondContact O-N 3.1Å; L272-V275 PolarHBondContact O-N 3.27Å; V275-T278 PolarHBondContact O-N 3.49Å; V275-H279 WeakPolarHBondContact O-CB 3.48Å; V275-H279 PolarHBondContact O-N 3.44Å; V275-I377 HydrophobicContact CB-CD1 4.43Å; V275-I377 HydrophobicContact CG1-CD1 3.97Å; V275-I377 HydrophobicContact CG2-CD1 3.67Å; V275-I377 HydrophobicContact CG2-CG1 3.79Å
276	I	87.7	Confident	81	Confident	85 Å²	85	87.5 Å²	87.5	44%	0.436	43%	0.427	S	S	.	.	H	α-helix	trans	-63.1	-44.2	177.3	-67.7	165.4	0	0	0	110.7	L272 V274 T278 H279 R280	L272-I276 WeakPolarHBondContact O-CB 3.37Å; L272-I276 VanDerWaalsContact O-CG1 3.24Å; L272-I276 WeakPolarHBondContact O-CG1 3.41Å; L272-I276 PolarHBondContact O-N 3.18Å; V274-I276 PolarHBondContact O-N 3.27Å; I276-T278 PolarHBondContact O-N 2.88Å; I276-H279 PolarHBondContact O-N 3.34Å; I276-R280 HydrophobicContact CG2-CG 4.38Å; I276-R280 WeakPolarHBondContact O-CB 3.17Å; I276-R280 VanDerWaalsContact O-CG 3.29Å; I276-R280 WeakPolarHBondContact O-CG 3.22Å; I276-R280 PolarHBondContact O-N 3.22Å
277	K	87.4	Confident	78.4	Confident	161 Å²	161	91.1 Å²	91.1	70%	0.7	44%	0.444	S	S	*	.	H	α-helix	trans	-60.3	-44.8	177.5	-173	178	179.5	-179.3	0	111.3	R273 V274 R280 A281	R273-K277 WeakPolarHBondContact O-CB 3.41Å; R273-K277 PolarHBondContact O-N 3.09Å; V274-K277 PolarHBondContact O-N 3.35Å; K277-R280 PolarHBondContact O-N 3.17Å; K277-A281 WeakPolarHBondContact O-CB 3.23Å; K277-A281 PolarHBondContact O-N 3.33Å
278	T	80.8	Confident	75.8	Confident	46 Å²	46	96.7 Å²	96.7	28%	0.282	48%	0.478	S	S	.	.	H	α-helix	trans	-65	-45.4	178.6	-58.1	0	0	0	0	111.9	V274 V275 I276 R280 A281 Q282 L373	V274-T278 PolarHBondContact O-N 2.96Å; V274-T278 PolarHBondContact O-OG1 3.26Å; V275-T278 PolarHBondContact O-N 3.49Å; I276-T278 PolarHBondContact O-N 2.88Å; T278-R280 VanDerWaalsContact C-N 3.33Å; T278-R280 PolarHBondContact O-N 3.42Å; T278-A281 PolarHBondContact O-N 2.88Å; T278-Q282 WeakPolarHBondContact O-CG 3.44Å; T278-Q282 PolarHBondContact O-N 3.12Å; T278-L373 HydrophobicContact CG2-CD2 3.77Å
279	H	81.1	Confident	73.2	Confident	75 Å²	75	99.9 Å²	99.9	35%	0.347	50%	0.503	S	S	.	.	H	α-helix	trans	-64.9	-36.3	177.6	-177.6	-95.2	0	0	0	112.3	V275 I276 Q282 R283	V275-H279 WeakPolarHBondContact O-CB 3.48Å; V275-H279 PolarHBondContact O-N 3.44Å; I276-H279 PolarHBondContact O-N 3.34Å; H279-Q282 PolarHBondContact O-N 2.96Å; H279-R283 PolarHBondContact CE1-NE 3.42Å; H279-R283 PolarHBondContact O-N 3.26Å
280	R	83.6	Confident	70.5	Confident	163 Å²	163	103.9 Å²	103.9	62%	0.615	52%	0.519	S	S	*	.	H	α-helix	trans	-65.1	-45.9	172.8	-73.7	178.1	-176.5	-172.6	2.4	111.6	I276 K277 T278 Q282 R283 Y284	I276-R280 HydrophobicContact CG2-CG 4.38Å; I276-R280 WeakPolarHBondContact O-CB 3.17Å; I276-R280 VanDerWaalsContact O-CG 3.29Å; I276-R280 WeakPolarHBondContact O-CG 3.22Å; I276-R280 PolarHBondContact O-N 3.22Å; K277-R280 PolarHBondContact O-N 3.17Å; T278-R280 VanDerWaalsContact C-N 3.33Å; T278-R280 PolarHBondContact O-N 3.42Å; R280-Q282 PolarHBondContact O-N 3.47Å; R280-R283 PolarHBondContact O-N 3.11Å; R280-Y284 VanDerWaalsContact O-CD2 3.26Å; R280-Y284 WeakPolarHBondContact O-CD2 3.46Å; R280-Y284 PolarHBondContact O-N 2.79Å
281	A	77.4	Confident	67.6	Low	64 Å²	64	108.5 Å²	108.5	53%	0.529	54%	0.544	S	S	.	.	H	α-helix	trans	-60.6	-31	177.3	0	0	0	0	0	112.9	K277 T278	K277-A281 WeakPolarHBondContact O-CB 3.23Å; K277-A281 PolarHBondContact O-N 3.33Å; T278-A281 PolarHBondContact O-N 2.88Å
282	Q	69.1	Low	64.8	Low	52 Å²	52	113.9 Å²	113.9	24%	0.243	57%	0.571	C	S	.	*	H	α-helix	trans	-67.6	-38.3	173.4	-73.9	174.1	-21.1	0	0	112.7	T278 H279 R280 Y284 S285 E370	T278-Q282 WeakPolarHBondContact O-CG 3.44Å; T278-Q282 PolarHBondContact O-N 3.12Å; H279-Q282 PolarHBondContact O-N 2.96Å; R280-Q282 PolarHBondContact O-N 3.47Å; Q282-Y284 VanDerWaalsContact C-N 3.35Å; Q282-S285 PolarHBondContact O-N 2.96Å; Q282-E370 PolarHBondContact NE2-OE1 2.99Å
283	R	63.9	Low	62.1	Low	197 Å²	197	112.3 Å²	112.3	74%	0.743	57%	0.567	S	S	*	*	H	α-helix	trans	-69.5	-29.4	176.8	-73.4	-169.2	177.1	-173.6	-1.3	113.5	H279 R280 S285	H279-R283 PolarHBondContact CE1-NE 3.42Å; H279-R283 PolarHBondContact O-N 3.26Å; R280-R283 PolarHBondContact O-N 3.11Å; R283-S285 VanDerWaalsContact C-N 3.31Å
284	Y	57	Low	59.3	Low	197 Å²	197	113 Å²	113	77%	0.773	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	10.9	177.2	-72.2	-75.8	0	0	0	114.1	R280 Q282 P286	R280-Y284 VanDerWaalsContact O-CD2 3.26Å; R280-Y284 WeakPolarHBondContact O-CD2 3.46Å; R280-Y284 PolarHBondContact O-N 2.79Å; Q282-Y284 VanDerWaalsContact C-N 3.35Å; Y284-P286 WeakPolarHBondContact O-CD 3.18Å
285	S	44.9	Very low	56.8	Low	69 Å²	69	117.8 Å²	117.8	48%	0.483	59%	0.588	S	S	.	*			trans	-103.2	79.3	170.4	-157.5	0	0	0	0	109.4	Q282 R283 M287	Q282-S285 PolarHBondContact O-N 2.96Å; R283-S285 VanDerWaalsContact C-N 3.31Å; S285-M287 PolarHBondContact O-N 3.35Å
286	P	42.5	Very low	54.6	Low	101 Å²	101	120.3 Å²	120.3	66%	0.656	60%	0.604	S	S	*	*			trans	-68.1	125.7	171	30.3	-33.1	0	0	0	108.8	Y284 V288	Y284-P286 WeakPolarHBondContact O-CD 3.18Å; P286-V288 PolarHBondContact O-N 2.97Å
287	M	40.8	Very low	52.2	Low	175 Å²	175	119.5 Å²	119.5	86%	0.862	60%	0.603	S	S	*	*			trans	32.3	76.6	142.7	-63	-174.5	142.9	0	0	117.3	S285 S289	S285-M287 PolarHBondContact O-N 3.35Å; M287-S289 VanDerWaalsContact C-N 3.28Å
288	V	42.6	Very low	50	Low	134 Å²	134	117.4 Å²	117.4	81%	0.812	60%	0.598	S	S	*	*			trans	-104	61.2	136.8	-173.6	0	0	0	0	106.7	P286	P286-V288 PolarHBondContact O-N 2.97Å
289	S	37.8	Very low	48	Very low	79 Å²	79	120.2 Å²	120.2	55%	0.552	61%	0.609	S	S	*	*	S	Bend	trans	-137.7	102.7	172	-178	0	0	0	0	106.8	M287	M287-S289 VanDerWaalsContact C-N 3.28Å
290	N	36.8	Very low	45.9	Very low	147 Å²	147	122.6 Å²	122.6	79%	0.786	62%	0.624	S	S	*	*	S	Bend	trans	62.5	63.4	159.4	-59	-9.9	0	0	0	117.3
291	N	34.3	Very low	43.8	Very low	157 Å²	157	121 Å²	121	84%	0.84	62%	0.624	S	S	*	*			trans	-146.6	49.9	147.2	-97.1	-15.6	0	0	0	110.4	P293	N291-P293 WeakPolarHBondContact O-CD 3.12Å
292	I	35	Very low	42	Very low	121 Å²	121	121 Å²	121	62%	0.621	62%	0.62	S	S	*	*	S	Bend	trans	-71.7	109	145.1	-60.1	174.9	0	0	0	102.8	Y294 V297	I292-Y294 PolarHBondContact O-N 2.87Å; I292-V297 HydrophobicContact CG2-CG2 4.16Å
293	P	33.6	Very low	40.4	Very low	69 Å²	69	124.3 Å²	124.3	45%	0.448	64%	0.639	S	S	.	*			trans	-60.2	121	175.6	-9	23.4	0	0	0	105.3	N291 K295 T296	N291-P293 WeakPolarHBondContact O-CD 3.12Å; P293-K295 HydrophobicContact CB-CB 4.22Å; P293-K295 PolarHBondContact O-N 3.39Å; P293-T296 WeakPolarHBondContact CD-OG1 3.02Å; P293-T296 WeakPolarHBondContact CG-OG1 3.32Å; P293-T296 PolarHBondContact O-N 2.81Å; P293-T296 PolarHBondContact O-OG1 3.09Å
294	Y	33.5	Very low	39	Very low	201 Å²	201	122.8 Å²	122.8	79%	0.788	64%	0.642	S	S	*	*	H	α-helix	trans	-51.3	-21.8	169.9	-73	-94.9	0	0	0	111	I292 T296 V297 I298	I292-Y294 PolarHBondContact O-N 2.87Å; Y294-T296 PolarHBondContact O-N 3.11Å; Y294-V297 PolarHBondContact O-N 3.23Å; Y294-I298 WeakPolarHBondContact O-CG1 3.42Å; Y294-I298 PolarHBondContact O-N 3.36Å
295	K	35.6	Very low	37.9	Very low	151 Å²	151	119.7 Å²	119.7	66%	0.657	64%	0.639	S	S	*	*	H	α-helix	trans	-60	-33.2	168.6	-95.7	-177.6	169.1	-178.9	0	115.5	P293 V297 I298 M299	P293-K295 HydrophobicContact CB-CB 4.22Å; P293-K295 PolarHBondContact O-N 3.39Å; K295-V297 VanDerWaalsContact C-N 3.33Å; K295-V297 PolarHBondContact O-N 3.29Å; K295-I298 PolarHBondContact O-N 2.81Å; K295-M299 HydrophobicContact CB-CE 4.33Å; K295-M299 HydrophobicContact CD-CE 3.89Å; K295-M299 HydrophobicContact CG-CE 4.01Å; K295-M299 WeakPolarHBondContact O-CB 3.36Å; K295-M299 WeakPolarHBondContact O-CG 3.45Å; K295-M299 PolarHBondContact O-N 2.81Å
296	T	40.3	Very low	37.5	Very low	82 Å²	82	123.7 Å²	123.7	50%	0.503	65%	0.65	S	S	.	*	H	α-helix	trans	-80.6	-16.5	-177.6	-22.3	0	0	0	0	112.8	P293 Y294	P293-T296 WeakPolarHBondContact CD-OG1 3.02Å; P293-T296 WeakPolarHBondContact CG-OG1 3.32Å; P293-T296 PolarHBondContact O-N 2.81Å; P293-T296 PolarHBondContact O-OG1 3.09Å; Y294-T296 PolarHBondContact O-N 3.11Å
297	V	38.8	Very low	37	Very low	69 Å²	69	128.8 Å²	128.8	42%	0.418	66%	0.662	S	S	.	*	H	α-helix	trans	-94.4	-18.8	175.8	-178.9	0	0	0	0	111.6	I292 Y294 K295	I292-V297 HydrophobicContact CG2-CG2 4.16Å; Y294-V297 PolarHBondContact O-N 3.23Å; K295-V297 VanDerWaalsContact C-N 3.33Å; K295-V297 PolarHBondContact O-N 3.29Å
298	I	39.7	Very low	36.5	Very low	116 Å²	116	124.4 Å²	124.4	60%	0.595	65%	0.649	S	S	*	*	H	α-helix	trans	-98.2	-29.8	178.9	-61.2	173.6	0	0	0	111.9	Y294 K295 N300 H301 S302	Y294-I298 WeakPolarHBondContact O-CG1 3.42Å; Y294-I298 PolarHBondContact O-N 3.36Å; K295-I298 PolarHBondContact O-N 2.81Å; I298-N300 PolarHBondContact O-N 3.36Å; I298-H301 PolarHBondContact O-N 3.19Å; I298-S302 PolarHBondContact O-N 3.04Å; I298-S302 PolarHBondContact O-OG 3.42Å
299	M	38.7	Very low	35.9	Very low	105 Å²	105	125.2 Å²	125.2	52%	0.517	65%	0.647	S	S	.	*	H	α-helix	trans	-74.5	-19.6	176.8	-71.7	-166	-161.9	0	0	115	K295 S302	K295-M299 HydrophobicContact CB-CE 4.33Å; K295-M299 HydrophobicContact CD-CE 3.89Å; K295-M299 HydrophobicContact CG-CE 4.01Å; K295-M299 WeakPolarHBondContact O-CB 3.36Å; K295-M299 WeakPolarHBondContact O-CG 3.45Å; K295-M299 PolarHBondContact O-N 2.81Å; M299-S302 PolarHBondContact O-OG 2.94Å
300	N	37	Very low	35.6	Very low	126 Å²	126	129.5 Å²	129.5	67%	0.674	66%	0.66	S	S	*	*	H	α-helix	trans	-89.8	-7.6	172.9	-85.6	3.8	0	0	0	113.4	I298	I298-N300 PolarHBondContact O-N 3.36Å
301	H	40.3	Very low	35.4	Very low	129 Å²	129	128.4 Å²	128.4	60%	0.597	66%	0.664	S	S	*	*	H	α-helix	trans	-95.9	-17	175	-133.6	-48.2	0	0	0	112.8	I298	I298-H301 PolarHBondContact O-N 3.19Å
302	S	39.3	Very low	35.5	Very low	65 Å²	65	125.3 Å²	125.3	46%	0.455	66%	0.655	S	S	.	*	H	α-helix	trans	-90.1	-20.6	172.2	52.6	0	0	0	0	113.9	I298 M299	I298-S302 PolarHBondContact O-N 3.04Å; I298-S302 PolarHBondContact O-OG 3.42Å; M299-S302 PolarHBondContact O-OG 2.94Å
303	N	36.1	Very low	35.5	Very low	120 Å²	120	126.3 Å²	126.3	64%	0.642	66%	0.661	S	S	*	*	S	Bend	trans	-97.5	4.4	-177	-89.5	1.1	0	0	0	115.9
304	M	33.9	Very low	35.6	Very low	165 Å²	165	131.5 Å²	131.5	81%	0.813	69%	0.685	S	S	*	*	S	Bend	trans	-117.4	-1.6	178	-107.5	-171	161.4	0	0	115.3
305	N	34.6	Very low	35.8	Very low	132 Å²	132	129.7 Å²	129.7	71%	0.706	69%	0.689	S	S	*	*	S	Bend	trans	-118.5	18.1	175	-78.8	-3.8	0	0	0	113.5
306	Q	36.6	Very low	35.8	Very low	154 Å²	154	128.9 Å²	128.9	72%	0.72	69%	0.691	S	S	*	*	S	Bend	trans	-126.2	15.6	177.8	-133.2	171.6	16.5	0	0	113.2
307	K	32.2	Very low	35.5	Very low	208 Å²	208	130.6 Å²	130.6	90%	0.904	70%	0.697	S	S	*	*	S	Bend	trans	-94.8	8	172.8	-102	-176.2	176.4	-175.6	0	114.3
308	S	30.5	Very low	35.3	Very low	82 Å²	82	133.2 Å²	133.2	57%	0.573	71%	0.709	S	S	*	*	S	Bend	trans	-113.2	128.8	159.2	55.6	0	0	0	0	106.4
309	I	30.3	Very low	35.1	Very low	152 Å²	152	133.8 Å²	133.8	78%	0.779	71%	0.713	S	S	*	*	S	Bend	trans	91.3	108.1	178.6	-45.9	153.8	0	0	0	112.2
310	M	29.6	Very low	34.9	Very low	169 Å²	169	135.7 Å²	135.7	83%	0.833	72%	0.721	S	S	*	*			trans	95	70.1	162.5	-131.6	134.3	70.6	0	0	117.8
311	S	34.1	Very low	34.7	Very low	124 Å²	124	135.8 Å²	135.8	87%	0.867	72%	0.721	S	S	*	*			trans	-114.5	97.7	133.7	-77.4	0	0	0	0	104.7
312	S	34.9	Very low	34.5	Very low	91 Å²	91	135.1 Å²	135.1	64%	0.636	73%	0.726	S	S	*	*				67.4	93.6	79.9	-60.7	0	0	0	0	111.4
313	N	35.8	Very low	34.2	Very low	142 Å²	142	137.3 Å²	137.3	76%	0.759	74%	0.737	S	S	*	*			trans	62.2	95.8	149.3	-61.5	-8.3	0	0	0	117.1	L315	N313-L315 VanDerWaalsContact C-N 3.3Å; N313-L315 PolarHBondContact O-N 3.07Å
314	D	35.1	Very low	34.1	Very low	179 Å²	179	137.6 Å²	137.6	96%	0.957	74%	0.739	S	S	*	*			trans	-50.5	98.8	142.2	-72.5	-45.1	0	0	0	109
315	L	37.6	Very low	34.1	Very low	163 Å²	163	136 Å²	136	85%	0.853	73%	0.733	S	S	*	*			trans	-87	112.7	164.9	-101.3	153.9	0	0	0	108	N313	N313-L315 VanDerWaalsContact C-N 3.3Å; N313-L315 PolarHBondContact O-N 3.07Å
316	N	36.1	Very low	34.1	Very low	133 Å²	133	135.1 Å²	135.1	71%	0.711	73%	0.733	S	S	*	*			trans	-37.9	146.5	166.9	-148.2	3.5	0	0	0	114.9
317	N	34.1	Very low	34	Very low	118 Å²	118	133.1 Å²	133.1	63%	0.631	73%	0.732	S	S	*	*			trans	79.1	109.7	151.8	-82.9	-21.1	0	0	0	121.7
318	N	34.8	Very low	34	Very low	125 Å²	125	132.1 Å²	132.1	67%	0.668	72%	0.724	S	S	*	*				75	115.8	120.9	-65.7	-13.1	0	0	0	120.9
319	N	34.9	Very low	34.2	Very low	128 Å²	128	133.3 Å²	133.3	68%	0.684	72%	0.723	S	S	*	*				94.2	122.1	129.2	-71.9	-2.3	0	0	0	120.3
320	Q	34.9	Very low	34.6	Very low	145 Å²	145	131.8 Å²	131.8	68%	0.678	72%	0.717	S	S	*	*			trans	78.3	105.8	135.7	-76.4	175.3	-70.7	0	0	116.9
321	D	33.9	Very low	34.9	Very low	127 Å²	127	129.7 Å²	129.7	68%	0.679	71%	0.709	S	S	*	*				108.3	136.1	99.3	-78.5	-20.8	0	0	0	104.7
322	T	34.4	Very low	35.2	Very low	115 Å²	115	131 Å²	131	71%	0.706	71%	0.706	S	S	*	*			cis	-166.5	140.1	23.8	-1.7	0	0	0	0	107.3
323	T	32.8	Very low	35.4	Very low	111 Å²	111	134 Å²	134	68%	0.681	71%	0.713	S	S	*	*			trans	31.8	122.6	137	56.1	0	0	0	0	120.9
324	D	35.7	Very low	35.5	Very low	126 Å²	126	135.9 Å²	135.9	67%	0.674	72%	0.718	S	S	*	*				172	127.7	93.7	-96.3	-30.3	0	0	0	114.3
325	N	33.1	Very low	35.8	Very low	131 Å²	131	135.7 Å²	135.7	70%	0.701	71%	0.711	S	S	*	*				53.2	128.2	128.4	-64.3	-20.6	0	0	0	118.9
326	T	35.5	Very low	35.6	Very low	114 Å²	114	132.1 Å²	132.1	70%	0.699	70%	0.699	S	S	*	*			cis	176.7	134.5	41.8	18.1	0	0	0	0	107.8
327	T	33.9	Very low	36	Very low	113 Å²	113	132.3 Å²	132.3	69%	0.693	71%	0.706	S	S	*	*				84.6	129	105	-55.9	0	0	0	0	112.6
328	Y	31.9	Very low	36.7	Very low	187 Å²	187	134 Å²	134	73%	0.733	72%	0.715	S	S	*	*			cis	-172.2	149.7	18	-129.9	-140	0	0	0	110.4
329	N	35.6	Very low	37.4	Very low	106 Å²	106	133.5 Å²	133.5	57%	0.567	72%	0.718	S	S	*	*				53.5	144.5	129.4	-76.7	7.4	0	0	0	121.7
330	N	38.6	Very low	38.7	Very low	120 Å²	120	132.7 Å²	132.7	64%	0.642	72%	0.72	S	S	*	*			cis	-161.3	131.2	20.4	-102	-25.8	0	0	0	107.3
331	N	35	Very low	39.2	Very low	126 Å²	126	131.9 Å²	131.9	67%	0.674	73%	0.728	S	S	*	*				74.7	131.6	87.6	-71.6	-19.9	0	0	0	117.6
332	N	40.1	Very low	40	Very low	151 Å²	151	131 Å²	131	81%	0.807	73%	0.732	S	S	*	*			trans	120	85.7	159.4	-59.1	-9.2	0	0	0	111.7
333	I	39.7	Very low	40.6	Very low	153 Å²	153	130.1 Å²	130.1	79%	0.785	74%	0.735	S	S	*	*				52.1	106	68.7	-43.1	-176.5	0	0	0	114.9
334	E	37.7	Very low	41.6	Very low	183 Å²	183	129.8 Å²	129.8	86%	0.855	74%	0.735	S	S	*	*			trans	156.4	100.2	131.3	-88	-171.2	150.6	0	0	109.2
335	H	41.4	Very low	42	Very low	174 Å²	174	130.2 Å²	130.2	81%	0.806	75%	0.745	S	S	*	*				88.5	104.8	84.3	-154.7	21.3	0	0	0	114.9
336	S	34.2	Very low	42.8	Very low	88 Å²	88	131.6 Å²	131.6	62%	0.615	75%	0.747	S	S	*	*			trans	59.9	113.9	148.4	-69.8	0	0	0	0	122
337	T	43.6	Very low	43.4	Very low	137 Å²	137	134.5 Å²	134.5	84%	0.84	75%	0.753	S	S	*	*				-172.6	130.5	111.2	30.4	0	0	0	0	110.1
338	D	48.6	Very low	44.1	Very low	154 Å²	154	137.3 Å²	137.3	82%	0.824	76%	0.757	S	S	*	*			trans	9.9	144.6	169.7	-61.1	-37.5	0	0	0	123.8
339	P	51	Low	44.9	Very low	114 Å²	114	137.5 Å²	137.5	74%	0.74	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-87.1	147.9	-169.7	35.5	-33.6	0	0	0	113.8
340	P	60.9	Low	45.6	Very low	111 Å²	111	137.8 Å²	137.8	72%	0.721	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-83.5	140.2	165.1	33	-28.9	0	0	0	110.5
341	P	46.2	Very low	46.2	Very low	129 Å²	129	137.8 Å²	137.8	84%	0.838	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-87.3	116.4	175.2	32.6	-27.6	0	0	0	109.5
342	S	50.6	Low	46.8	Very low	109 Å²	109	139.3 Å²	139.3	76%	0.762	75%	0.751	S	S	*	*			trans	-156	113.9	167.6	55.3	0	0	0	0	115.7
343	A	47.3	Very low	47.3	Very low	95 Å²	95	138.7 Å²	138.7	79%	0.785	74%	0.741	S	S	*	*			trans	88.1	107.6	142.3	0	0	0	0	0	120.1
344	P	52.3	Low	48.1	Very low	105 Å²	105	133.7 Å²	133.7	68%	0.682	72%	0.719	S	S	*	*			trans	-78.4	154	165.7	32	-31.2	0	0	0	112.2	Q346	P344-Q346 PolarHBondContact O-N 2.86Å; P344-Q346 VanDerWaalsContact O-N 3.1Å
345	P	45.8	Very low	49.2	Very low	135 Å²	135	128.8 Å²	128.8	88%	0.877	70%	0.698	S	S	*	*			trans	-79.6	94.8	-171.5	31.8	-34	0	0	0	112.2
346	Q	48.5	Very low	50.1	Low	159 Å²	159	123.4 Å²	123.4	74%	0.743	68%	0.678	S	S	*	*			trans	-95	-4.7	175.9	-80	-175.6	-15.9	0	0	115.2	P344 H348	P344-Q346 PolarHBondContact O-N 2.86Å; P344-Q346 VanDerWaalsContact O-N 3.1Å; Q346-H348 PolarHBondContact O-N 3.45Å
347	H	47.6	Very low	50.9	Low	176 Å²	176	123.9 Å²	123.9	82%	0.815	67%	0.673	S	S	*	*	H	α-helix	trans	-78.5	-14	-169.2	-119.1	-79.3	0	0	0	116.8
348	H	50.6	Low	51.2	Low	172 Å²	172	125.3 Å²	125.3	80%	0.796	66%	0.663	S	S	*	*	H	α-helix	trans	-88.5	-25	-174.4	-106.9	-72.5	0	0	0	115.2	Q346	Q346-H348 PolarHBondContact O-N 3.45Å
349	R	48.1	Very low	51.5	Low	191 Å²	191	121.8 Å²	121.8	72%	0.721	64%	0.644	S	S	*	*	H	α-helix	trans	-80	-35.4	-177.5	-83.3	-177.9	178.5	173.2	-0	113	R352 K353	R349-R352 PolarHBondContact O-N 3.25Å; R349-K353 PolarHBondContact O-N 3.44Å
350	D	49.8	Very low	51.4	Low	111 Å²	111	123.3 Å²	123.3	59%	0.594	64%	0.638	S	S	*	*	H	α-helix	trans	-71.1	-34.4	-179	-69.5	-24.1	0	0	0	112.1	R352 K353 S354	D350-R352 VanDerWaalsContact C-N 3.35Å; D350-R352 PolarHBondContact O-N 3.35Å; D350-K353 PolarHBondContact O-N 3.22Å; D350-S354 VanDerWaalsContact O-CB 3.29Å; D350-S354 WeakPolarHBondContact O-CB 3.25Å; D350-S354 PolarHBondContact O-N 3.47Å
351	H	50.3	Low	50.4	Low	120 Å²	120	123.8 Å²	123.8	56%	0.556	63%	0.633	S	S	*	*	H	α-helix	trans	-64.9	-37.4	175.2	-151.5	-71.4	0	0	0	112.2	S354 I355	H351-S354 WeakPolarHBondContact O-CB 3.47Å; H351-I355 WeakPolarHBondContact ND1-CD1 3.11Å; H351-I355 WeakPolarHBondContact O-CG1 3.26Å; H351-I355 PolarHBondContact O-N 3.17Å; H351-I355 VanDerWaalsContact O-N 3.14Å
352	R	49.3	Very low	50.5	Low	159 Å²	159	122.5 Å²	122.5	60%	0.6	62%	0.618	S	S	*	*	H	α-helix	trans	-70.3	-42.2	178.5	-165.5	175.8	-178.1	-172.9	0.7	112.3	R349 D350 I355 T356	R349-R352 PolarHBondContact O-N 3.25Å; D350-R352 VanDerWaalsContact C-N 3.35Å; D350-R352 PolarHBondContact O-N 3.35Å; R352-I355 PolarHBondContact O-N 3.19Å; R352-T356 WeakPolarHBondContact O-CG2 3.29Å; R352-T356 PolarHBondContact O-N 2.94Å; R352-T356 VanDerWaalsContact O-N 3.13Å; R352-T356 PolarHBondContact O-OG1 3.04Å
353	K	50.4	Low	50.8	Low	138 Å²	138	120.9 Å²	120.9	60%	0.6	60%	0.6	S	S	*	*	H	α-helix	trans	-63.5	-43.3	175.1	-74	-178.7	179.7	175.9	0	111.6	R349 D350 I355 T356 N357	R349-K353 PolarHBondContact O-N 3.44Å; D350-K353 PolarHBondContact O-N 3.22Å; K353-I355 PolarHBondContact O-N 3.28Å; K353-T356 PolarHBondContact O-N 2.88Å; K353-T356 PolarHBondContact O-OG1 2.92Å; K353-N357 WeakPolarHBondContact O-CB 3.38Å; K353-N357 PolarHBondContact O-N 3.45Å
354	S	55.2	Low	50.6	Low	48 Å²	48	119.2 Å²	119.2	34%	0.336	58%	0.583	S	S	.	*	H	α-helix	trans	-52.8	-51.3	173.9	158	0	0	0	0	112.4	D350 H351 N357 R358	D350-S354 VanDerWaalsContact O-CB 3.29Å; D350-S354 WeakPolarHBondContact O-CB 3.25Å; D350-S354 PolarHBondContact O-N 3.47Å; H351-S354 WeakPolarHBondContact O-CB 3.47Å; S354-N357 PolarHBondContact O-N 3.34Å; S354-R358 WeakPolarHBondContact O-CG 3.2Å; S354-R358 PolarHBondContact O-N 3.1Å
355	I	62.4	Low	50.8	Low	79 Å²	79	117.2 Å²	117.2	41%	0.405	57%	0.566	S	S	.	*	H	α-helix	trans	-63.1	-46.9	-179.9	-67.8	165.9	0	0	0	111.1	H351 R352 K353 N357 R358 I359	H351-I355 WeakPolarHBondContact ND1-CD1 3.11Å; H351-I355 WeakPolarHBondContact O-CG1 3.26Å; H351-I355 PolarHBondContact O-N 3.17Å; H351-I355 VanDerWaalsContact O-N 3.14Å; R352-I355 PolarHBondContact O-N 3.19Å; K353-I355 PolarHBondContact O-N 3.28Å; I355-N357 VanDerWaalsContact C-N 3.31Å; I355-N357 PolarHBondContact O-N 3.03Å; I355-R358 PolarHBondContact O-N 2.92Å; I355-I359 HydrophobicContact CG2-CD1 3.81Å; I355-I359 HydrophobicContact CG2-CG1 4.45Å; I355-I359 WeakPolarHBondContact O-CG1 3.38Å; I355-I359 PolarHBondContact O-N 3.45Å
356	T	58.5	Low	51.5	Low	62 Å²	62	114.9 Å²	114.9	38%	0.38	54%	0.542	S	S	.	.	H	α-helix	trans	-62.6	-36.3	179.5	55.6	0	0	0	0	113	R352 K353 I359 K360	R352-T356 WeakPolarHBondContact O-CG2 3.29Å; R352-T356 PolarHBondContact O-N 2.94Å; R352-T356 VanDerWaalsContact O-N 3.13Å; R352-T356 PolarHBondContact O-OG1 3.04Å; K353-T356 PolarHBondContact O-N 2.88Å; K353-T356 PolarHBondContact O-OG1 2.92Å; T356-I359 PolarHBondContact O-N 2.96Å; T356-K360 WeakPolarHBondContact O-CB 3.45Å; T356-K360 WeakPolarHBondContact O-CG 3.39Å; T356-K360 PolarHBondContact O-N 2.95Å
357	N	52.2	Low	51.9	Low	97 Å²	97	111.5 Å²	111.5	52%	0.519	53%	0.529	S	S	.	.	H	α-helix	trans	-69.7	-37.6	176.6	-73.7	-15.6	0	0	0	111.9	K353 S354 I355 M361	K353-N357 WeakPolarHBondContact O-CB 3.38Å; K353-N357 PolarHBondContact O-N 3.45Å; S354-N357 PolarHBondContact O-N 3.34Å; I355-N357 VanDerWaalsContact C-N 3.31Å; I355-N357 PolarHBondContact O-N 3.03Å; N357-M361 WeakPolarHBondContact O-CB 3.42Å; N357-M361 PolarHBondContact O-N 3.44Å
358	R	50.7	Low	52.5	Low	167 Å²	167	107.7 Å²	107.7	63%	0.63	51%	0.514	S	S	*	.	H	α-helix	trans	-63.6	-44.6	173	-73	-176.6	-176.1	-144	2.7	111.9	S354 I355 M361 N362	S354-R358 WeakPolarHBondContact O-CG 3.2Å; S354-R358 PolarHBondContact O-N 3.1Å; I355-R358 PolarHBondContact O-N 2.92Å; R358-M361 PolarHBondContact O-N 3.24Å; R358-N362 WeakPolarHBondContact O-CB 3.31Å; R358-N362 VanDerWaalsContact O-CG 3.26Å; R358-N362 PolarHBondContact O-N 3.04Å
359	I	54.7	Low	53.2	Low	81 Å²	81	102.9 Å²	102.9	42%	0.415	50%	0.497	S	S	.	.	H	α-helix	trans	-62.5	-47	177.1	-65.5	167.8	0	0	0	110.6	I355 T356 M361 N362 I363	I355-I359 HydrophobicContact CG2-CD1 3.81Å; I355-I359 HydrophobicContact CG2-CG1 4.45Å; I355-I359 WeakPolarHBondContact O-CG1 3.38Å; I355-I359 PolarHBondContact O-N 3.45Å; T356-I359 PolarHBondContact O-N 2.96Å; I359-M361 PolarHBondContact O-N 3.23Å; I359-N362 PolarHBondContact O-N 3.08Å; I359-I363 HydrophobicContact CG2-CD1 3.78Å; I359-I363 HydrophobicContact CG2-CG1 4.46Å; I359-I363 VanDerWaalsContact O-CG1 3.31Å; I359-I363 WeakPolarHBondContact O-CG1 3.48Å; I359-I363 PolarHBondContact O-N 3.27Å
360	K	47.8	Very low	54.2	Low	146 Å²	146	95.9 Å²	95.9	64%	0.635	47%	0.472	S	S	*	.	H	α-helix	trans	-59.9	-42.6	175.7	-75.7	-178.7	179.5	-175.4	0	112.3	T356 I363 S364	T356-K360 WeakPolarHBondContact O-CB 3.45Å; T356-K360 WeakPolarHBondContact O-CG 3.39Å; T356-K360 PolarHBondContact O-N 2.95Å; K360-I363 PolarHBondContact O-N 3.38Å; K360-S364 WeakPolarHBondContact O-CB 3.41Å; K360-S364 PolarHBondContact O-N 2.91Å
361	M	39.3	Very low	55.2	Low	121 Å²	121	93.7 Å²	93.7	60%	0.596	47%	0.466	S	S	*	.	H	α-helix	trans	-62.5	-45.2	174.1	-94.8	-151.4	-179.3	0	0	111.8	N357 R358 I359 I363 S364 I365	N357-M361 WeakPolarHBondContact O-CB 3.42Å; N357-M361 PolarHBondContact O-N 3.44Å; R358-M361 PolarHBondContact O-N 3.24Å; I359-M361 PolarHBondContact O-N 3.23Å; M361-I363 VanDerWaalsContact C-N 3.34Å; M361-I363 PolarHBondContact O-N 3.41Å; M361-S364 PolarHBondContact O-N 2.83Å; M361-I365 WeakPolarHBondContact O-CB 3.41Å; M361-I365 WeakPolarHBondContact O-CG1 3.32Å; M361-I365 PolarHBondContact O-N 3.45Å
362	N	49.1	Very low	56.3	Low	101 Å²	101	90.3 Å²	90.3	54%	0.54	45%	0.454	S	S	.	.	H	α-helix	trans	-62.7	-40.5	179.6	-73.2	-7.8	0	0	0	111.9	R358 I359 K366	R358-N362 WeakPolarHBondContact O-CB 3.31Å; R358-N362 VanDerWaalsContact O-CG 3.26Å; R358-N362 PolarHBondContact O-N 3.04Å; I359-N362 PolarHBondContact O-N 3.08Å; N362-K366 VanDerWaalsContact O-CB 3.27Å; N362-K366 WeakPolarHBondContact O-CB 3.43Å; N362-K366 PolarHBondContact O-N 3.21Å
363	I	57.2	Low	57.8	Low	75 Å²	75	84.6 Å²	84.6	39%	0.385	44%	0.435	S	S	.	.	H	α-helix	trans	-65.6	-44.1	174.3	-65.3	166.3	0	0	0	110.7	I359 K360 M361 K366 N367	I359-I363 HydrophobicContact CG2-CD1 3.78Å; I359-I363 HydrophobicContact CG2-CG1 4.46Å; I359-I363 VanDerWaalsContact O-CG1 3.31Å; I359-I363 WeakPolarHBondContact O-CG1 3.48Å; I359-I363 PolarHBondContact O-N 3.27Å; K360-I363 PolarHBondContact O-N 3.38Å; M361-I363 VanDerWaalsContact C-N 3.34Å; M361-I363 PolarHBondContact O-N 3.41Å; I363-K366 PolarHBondContact O-N 3.14Å; I363-N367 WeakPolarHBondContact O-CB 3.29Å; I363-N367 VanDerWaalsContact O-CG 3.23Å; I363-N367 PolarHBondContact O-N 3.12Å; I363-N367 PolarHBondContact O-OD1 3.14Å
364	S	42.5	Very low	59.2	Low	61 Å²	61	83.6 Å²	83.6	43%	0.427	43%	0.427	S	S	.	.	H	α-helix	trans	-62.6	-45.3	177.6	-179.3	0	0	0	0	111.9	K360 M361 N367 I368	K360-S364 WeakPolarHBondContact O-CB 3.41Å; K360-S364 PolarHBondContact O-N 2.91Å; M361-S364 PolarHBondContact O-N 2.83Å; S364-N367 PolarHBondContact O-N 3.2Å; S364-I368 WeakPolarHBondContact O-CB 3.21Å; S364-I368 WeakPolarHBondContact O-CD1 3.42Å; S364-I368 WeakPolarHBondContact O-CG1 3.33Å; S364-I368 PolarHBondContact O-N 2.94Å
365	I	56.1	Low	60.3	Low	62 Å²	62	85 Å²	85	32%	0.318	43%	0.425	S	S	.	.	H	α-helix	trans	-61.8	-45.7	175.4	-67.7	165	0	0	0	109.7	M361 N367 I368 T369 I497	M361-I365 WeakPolarHBondContact O-CB 3.41Å; M361-I365 WeakPolarHBondContact O-CG1 3.32Å; M361-I365 PolarHBondContact O-N 3.45Å; I365-N367 PolarHBondContact O-N 3.49Å; I365-I368 PolarHBondContact O-N 3.39Å; I365-T369 HydrophobicContact CG2-CG2 4.22Å; I365-T369 VanDerWaalsContact O-CG2 3.3Å; I365-T369 WeakPolarHBondContact O-CG2 3.29Å; I365-T369 PolarHBondContact O-N 2.91Å; I365-T369 PolarHBondContact O-OG1 3.41Å; I365-T369 VanDerWaalsContact O-OG1 3.13Å; I365-I497 HydrophobicContact CD1-CD1 4.34Å
366	K	60.4	Low	61.2	Low	86 Å²	86	82.7 Å²	82.7	37%	0.374	41%	0.413	S	S	.	.	H	α-helix	trans	-56.7	-51.7	175.7	-172.8	178.9	176.4	-176.7	0	110.9	N362 I363 I368 T369 E370	N362-K366 VanDerWaalsContact O-CB 3.27Å; N362-K366 WeakPolarHBondContact O-CB 3.43Å; N362-K366 PolarHBondContact O-N 3.21Å; I363-K366 PolarHBondContact O-N 3.14Å; K366-I368 VanDerWaalsContact C-N 3.33Å; K366-I368 PolarHBondContact O-N 3.47Å; K366-T369 WeakPolarHBondContact CA-OG1 3.39Å; K366-T369 PolarHBondContact O-N 3.05Å; K366-T369 VanDerWaalsContact O-N 3.15Å; K366-T369 PolarHBondContact O-OG1 3.35Å; K366-E370 WeakPolarHBondContact CE-OE1 3.36Å; K366-E370 HydrophobicContact CG-CG 4.39Å; K366-E370 WeakPolarHBondContact O-CB 3.41Å; K366-E370 VanDerWaalsContact O-CG 3.29Å; K366-E370 WeakPolarHBondContact O-CG 3.38Å; K366-E370 PolarHBondContact O-N 3.33Å
367	N	57.2	Low	62.5	Low	89 Å²	89	80.9 Å²	80.9	48%	0.476	40%	0.401	S	S	.	.	H	α-helix	trans	-60.9	-39.5	178.6	-68.7	-8.4	0	0	0	112.5	I363 S364 I365 S371	I363-N367 WeakPolarHBondContact O-CB 3.29Å; I363-N367 VanDerWaalsContact O-CG 3.23Å; I363-N367 PolarHBondContact O-N 3.12Å; I363-N367 PolarHBondContact O-OD1 3.14Å; S364-N367 PolarHBondContact O-N 3.2Å; I365-N367 PolarHBondContact O-N 3.49Å; N367-S371 WeakPolarHBondContact O-CB 3.27Å; N367-S371 PolarHBondContact O-N 3.41Å; N367-S371 PolarHBondContact O-OG 3.44Å
368	I	60.1	Low	64.1	Low	96 Å²	96	83.2 Å²	83.2	49%	0.492	40%	0.402	S	S	.	.	H	α-helix	trans	-63.9	-49.6	174.4	-69.2	164.4	0	0	0	109.8	S364 I365 K366 E370 S371 T372	S364-I368 WeakPolarHBondContact O-CB 3.21Å; S364-I368 WeakPolarHBondContact O-CD1 3.42Å; S364-I368 WeakPolarHBondContact O-CG1 3.33Å; S364-I368 PolarHBondContact O-N 2.94Å; I365-I368 PolarHBondContact O-N 3.39Å; K366-I368 VanDerWaalsContact C-N 3.33Å; K366-I368 PolarHBondContact O-N 3.47Å; I368-E370 VanDerWaalsContact C-N 3.31Å; I368-E370 PolarHBondContact O-N 3.37Å; I368-S371 PolarHBondContact O-N 3.19Å; I368-S371 PolarHBondContact O-OG 3.4Å; I368-T372 WeakPolarHBondContact O-CG2 3.28Å; I368-T372 PolarHBondContact O-N 2.9Å; I368-T372 PolarHBondContact O-OG1 3.46Å
369	T	66.5	Low	65.7	Low	71 Å²	71	76.5 Å²	76.5	44%	0.436	38%	0.381	S	S	.	.	H	α-helix	trans	-60.9	-40.3	179.3	56.5	0	0	0	0	112	I365 K366 T372 L373	I365-T369 HydrophobicContact CG2-CG2 4.22Å; I365-T369 VanDerWaalsContact O-CG2 3.3Å; I365-T369 WeakPolarHBondContact O-CG2 3.29Å; I365-T369 PolarHBondContact O-N 2.91Å; I365-T369 PolarHBondContact O-OG1 3.41Å; I365-T369 VanDerWaalsContact O-OG1 3.13Å; K366-T369 WeakPolarHBondContact CA-OG1 3.39Å; K366-T369 PolarHBondContact O-N 3.05Å; K366-T369 VanDerWaalsContact O-N 3.15Å; K366-T369 PolarHBondContact O-OG1 3.35Å; T369-T372 WeakPolarHBondContact CA-OG1 3.26Å; T369-T372 PolarHBondContact O-N 3.33Å; T369-T372 PolarHBondContact O-OG1 3.43Å; T369-L373 WeakPolarHBondContact O-CB 3.41Å; T369-L373 PolarHBondContact O-N 3.46Å
370	E	68.1	Low	67.4	Low	43 Å²	43	72.9 Å²	72.9	20%	0.201	36%	0.363	C	S	.	.	H	α-helix	trans	-64.5	-46.7	176	-72.4	-178.5	169.2	0	0	111.3	Q282 K366 I368 T372 L373 W374	Q282-E370 PolarHBondContact NE2-OE1 2.99Å; K366-E370 WeakPolarHBondContact CE-OE1 3.36Å; K366-E370 HydrophobicContact CG-CG 4.39Å; K366-E370 WeakPolarHBondContact O-CB 3.41Å; K366-E370 VanDerWaalsContact O-CG 3.29Å; K366-E370 WeakPolarHBondContact O-CG 3.38Å; K366-E370 PolarHBondContact O-N 3.33Å; I368-E370 VanDerWaalsContact C-N 3.31Å; I368-E370 PolarHBondContact O-N 3.37Å; E370-T372 VanDerWaalsContact C-N 3.27Å; E370-T372 PolarHBondContact O-N 2.69Å; E370-L373 PolarHBondContact O-N 3.37Å; E370-W374 PolarHBondContact O-N 3.42Å
371	S	71.4	Confident	69.3	Low	66 Å²	66	68.4 Å²	68.4	46%	0.462	35%	0.35	S	S	.	.	H	α-helix	trans	-60.7	-37.2	176.3	74	0	0	0	0	112.5	N367 I368 R375	N367-S371 WeakPolarHBondContact O-CB 3.27Å; N367-S371 PolarHBondContact O-N 3.41Å; N367-S371 PolarHBondContact O-OG 3.44Å; I368-S371 PolarHBondContact O-N 3.19Å; I368-S371 PolarHBondContact O-OG 3.4Å; S371-R375 PolarHBondContact O-N 3.43Å
372	T	74.1	Confident	71.8	Confident	49 Å²	49	63.1 Å²	63.1	30%	0.301	32%	0.324	S	S	.	.	H	α-helix	trans	-69.2	-43	174.8	55.3	0	0	0	0	111.8	I368 T369 E370 W374 R375 E376	I368-T372 WeakPolarHBondContact O-CG2 3.28Å; I368-T372 PolarHBondContact O-N 2.9Å; I368-T372 PolarHBondContact O-OG1 3.46Å; T369-T372 WeakPolarHBondContact CA-OG1 3.26Å; T369-T372 PolarHBondContact O-N 3.33Å; T369-T372 PolarHBondContact O-OG1 3.43Å; E370-T372 VanDerWaalsContact C-N 3.27Å; E370-T372 PolarHBondContact O-N 2.69Å; T372-W374 PolarHBondContact O-N 3.34Å; T372-R375 WeakPolarHBondContact O-CB 3.34Å; T372-R375 PolarHBondContact O-N 2.93Å; T372-E376 WeakPolarHBondContact O-CG 3.34Å; T372-E376 PolarHBondContact O-N 3.45Å
373	L	79.4	Confident	73.7	Confident	38 Å²	38	58.5 Å²	58.5	20%	0.199	30%	0.299	C	S	.	.	H	α-helix	trans	-61.5	-45.7	177.8	178	65.1	0	0	0	111.2	I180 T278 T369 E370 R375 E376 I377	I180-L373 HydrophobicContact CG2-CD1 4.11Å; T278-L373 HydrophobicContact CG2-CD2 3.77Å; T369-L373 WeakPolarHBondContact O-CB 3.41Å; T369-L373 PolarHBondContact O-N 3.46Å; E370-L373 PolarHBondContact O-N 3.37Å; L373-R375 PolarHBondContact O-N 3.09Å; L373-E376 CarbonylContact O-C 3.49Å; L373-E376 PolarHBondContact O-N 3.41Å; L373-I377 HydrophobicContact CD1-CD1 4.25Å; L373-I377 HydrophobicContact CD1-CG1 4.27Å; L373-I377 HydrophobicContact CD2-CD1 4.38Å; L373-I377 HydrophobicContact CG-CD1 3.85Å; L373-I377 HydrophobicContact CG-CG1 4.31Å; L373-I377 WeakPolarHBondContact O-CG1 3.4Å; L373-I377 PolarHBondContact O-N 2.9Å
374	W	79.8	Confident	75.4	Confident	118 Å²	118	58.6 Å²	58.6	45%	0.447	30%	0.297	S	S	.	.	H	α-helix	trans	-59.7	-33.9	176.9	-81.4	114.1	0	0	0	113	E370 T372 I377 R378	E370-W374 PolarHBondContact O-N 3.42Å; T372-W374 PolarHBondContact O-N 3.34Å; W374-I377 HydrophobicContact CE3-CD1 4.39Å; W374-R378 WeakPolarHBondContact O-CB 3.49Å; W374-R378 PolarHBondContact O-N 3.48Å; W374-R378 VanDerWaalsContact O-N 3.08Å
375	R	78.1	Confident	77.9	Confident	76 Å²	76	57.9 Å²	57.9	29%	0.287	29%	0.29	S	S	.	.	H	α-helix	trans	-68.9	-42.5	173.3	-172.7	-177	64.7	-170.2	-4.7	111.7	S371 T372 L373 R378 S379	S371-R375 PolarHBondContact O-N 3.43Å; T372-R375 WeakPolarHBondContact O-CB 3.34Å; T372-R375 PolarHBondContact O-N 2.93Å; L373-R375 PolarHBondContact O-N 3.09Å; R375-R378 PolarHBondContact O-N 3.15Å; R375-S379 PolarHBondContact O-N 2.6Å; R375-S379 PolarHBondContact O-OG 3.02Å
376	E	83.1	Confident	79.7	Confident	31 Å²	31	55 Å²	55	15%	0.145	28%	0.275	C	S	.	.	H	α-helix	trans	-68	-36	176.5	-61.5	-47	134.9	0	0	112.6	R176 T179 I180 T372 L373 S379 A380	R176-E376 IonicContact NH1-OE2 3.39Å; R176-E376 PolarHBondContact NH1-OE2 2.96Å; T179-E376 HydrophobicContact CG2-CG 4.14Å; I180-E376 HydrophobicContact CG1-CB 4.09Å; T372-E376 WeakPolarHBondContact O-CG 3.34Å; T372-E376 PolarHBondContact O-N 3.45Å; L373-E376 CarbonylContact O-C 3.49Å; L373-E376 PolarHBondContact O-N 3.41Å; E376-S379 WeakPolarHBondContact CA-OG 3.34Å; E376-S379 PolarHBondContact O-N 3.25Å; E376-S379 PolarHBondContact O-OG 3.24Å; E376-A380 VanDerWaalsContact O-CB 3.29Å; E376-A380 WeakPolarHBondContact O-CB 3.38Å; E376-A380 PolarHBondContact O-N 3.07Å
377	I	84.8	Confident	81.4	Confident	25 Å²	25	51 Å²	51	13%	0.128	26%	0.259	C	S	.	.	H	α-helix	trans	-62.6	-47.7	172.9	-68.7	167.5	0	0	0	109.6	V275 L373 W374 S379 A380 S381	V275-I377 HydrophobicContact CB-CD1 4.43Å; V275-I377 HydrophobicContact CG1-CD1 3.97Å; V275-I377 HydrophobicContact CG2-CD1 3.67Å; V275-I377 HydrophobicContact CG2-CG1 3.79Å; L373-I377 HydrophobicContact CD1-CD1 4.25Å; L373-I377 HydrophobicContact CD1-CG1 4.27Å; L373-I377 HydrophobicContact CD2-CD1 4.38Å; L373-I377 HydrophobicContact CG-CD1 3.85Å; L373-I377 HydrophobicContact CG-CG1 4.31Å; L373-I377 WeakPolarHBondContact O-CG1 3.4Å; L373-I377 PolarHBondContact O-N 2.9Å; W374-I377 HydrophobicContact CE3-CD1 4.39Å; I377-S379 VanDerWaalsContact C-N 3.33Å; I377-S379 PolarHBondContact O-N 3.32Å; I377-A380 PolarHBondContact O-N 3.47Å; I377-S381 PolarHBondContact O-N 3.41Å; I377-S381 PolarHBondContact O-OG 3.01Å
378	R	86	Confident	83.2	Confident	146 Å²	146	49.1 Å²	49.1	55%	0.551	25%	0.25	S	S	*	.	H	α-helix	trans	-60.4	-42.3	178.7	-179.3	178.5	-83.9	114.3	-4.9	111.8	W374 R375 S381 V382	W374-R378 WeakPolarHBondContact O-CB 3.49Å; W374-R378 PolarHBondContact O-N 3.48Å; W374-R378 VanDerWaalsContact O-N 3.08Å; R375-R378 PolarHBondContact O-N 3.15Å; R378-S381 PolarHBondContact O-N 2.64Å; R378-V382 WeakPolarHBondContact O-CG2 3.22Å; R378-V382 PolarHBondContact O-N 2.91Å
379	S	85	Confident	84.9	Confident	26 Å²	26	46 Å²	46	18%	0.182	24%	0.236	C	C	.	.	H	α-helix	trans	-67.9	-37.6	176.4	64.4	0	0	0	0	112	R176 R375 E376 I377 V382 L383	R176-S379 PolarHBondContact NH1-OG 3.49Å; R176-S379 VanDerWaalsContact NH1-OG 3.1Å; R375-S379 PolarHBondContact O-N 2.6Å; R375-S379 PolarHBondContact O-OG 3.02Å; E376-S379 WeakPolarHBondContact CA-OG 3.34Å; E376-S379 PolarHBondContact O-N 3.25Å; E376-S379 PolarHBondContact O-OG 3.24Å; I377-S379 VanDerWaalsContact C-N 3.33Å; I377-S379 PolarHBondContact O-N 3.32Å; S379-V382 PolarHBondContact O-N 2.91Å; S379-L383 PolarHBondContact O-N 3.23Å; S379-L383 VanDerWaalsContact O-N 3.17Å
380	A	88.9	Confident	86.3	Confident	4 Å²	4	42.8 Å²	42.8	3%	0.033	22%	0.216	C	C	.	.	H	α-helix	trans	-64.8	-37.5	173.6	0	0	0	0	0	113.1	R176 I180 E376 I377 V382 L383 F384	R176-A380 HydrophobicContact CB-CB 4.36Å; R176-A380 HydrophobicContact CG-CB 4.18Å; I180-A380 HydrophobicContact CD1-CB 3.47Å; I180-A380 VanDerWaalsContact CD1-CB 3.47Å; E376-A380 VanDerWaalsContact O-CB 3.29Å; E376-A380 WeakPolarHBondContact O-CB 3.38Å; E376-A380 PolarHBondContact O-N 3.07Å; I377-A380 PolarHBondContact O-N 3.47Å; A380-V382 VanDerWaalsContact C-N 3.33Å; A380-V382 PolarHBondContact O-N 2.88Å; A380-L383 PolarHBondContact O-N 2.81Å; A380-F384 WeakPolarHBondContact O-CB 3.47Å; A380-F384 PolarHBondContact O-N 2.95Å
381	S	89.2	Confident	87.7	Confident	53 Å²	53	42.2 Å²	42.2	37%	0.371	21%	0.214	S	C	.	.	H	α-helix	trans	-62.3	-39.4	174.3	-57	0	0	0	0	112.2	I377 R378 F384 V385	I377-S381 PolarHBondContact O-N 3.41Å; I377-S381 PolarHBondContact O-OG 3.01Å; R378-S381 PolarHBondContact O-N 2.64Å; S381-F384 WeakPolarHBondContact O-CB 3.31Å; S381-F384 PolarHBondContact O-N 3.43Å; S381-V385 WeakPolarHBondContact O-CG2 3.29Å; S381-V385 PolarHBondContact O-N 2.76Å
382	V	90.3	Very high	88.9	Confident	10 Å²	10	44.3 Å²	44.3	6%	0.061	22%	0.218	C	C	.	.	H	α-helix	trans	-62.1	-49.8	175.3	175.8	0	0	0	0	110.4	R378 S379 A380 F384 V385 V386 I425 Y426 M429	R378-V382 WeakPolarHBondContact O-CG2 3.22Å; R378-V382 PolarHBondContact O-N 2.91Å; S379-V382 PolarHBondContact O-N 2.91Å; A380-V382 VanDerWaalsContact C-N 3.33Å; A380-V382 PolarHBondContact O-N 2.88Å; V382-F384 VanDerWaalsContact C-N 3.29Å; V382-F384 PolarHBondContact O-N 2.95Å; V382-V385 PolarHBondContact O-N 3.42Å; V382-V386 PolarHBondContact O-N 3.32Å; V382-V386 VanDerWaalsContact O-N 3.13Å; V382-I425 HydrophobicContact CG1-CG2 4.06Å; V382-Y426 HydrophobicContact CG1-CD1 3.73Å; V382-Y426 HydrophobicContact CG1-CE1 3.68Å; V382-M429 HydrophobicContact CG2-CB 3.77Å; V382-M429 HydrophobicContact CG2-CE 4.42Å
383	L	90.3	Very high	89.9	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.016	21%	0.209	C	C	.	.	H	α-helix	trans	-69.1	-27.1	-179.1	-68.1	167.5	0	0	0	112.8	I117 L120 I172 R176 S379 A380 V386 A387	I117-L383 HydrophobicContact CG1-CD2 4.42Å; L120-L383 HydrophobicContact CD1-CD2 4.16Å; I172-L383 HydrophobicContact CG2-CB 3.89Å; I172-L383 HydrophobicContact CG2-CD1 3.95Å; I172-L383 HydrophobicContact CG2-CD2 4.03Å; I172-L383 HydrophobicContact CG2-CG 4.16Å; R176-L383 HydrophobicContact CG-CD1 4.09Å; S379-L383 PolarHBondContact O-N 3.23Å; S379-L383 VanDerWaalsContact O-N 3.17Å; A380-L383 PolarHBondContact O-N 2.81Å; L383-V386 WeakPolarHBondContact O-CB 3.36Å; L383-V386 PolarHBondContact O-N 2.92Å; L383-A387 PolarHBondContact O-N 3.12Å
384	F	93.1	Very high	90.7	Very high	77 Å²	77	41.7 Å²	41.7	34%	0.338	20%	0.203	S	C	.	.	H	α-helix	trans	-63	-46.1	170.7	178.1	-112.9	0	0	0	111.1	V264 Y268 A380 S381 V382 V386 A387 V388	V264-F384 HydrophobicContact CG1-CE2 4.43Å; Y268-F384 HydrophobicContact CD1-CB 3.91Å; Y268-F384 AromaticContact CD1-CD2 3.53Å; Y268-F384 HydrophobicContact CD1-CD2 3.53Å; Y268-F384 HydrophobicContact CD1-CE2 4.4Å; Y268-F384 HydrophobicContact CD1-CG 4.01Å; Y268-F384 AromaticContact CD2-CD2 3.68Å; Y268-F384 HydrophobicContact CD2-CD2 3.68Å; Y268-F384 HydrophobicContact CD2-CE2 4.3Å; Y268-F384 HydrophobicContact CE1-CB 3.47Å; Y268-F384 VanDerWaalsContact CE1-CB 3.47Å; Y268-F384 AromaticContact CE1-CD2 3.87Å; Y268-F384 HydrophobicContact CE1-CD2 3.87Å; Y268-F384 HydrophobicContact CE1-CG 4.07Å; Y268-F384 HydrophobicContact CE2-CB 4.49Å; Y268-F384 AromaticContact CE2-CD2 3.99Å; Y268-F384 HydrophobicContact CE2-CD2 3.99Å; Y268-F384 AromaticContact CG-CD2 3.42Å; Y268-F384 HydrophobicContact CG-CD2 3.42Å; Y268-F384 VanDerWaalsContact CG-CD2 3.42Å; Y268-F384 AromaticContact CG-CE2 3.98Å; Y268-F384 HydrophobicContact CG-CE2 3.98Å; Y268-F384 HydrophobicContact CG-CG 4.34Å; Y268-F384 WeakPolarHBondContact OH-CA 3.02Å; Y268-F384 PolarHBondContact OH-N 2.87Å; Y268-F384 VanDerWaalsContact OH-N 3.15Å; A380-F384 WeakPolarHBondContact O-CB 3.47Å; A380-F384 PolarHBondContact O-N 2.95Å; S381-F384 WeakPolarHBondContact O-CB 3.31Å; S381-F384 PolarHBondContact O-N 3.43Å; V382-F384 VanDerWaalsContact C-N 3.29Å; V382-F384 PolarHBondContact O-N 2.95Å; F384-V386 VanDerWaalsContact C-N 3.3Å; F384-V386 PolarHBondContact O-N 2.99Å; F384-A387 WeakPolarHBondContact O-CB 3.34Å; F384-A387 PolarHBondContact O-N 2.95Å; F384-A387 VanDerWaalsContact O-N 3.13Å; F384-V388 HydrophobicContact CD1-CG2 4.23Å; F384-V388 HydrophobicContact CD2-CG2 4.35Å; F384-V388 HydrophobicContact CE1-CG2 3.79Å; F384-V388 HydrophobicContact CE2-CG2 3.93Å; F384-V388 HydrophobicContact CG-CG2 4.5Å; F384-V388 HydrophobicContact CZ-CG2 3.63Å; F384-V388 WeakPolarHBondContact O-CG2 3.41Å; F384-V388 PolarHBondContact O-N 2.68Å
385	V	94.7	Very high	91.4	Very high	46 Å²	46	38.3 Å²	38.3	28%	0.279	20%	0.195	S	C	.	.	H	α-helix	trans	-64	-38.1	177.8	172.7	0	0	0	0	111.1	S381 V382 A387 V388 V389 I425 M429	S381-V385 WeakPolarHBondContact O-CG2 3.29Å; S381-V385 PolarHBondContact O-N 2.76Å; V382-V385 PolarHBondContact O-N 3.42Å; V385-A387 VanDerWaalsContact C-N 3.34Å; V385-A387 PolarHBondContact O-N 3.04Å; V385-V388 PolarHBondContact O-N 3.35Å; V385-V389 HydrophobicContact CG1-CG2 4.38Å; V385-V389 WeakPolarHBondContact O-CG2 3.12Å; V385-V389 PolarHBondContact O-N 2.98Å; V385-I425 HydrophobicContact CB-CG2 4.36Å; V385-I425 HydrophobicContact CG1-CD1 4.25Å; V385-I425 HydrophobicContact CG1-CG1 4.2Å; V385-I425 HydrophobicContact CG1-CG2 4.09Å; V385-M429 HydrophobicContact CB-CE 4.22Å; V385-M429 HydrophobicContact CB-SD 3.65Å; V385-M429 HydrophobicContact CG1-SD 3.86Å; V385-M429 HydrophobicContact CG2-CE 3.57Å; V385-M429 HydrophobicContact CG2-SD 3.55Å; V385-M429 VanDerWaalsContact CG2-SD 3.55Å
386	V	94.1	Very high	92.2	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.006	19%	0.193	C	C	.	.	H	α-helix	trans	-55.9	-48.5	170.8	173.1	0	0	0	0	111.1	L120 I169 V382 L383 F384 V388 V389 Y390 N422 I425	L120-V386 HydrophobicContact CD1-CG1 4.31Å; I169-V386 HydrophobicContact CD1-CG1 4.22Å; V382-V386 PolarHBondContact O-N 3.32Å; V382-V386 VanDerWaalsContact O-N 3.13Å; L383-V386 WeakPolarHBondContact O-CB 3.36Å; L383-V386 PolarHBondContact O-N 2.92Å; F384-V386 VanDerWaalsContact C-N 3.3Å; F384-V386 PolarHBondContact O-N 2.99Å; V386-V388 PolarHBondContact O-N 3.33Å; V386-V389 PolarHBondContact O-N 3.29Å; V386-Y390 PolarHBondContact O-N 3.37Å; V386-N422 WeakPolarHBondContact CG1-OD1 3.2Å; V386-I425 HydrophobicContact CB-CD1 4.39Å; V386-I425 HydrophobicContact CG2-CD1 3.79Å; V386-I425 HydrophobicContact CG2-CG2 4.15Å
387	A	94.9	Very high	92.7	Very high	3 Å²	3	35.1 Å²	35.1	3%	0.025	19%	0.188	C	C	.	.	H	α-helix	trans	-64.6	-39	178.5	0	0	0	0	0	113.1	I169 V264 L383 F384 V385 Y390 I391	I169-A387 HydrophobicContact CG2-CB 4.02Å; V264-A387 HydrophobicContact CG1-CB 3.98Å; V264-A387 HydrophobicContact CG2-CB 3.89Å; L383-A387 PolarHBondContact O-N 3.12Å; F384-A387 WeakPolarHBondContact O-CB 3.34Å; F384-A387 PolarHBondContact O-N 2.95Å; F384-A387 VanDerWaalsContact O-N 3.13Å; V385-A387 VanDerWaalsContact C-N 3.34Å; V385-A387 PolarHBondContact O-N 3.04Å; A387-Y390 WeakPolarHBondContact O-CB 3.46Å; A387-Y390 PolarHBondContact O-N 2.84Å; A387-I391 VanDerWaalsContact O-CG1 3.28Å; A387-I391 WeakPolarHBondContact O-CG1 3.26Å; A387-I391 PolarHBondContact O-N 3.32Å
388	V	95.7	Very high	93.2	Very high	49 Å²	49	35.2 Å²	35.2	30%	0.297	19%	0.188	S	C	.	.	H	α-helix	trans	-64.9	-44.9	176.7	170.5	0	0	0	0	111.1	F384 V385 V386 Y390 I391 I392	F384-V388 HydrophobicContact CD1-CG2 4.23Å; F384-V388 HydrophobicContact CD2-CG2 4.35Å; F384-V388 HydrophobicContact CE1-CG2 3.79Å; F384-V388 HydrophobicContact CE2-CG2 3.93Å; F384-V388 HydrophobicContact CG-CG2 4.5Å; F384-V388 HydrophobicContact CZ-CG2 3.63Å; F384-V388 WeakPolarHBondContact O-CG2 3.41Å; F384-V388 PolarHBondContact O-N 2.68Å; V385-V388 PolarHBondContact O-N 3.35Å; V386-V388 PolarHBondContact O-N 3.33Å; V388-Y390 VanDerWaalsContact C-N 3.34Å; V388-Y390 PolarHBondContact O-N 3.4Å; V388-I391 PolarHBondContact O-N 2.89Å; V388-I392 HydrophobicContact CG1-CD1 3.75Å; V388-I392 HydrophobicContact CG1-CG1 4.44Å; V388-I392 WeakPolarHBondContact O-CG1 3.41Å; V388-I392 PolarHBondContact O-N 3.26Å
389	V	96.4	Very high	93.6	Very high	32 Å²	32	30.9 Å²	30.9	19%	0.194	18%	0.176	C	C	.	.	H	α-helix	trans	-60.2	-46.7	176.5	170.8	0	0	0	0	110.2	V385 V386 I391 I392 V393 I425	V385-V389 HydrophobicContact CG1-CG2 4.38Å; V385-V389 WeakPolarHBondContact O-CG2 3.12Å; V385-V389 PolarHBondContact O-N 2.98Å; V386-V389 PolarHBondContact O-N 3.29Å; V389-I391 VanDerWaalsContact C-N 3.35Å; V389-I391 PolarHBondContact O-N 3.01Å; V389-I392 PolarHBondContact O-N 3.49Å; V389-V393 HydrophobicContact CG1-CG1 4.28Å; V389-V393 VanDerWaalsContact O-CG2 3.28Å; V389-V393 WeakPolarHBondContact O-CG2 3.47Å; V389-V393 PolarHBondContact O-N 3.44Å; V389-I425 HydrophobicContact CB-CD1 4.44Å; V389-I425 HydrophobicContact CG2-CD1 4.12Å
390	Y	95.7	Very high	93.9	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.008	17%	0.17	C	C	.	.	H	α-helix	trans	-51.7	-50.7	174.1	171.8	-104.7	0	0	0	112	S166 I169 F257 V386 A387 V388 I392 F394 N418	S166-Y390 WeakPolarHBondContact CA-OH 3.28Å; S166-Y390 WeakPolarHBondContact CB-OH 3.22Å; S166-Y390 PolarHBondContact N-OH 2.87Å; I169-Y390 HydrophobicContact CG1-CD1 3.99Å; I169-Y390 HydrophobicContact CG1-CE1 4.31Å; I169-Y390 HydrophobicContact CG1-CG 4.11Å; I169-Y390 HydrophobicContact CG2-CD1 4.46Å; F257-Y390 AromaticContact CD2-CE1 3.7Å; F257-Y390 HydrophobicContact CD2-CE1 3.7Å; F257-Y390 AromaticContact CD2-CZ 3.78Å; F257-Y390 WeakPolarHBondContact CD2-OH 2.97Å; F257-Y390 HydrophobicContact CE2-CD1 4.15Å; F257-Y390 AromaticContact CE2-CE1 3.51Å; F257-Y390 HydrophobicContact CE2-CE1 3.51Å; F257-Y390 AromaticContact CE2-CZ 3.81Å; V386-Y390 PolarHBondContact O-N 3.37Å; A387-Y390 WeakPolarHBondContact O-CB 3.46Å; A387-Y390 PolarHBondContact O-N 2.84Å; V388-Y390 VanDerWaalsContact C-N 3.34Å; V388-Y390 PolarHBondContact O-N 3.4Å; Y390-I392 PolarHBondContact O-N 2.93Å; Y390-F394 HydrophobicContact CD2-CD2 4.43Å; Y390-F394 AromaticContact CE2-CD2 3.71Å; Y390-F394 HydrophobicContact CE2-CD2 3.71Å; Y390-F394 HydrophobicContact CE2-CE2 4.32Å; Y390-F394 HydrophobicContact CE2-CG 4.26Å; Y390-F394 WeakPolarHBondContact O-CB 3.35Å; Y390-F394 PolarHBondContact O-N 3.46Å; Y390-N418 WeakPolarHBondContact CB-OD1 3.36Å
391	I	96	Very high	93.9	Very high	32 Å²	32	31.7 Å²	31.7	16%	0.164	18%	0.183	C	C	.	.	H	α-helix	trans	-60.3	-47.3	-179.7	-66.9	167.6	0	0	0	111	I261 V264 A387 V388 V389 F394 T395	I261-I391 HydrophobicContact CD1-CG2 4.27Å; I261-I391 HydrophobicContact CG1-CD1 4.08Å; I261-I391 HydrophobicContact CG1-CG1 3.88Å; I261-I391 HydrophobicContact CG1-CG2 4.04Å; V264-I391 HydrophobicContact CB-CD1 4.37Å; V264-I391 HydrophobicContact CG1-CD1 4.19Å; A387-I391 VanDerWaalsContact O-CG1 3.28Å; A387-I391 WeakPolarHBondContact O-CG1 3.26Å; A387-I391 PolarHBondContact O-N 3.32Å; V388-I391 PolarHBondContact O-N 2.89Å; V389-I391 VanDerWaalsContact C-N 3.35Å; V389-I391 PolarHBondContact O-N 3.01Å; I391-F394 PolarHBondContact O-N 3.5Å; I391-T395 WeakPolarHBondContact O-CB 3.37Å; I391-T395 PolarHBondContact O-N 2.79Å; I391-T395 PolarHBondContact O-OG1 3.3Å
392	I	96.6	Very high	94	Very high	109 Å²	109	32.1 Å²	32.1	56%	0.559	18%	0.181	S	C	*	.	H	α-helix	trans	-61.5	-51.2	-177.1	-68.7	168	0	0	0	110.9	V388 V389 Y390 F394 P396	V388-I392 HydrophobicContact CG1-CD1 3.75Å; V388-I392 HydrophobicContact CG1-CG1 4.44Å; V388-I392 WeakPolarHBondContact O-CG1 3.41Å; V388-I392 PolarHBondContact O-N 3.26Å; V389-I392 PolarHBondContact O-N 3.49Å; Y390-I392 PolarHBondContact O-N 2.93Å; I392-F394 VanDerWaalsContact C-N 3.3Å; I392-F394 PolarHBondContact O-N 2.95Å; I392-P396 WeakPolarHBondContact O-CD 3.36Å
393	V	96.5	Very high	94	Very high	17 Å²	17	41 Å²	41	10%	0.103	22%	0.219	C	C	.	.	H	α-helix	trans	-74.3	-22.4	-174	-57.3	0	0	0	0	112.8	V389 T414 Y415 L417 N418	V389-V393 HydrophobicContact CG1-CG1 4.28Å; V389-V393 VanDerWaalsContact O-CG2 3.28Å; V389-V393 WeakPolarHBondContact O-CG2 3.47Å; V389-V393 PolarHBondContact O-N 3.44Å; V393-T414 CarbonylContact O-C 3.58Å; V393-T414 PolarHBondContact O-OG1 2.82Å; V393-T414 VanDerWaalsContact O-OG1 3.12Å; V393-Y415 VanDerWaalsContact O-CA 3.23Å; V393-Y415 WeakPolarHBondContact O-CA 3.49Å; V393-Y415 PolarHBondContact O-N 2.87Å; V393-Y415 VanDerWaalsContact O-N 3.15Å; V393-L417 HydrophobicContact CB-CB 4.35Å; V393-L417 HydrophobicContact CG1-CB 3.97Å; V393-L417 HydrophobicContact CG1-CD1 4.4Å; V393-N418 HydrophobicContact CG2-CB 3.83Å
394	F	95.3	Very high	94.2	Very high	15 Å²	15	46.6 Å²	46.6	7%	0.066	25%	0.248	C	C	.	.	H	α-helix	trans	-90.1	-21.6	-179.8	-153.5	-76.1	0	0	0	112.9	I162 F257 Y390 I391 I392 A397 L398 Y415	I162-F394 HydrophobicContact CB-CZ 4.15Å; I162-F394 HydrophobicContact CD1-CZ 4.29Å; I162-F394 HydrophobicContact CG1-CE2 4.05Å; I162-F394 HydrophobicContact CG1-CZ 3.8Å; I162-F394 HydrophobicContact CG2-CE1 4.38Å; I162-F394 HydrophobicContact CG2-CE2 4.31Å; I162-F394 HydrophobicContact CG2-CZ 3.55Å; F257-F394 HydrophobicContact CD1-CD1 4.23Å; F257-F394 HydrophobicContact CD2-CB 4.3Å; F257-F394 AromaticContact CD2-CD1 3.43Å; F257-F394 HydrophobicContact CD2-CD1 3.43Å; F257-F394 VanDerWaalsContact CD2-CD1 3.43Å; F257-F394 AromaticContact CD2-CE1 3.98Å; F257-F394 HydrophobicContact CD2-CE1 3.98Å; F257-F394 AromaticContact CD2-CG 3.91Å; F257-F394 HydrophobicContact CD2-CG 3.91Å; F257-F394 HydrophobicContact CE1-CD1 4.16Å; F257-F394 HydrophobicContact CE2-CB 3.43Å; F257-F394 VanDerWaalsContact CE2-CB 3.43Å; F257-F394 AromaticContact CE2-CD1 3.4Å; F257-F394 HydrophobicContact CE2-CD1 3.4Å; F257-F394 VanDerWaalsContact CE2-CD1 3.4Å; F257-F394 HydrophobicContact CE2-CE1 4.38Å; F257-F394 AromaticContact CE2-CG 3.53Å; F257-F394 HydrophobicContact CE2-CG 3.53Å; F257-F394 AromaticContact CG-CD1 3.86Å; F257-F394 HydrophobicContact CG-CD1 3.86Å; F257-F394 HydrophobicContact CG-CE1 4.19Å; F257-F394 HydrophobicContact CZ-CB 3.65Å; F257-F394 AromaticContact CZ-CD1 3.77Å; F257-F394 HydrophobicContact CZ-CD1 3.77Å; F257-F394 HydrophobicContact CZ-CG 4.05Å; Y390-F394 HydrophobicContact CD2-CD2 4.43Å; Y390-F394 AromaticContact CE2-CD2 3.71Å; Y390-F394 HydrophobicContact CE2-CD2 3.71Å; Y390-F394 HydrophobicContact CE2-CE2 4.32Å; Y390-F394 HydrophobicContact CE2-CG 4.26Å; Y390-F394 WeakPolarHBondContact O-CB 3.35Å; Y390-F394 PolarHBondContact O-N 3.46Å; I391-F394 PolarHBondContact O-N 3.5Å; I392-F394 VanDerWaalsContact C-N 3.3Å; I392-F394 PolarHBondContact O-N 2.95Å; F394-A397 PolarHBondContact O-N 3.21Å; F394-L398 PolarHBondContact O-N 2.92Å; F394-Y415 HydrophobicContact CD2-CG 4.23Å; F394-Y415 HydrophobicContact CE2-CD2 4.21Å; F394-Y415 HydrophobicContact CE2-CG 4.16Å
395	T	95.3	Very high	94.2	Very high	48 Å²	48	46.5 Å²	46.5	29%	0.294	25%	0.25	S	S	.	.	H	α-helix	trans	-55.3	-46.5	-178.9	-65.3	0	0	0	0	113.5	I391 A397 L398 L399	I391-T395 WeakPolarHBondContact O-CB 3.37Å; I391-T395 PolarHBondContact O-N 2.79Å; I391-T395 PolarHBondContact O-OG1 3.3Å; T395-A397 VanDerWaalsContact C-N 3.31Å; T395-A397 PolarHBondContact O-N 2.74Å; T395-L398 WeakPolarHBondContact O-CB 3.17Å; T395-L398 PolarHBondContact O-N 2.89Å; T395-L399 HydrophobicContact CG2-CD1 3.91Å; T395-L399 HydrophobicContact CG2-CG 4.16Å; T395-L399 WeakPolarHBondContact O-CG 3.4Å; T395-L399 PolarHBondContact O-N 3.05Å
396	P	95.2	Very high	94.1	Very high	35 Å²	35	53.6 Å²	53.6	23%	0.227	28%	0.277	C	S	.	.	H	α-helix	trans	-61.5	-38.9	180	-23.2	34.4	0	0	0	113	I392 L399 T400 A411	I392-P396 WeakPolarHBondContact O-CD 3.36Å; P396-L399 PolarHBondContact O-N 2.66Å; P396-T400 WeakPolarHBondContact O-CB 3.49Å; P396-T400 PolarHBondContact O-N 3.14Å; P396-T400 PolarHBondContact O-OG1 3.41Å; P396-A411 HydrophobicContact CB-CB 4.05Å; P396-A411 WeakPolarHBondContact CB-O 3.16Å
397	A	93.4	Very high	94	Very high	5 Å²	5	59.5 Å²	59.5	4%	0.041	30%	0.303	C	S	.	.	H	α-helix	trans	-64.5	-44.2	176	0	0	0	0	0	111.5	F394 T395 L399 T400 A401 Y412 Y415	F394-A397 PolarHBondContact O-N 3.21Å; T395-A397 VanDerWaalsContact C-N 3.31Å; T395-A397 PolarHBondContact O-N 2.74Å; A397-L399 PolarHBondContact O-N 3.07Å; A397-T400 PolarHBondContact O-N 3.46Å; A397-A401 VanDerWaalsContact O-CB 3.22Å; A397-A401 WeakPolarHBondContact O-CB 3.26Å; A397-A401 PolarHBondContact O-N 3.21Å; A397-Y412 HydrophobicContact CB-CD2 4.18Å; A397-Y412 HydrophobicContact CB-CE2 4.42Å; A397-Y415 HydrophobicContact CB-CD1 3.85Å
398	L	93.6	Very high	93.9	Very high	26 Å²	26	62.3 Å²	62.3	14%	0.136	32%	0.318	C	S	.	.	H	α-helix	trans	-57.9	-50.7	175.3	-177.6	81.4	0	0	0	111.9	T254 F257 F394 T395 T400 A401 N402	T254-L398 HydrophobicContact CG2-CD1 3.98Å; F257-L398 HydrophobicContact CB-CD1 4.23Å; F257-L398 HydrophobicContact CD1-CB 4.11Å; F257-L398 HydrophobicContact CD1-CD1 3.63Å; F257-L398 HydrophobicContact CD1-CD2 3.57Å; F257-L398 HydrophobicContact CD1-CG 3.94Å; F257-L398 HydrophobicContact CE1-CB 4.1Å; F257-L398 HydrophobicContact CE1-CD1 4.43Å; F257-L398 HydrophobicContact CE1-CD2 3.72Å; F257-L398 HydrophobicContact CE1-CG 4.27Å; F257-L398 HydrophobicContact CG-CD1 4.26Å; F394-L398 PolarHBondContact O-N 2.92Å; T395-L398 WeakPolarHBondContact O-CB 3.17Å; T395-L398 PolarHBondContact O-N 2.89Å; L398-T400 VanDerWaalsContact C-N 3.3Å; L398-T400 PolarHBondContact O-N 2.88Å; L398-A401 PolarHBondContact O-N 3.49Å; L398-N402 PolarHBondContact O-N 3.36Å; L398-N402 VanDerWaalsContact O-N 3.11Å; L398-N402 PolarHBondContact O-ND2 3.03Å
399	L	95	Very high	93.7	Very high	55 Å²	55	61.3 Å²	61.3	29%	0.288	31%	0.311	S	S	.	.	H	α-helix	trans	-62.9	-40.3	-177.6	-67	177.7	0	0	0	111	T395 P396 A397 K403 L404 I405	T395-L399 HydrophobicContact CG2-CD1 3.91Å; T395-L399 HydrophobicContact CG2-CG 4.16Å; T395-L399 WeakPolarHBondContact O-CG 3.4Å; T395-L399 PolarHBondContact O-N 3.05Å; P396-L399 PolarHBondContact O-N 2.66Å; A397-L399 PolarHBondContact O-N 3.07Å; L399-K403 PolarHBondContact O-N 3.46Å; L399-L404 HydrophobicContact CB-CB 4.42Å; L399-L404 HydrophobicContact CD2-CB 4.22Å; L399-L404 HydrophobicContact CD2-CD1 3.72Å; L399-L404 WeakPolarHBondContact O-CB 3.35Å; L399-L404 PolarHBondContact O-N 3.06Å; L399-I405 HydrophobicContact CB-CD1 3.67Å; L399-I405 HydrophobicContact CB-CG1 3.73Å; L399-I405 HydrophobicContact CB-CG2 4.17Å; L399-I405 HydrophobicContact CD1-CD1 4.34Å; L399-I405 HydrophobicContact CD1-CG2 4.29Å
400	T	91.8	Very high	93.6	Very high	12 Å²	12	62.5 Å²	62.5	7%	0.074	32%	0.316	C	S	.	.	H	α-helix	trans	-66.6	-48	177.5	-58.2	0	0	0	0	111.4	P396 A397 L398 N402 K403 F407 Y412	P396-T400 WeakPolarHBondContact O-CB 3.49Å; P396-T400 PolarHBondContact O-N 3.14Å; P396-T400 PolarHBondContact O-OG1 3.41Å; A397-T400 PolarHBondContact O-N 3.46Å; L398-T400 VanDerWaalsContact C-N 3.3Å; L398-T400 PolarHBondContact O-N 2.88Å; T400-N402 PolarHBondContact O-N 3.38Å; T400-K403 PolarHBondContact O-N 3.04Å; T400-F407 HydrophobicContact CG2-CB 4.12Å; T400-F407 HydrophobicContact CG2-CD2 3.35Å; T400-F407 HydrophobicContact CG2-CE2 4.11Å; T400-F407 HydrophobicContact CG2-CG 4.1Å; T400-Y412 HydrophobicContact CG2-CD2 4.05Å
401	A	89.7	Confident	93.6	Very high	36 Å²	36	63.5 Å²	63.5	30%	0.298	33%	0.325	S	S	.	.	H	α-helix	trans	-61.9	-28	-179.6	0	0	0	0	0	113.3	A397 L398	A397-A401 VanDerWaalsContact O-CB 3.22Å; A397-A401 WeakPolarHBondContact O-CB 3.26Å; A397-A401 PolarHBondContact O-N 3.21Å; L398-A401 PolarHBondContact O-N 3.49Å
402	N	91.1	Very high	93.5	Very high	62 Å²	62	65.5 Å²	65.5	33%	0.332	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	12.8	176.3	-71.9	-86.3	0	0	0	113.2	T254 L398 T400 L404	T254-N402 PolarHBondContact OG1-ND2 2.67Å; L398-N402 PolarHBondContact O-N 3.36Å; L398-N402 VanDerWaalsContact O-N 3.11Å; L398-N402 PolarHBondContact O-ND2 3.03Å; T400-N402 PolarHBondContact O-N 3.38Å; N402-L404 HydrophobicContact CB-CD1 4.24Å; N402-L404 HydrophobicContact CB-CG 4.1Å; N402-L404 PolarHBondContact O-N 2.97Å; N402-L404 VanDerWaalsContact O-N 3.14Å
403	K	90.7	Very high	93.5	Very high	195 Å²	195	60.3 Å²	60.3	85%	0.848	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	28.1	178.6	-55.2	-179.8	179.6	-177.8	0	113.8	L399 T400	L399-K403 PolarHBondContact O-N 3.46Å; T400-K403 PolarHBondContact O-N 3.04Å
404	L	93.6	Very high	93.4	Very high	122 Å²	122	60.9 Å²	60.9	64%	0.639	31%	0.307	S	S	*	.	S	Bend	trans	-84.9	-22.4	178.6	-62.2	177	0	0	0	112.5	L399 N402	L399-L404 HydrophobicContact CB-CB 4.42Å; L399-L404 HydrophobicContact CD2-CB 4.22Å; L399-L404 HydrophobicContact CD2-CD1 3.72Å; L399-L404 WeakPolarHBondContact O-CB 3.35Å; L399-L404 PolarHBondContact O-N 3.06Å; N402-L404 HydrophobicContact CB-CD1 4.24Å; N402-L404 HydrophobicContact CB-CG 4.1Å; N402-L404 PolarHBondContact O-N 2.97Å; N402-L404 VanDerWaalsContact O-N 3.14Å
405	I	93.8	Very high	93.5	Very high	74 Å²	74	60.6 Å²	60.6	38%	0.379	31%	0.306	S	S	.	.	S	Bend	trans	-133	157.9	173.7	63.6	175.8	0	0	0	109.6	L399	L399-I405 HydrophobicContact CB-CD1 3.67Å; L399-I405 HydrophobicContact CB-CG1 3.73Å; L399-I405 HydrophobicContact CB-CG2 4.17Å; L399-I405 HydrophobicContact CD1-CD1 4.34Å; L399-I405 HydrophobicContact CD1-CG2 4.29Å
406	K	92.2	Very high	93.6	Very high	195 Å²	195	58.3 Å²	58.3	85%	0.848	29%	0.292	S	S	*	.			trans	-61.4	137.4	174	-175.3	177.3	178.3	-180	0	109.9	N408	K406-N408 PolarHBondContact O-N 3.21Å
407	F	91.3	Very high	93.7	Very high	125 Å²	125	58.9 Å²	58.9	55%	0.548	29%	0.293	S	S	.	.			trans	-56.7	127.6	176.6	-176	-92.5	0	0	0	111.1	T400 L409 Y412	T400-F407 HydrophobicContact CG2-CB 4.12Å; T400-F407 HydrophobicContact CG2-CD2 3.35Å; T400-F407 HydrophobicContact CG2-CE2 4.11Å; T400-F407 HydrophobicContact CG2-CG 4.1Å; F407-L409 HydrophobicContact CE1-CB 4.07Å; F407-L409 HydrophobicContact CE1-CD1 4.24Å; F407-L409 HydrophobicContact CZ-CB 4.49Å; F407-L409 HydrophobicContact CZ-CD1 3.99Å; F407-Y412 HydrophobicContact CE2-CD1 4.46Å; F407-Y412 HydrophobicContact CE2-CD2 4.36Å; F407-Y412 HydrophobicContact CE2-CG 4.11Å
408	N	92.4	Very high	93.8	Very high	62 Å²	62	59 Å²	59	33%	0.332	29%	0.293	S	S	.	.			trans	-135.2	116.1	172.1	178.6	-66.6	0	0	0	107.6	K406 L410 A411 Y412	K406-N408 PolarHBondContact O-N 3.21Å; N408-L410 VanDerWaalsContact C-N 3.33Å; N408-L410 PolarHBondContact O-N 2.96Å; N408-L410 PolarHBondContact OD1-N 3.48Å; N408-A411 HydrophobicContact CB-CB 3.94Å; N408-A411 PolarHBondContact O-N 2.91Å; N408-A411 PolarHBondContact OD1-N 3.02Å; N408-Y412 WeakPolarHBondContact O-CB 3.33Å; N408-Y412 PolarHBondContact O-N 3.38Å
409	L	92.2	Very high	94	Very high	28 Å²	28	57.9 Å²	57.9	15%	0.147	29%	0.287	C	S	.	.	H	α-helix	trans	-59.2	-42.7	-171.8	-177.5	64	0	0	0	112.8	I20 T24 E139 F407 Y412 N413	I20-L409 HydrophobicContact CG2-CB 4.26Å; T24-L409 HydrophobicContact CG2-CD2 4.16Å; T24-L409 HydrophobicContact CG2-CG 3.92Å; E139-L409 WeakPolarHBondContact OE2-CD1 3.34Å; F407-L409 HydrophobicContact CE1-CB 4.07Å; F407-L409 HydrophobicContact CE1-CD1 4.24Å; F407-L409 HydrophobicContact CZ-CB 4.49Å; F407-L409 HydrophobicContact CZ-CD1 3.99Å; L409-Y412 PolarHBondContact O-N 2.91Å; L409-N413 WeakPolarHBondContact CD1-ND2 3.43Å; L409-N413 PolarHBondContact O-N 2.94Å; L409-N413 PolarHBondContact O-ND2 3.42Å
410	L	95.2	Very high	94	Very high	57 Å²	57	56.3 Å²	56.3	30%	0.298	28%	0.278	S	S	.	.	H	α-helix	trans	-64.1	-49.8	178.8	177.6	64.6	0	0	0	110.7	I20 T24 L27 N408 Y412 N413 T414	I20-L410 HydrophobicContact CG2-CB 4.04Å; T24-L410 WeakPolarHBondContact OG1-CA 3.32Å; T24-L410 PolarHBondContact OG1-N 3.48Å; L27-L410 HydrophobicContact CB-CD1 4.13Å; L27-L410 HydrophobicContact CD2-CD1 3.79Å; N408-L410 VanDerWaalsContact C-N 3.33Å; N408-L410 PolarHBondContact O-N 2.96Å; N408-L410 PolarHBondContact OD1-N 3.48Å; L410-Y412 VanDerWaalsContact C-N 3.33Å; L410-Y412 PolarHBondContact O-N 3.14Å; L410-N413 PolarHBondContact O-N 3.37Å; L410-T414 WeakPolarHBondContact O-CG2 3.34Å; L410-T414 PolarHBondContact O-N 2.95Å
411	A	94.4	Very high	94.2	Very high	24 Å²	24	56.7 Å²	56.7	20%	0.198	28%	0.282	C	S	.	.	H	α-helix	trans	-60.6	-43.5	179	0	0	0	0	0	111.2	P396 N408 N413 T414	P396-A411 HydrophobicContact CB-CB 4.05Å; P396-A411 WeakPolarHBondContact CB-O 3.16Å; N408-A411 HydrophobicContact CB-CB 3.94Å; N408-A411 PolarHBondContact O-N 2.91Å; N408-A411 PolarHBondContact OD1-N 3.02Å; A411-N413 VanDerWaalsContact C-N 3.29Å; A411-N413 PolarHBondContact O-N 3.38Å; A411-T414 WeakPolarHBondContact O-CB 3.39Å; A411-T414 PolarHBondContact O-N 3.3Å; A411-T414 PolarHBondContact O-OG1 2.81Å
412	Y	94.3	Very high	94.3	Very high	73 Å²	73	55 Å²	55	29%	0.286	27%	0.268	S	S	.	.	H	α-helix	trans	-58.1	-40.5	176.4	-177.4	-102	0	0	0	111.7	A397 T400 F407 N408 L409 L410 T414 Y415	A397-Y412 HydrophobicContact CB-CD2 4.18Å; A397-Y412 HydrophobicContact CB-CE2 4.42Å; T400-Y412 HydrophobicContact CG2-CD2 4.05Å; F407-Y412 HydrophobicContact CE2-CD1 4.46Å; F407-Y412 HydrophobicContact CE2-CD2 4.36Å; F407-Y412 HydrophobicContact CE2-CG 4.11Å; N408-Y412 WeakPolarHBondContact O-CB 3.33Å; N408-Y412 PolarHBondContact O-N 3.38Å; L409-Y412 PolarHBondContact O-N 2.91Å; L410-Y412 VanDerWaalsContact C-N 3.33Å; L410-Y412 PolarHBondContact O-N 3.14Å; Y412-T414 VanDerWaalsContact C-N 3.34Å; Y412-T414 PolarHBondContact O-N 3Å; Y412-Y415 WeakPolarHBondContact O-CD1 3.49Å; Y412-Y415 VanDerWaalsContact O-CE1 3.32Å; Y412-Y415 WeakPolarHBondContact O-CE1 3.32Å
413	N	95.6	Very high	94.4	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-83	-1.8	-179.6	-79	-71.2	0	0	0	114.9	T24 L27 L28 L409 L410 A411 Y415 Y416	T24-N413 HydrophobicContact CG2-CB 4.06Å; L27-N413 HydrophobicContact CD2-CB 4.2Å; L28-N413 HydrophobicContact CD2-CB 4.46Å; L409-N413 WeakPolarHBondContact CD1-ND2 3.43Å; L409-N413 PolarHBondContact O-N 2.94Å; L409-N413 PolarHBondContact O-ND2 3.42Å; L410-N413 PolarHBondContact O-N 3.37Å; A411-N413 VanDerWaalsContact C-N 3.29Å; A411-N413 PolarHBondContact O-N 3.38Å; N413-Y415 PolarHBondContact O-N 3.49Å; N413-Y416 WeakPolarHBondContact O-CD2 3.42Å; N413-Y416 PolarHBondContact O-N 3.27Å
414	T	96.2	Very high	94.6	Very high	28 Å²	28	47.9 Å²	47.9	17%	0.172	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-63.4	-23.2	-179.9	55.9	0	0	0	0	114	L27 V393 L410 A411 Y412 Y416 L417	L27-T414 HydrophobicContact CD2-CG2 4.46Å; V393-T414 CarbonylContact O-C 3.58Å; V393-T414 PolarHBondContact O-OG1 2.82Å; V393-T414 VanDerWaalsContact O-OG1 3.12Å; L410-T414 WeakPolarHBondContact O-CG2 3.34Å; L410-T414 PolarHBondContact O-N 2.95Å; A411-T414 WeakPolarHBondContact O-CB 3.39Å; A411-T414 PolarHBondContact O-N 3.3Å; A411-T414 PolarHBondContact O-OG1 2.81Å; Y412-T414 VanDerWaalsContact C-N 3.34Å; Y412-T414 PolarHBondContact O-N 3Å; T414-Y416 PolarHBondContact O-N 3.08Å; T414-L417 HydrophobicContact CG2-CD1 4.46Å; T414-L417 WeakPolarHBondContact O-CB 3.44Å; T414-L417 VanDerWaalsContact O-CG 3.31Å; T414-L417 WeakPolarHBondContact O-CG 3.46Å; T414-L417 PolarHBondContact O-N 3.06Å
415	Y	95.8	Very high	94.6	Very high	10 Å²	10	42.8 Å²	42.8	4%	0.039	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-59.5	-24.1	-179.3	70.8	-97.4	0	0	0	113.2	N158 V393 F394 A397 Y412 N413 L417 N418	N158-Y415 PolarHBondContact OD1-OH 2.96Å; V393-Y415 VanDerWaalsContact O-CA 3.23Å; V393-Y415 WeakPolarHBondContact O-CA 3.49Å; V393-Y415 PolarHBondContact O-N 2.87Å; V393-Y415 VanDerWaalsContact O-N 3.15Å; F394-Y415 HydrophobicContact CD2-CG 4.23Å; F394-Y415 HydrophobicContact CE2-CD2 4.21Å; F394-Y415 HydrophobicContact CE2-CG 4.16Å; A397-Y415 HydrophobicContact CB-CD1 3.85Å; Y412-Y415 WeakPolarHBondContact O-CD1 3.49Å; Y412-Y415 VanDerWaalsContact O-CE1 3.32Å; Y412-Y415 WeakPolarHBondContact O-CE1 3.32Å; N413-Y415 PolarHBondContact O-N 3.49Å; Y415-L417 PolarHBondContact O-N 3.37Å; Y415-N418 VanDerWaalsContact O-CB 3.27Å; Y415-N418 WeakPolarHBondContact O-CB 3.41Å; Y415-N418 PolarHBondContact O-N 3.47Å
416	Y	97.5	Very high	94.5	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-63.2	-25.1	175.5	-79.5	-60	0	0	0	114	L28 V31 V127 V131 V132 T135 N158 N413 T414 N418 N419	L28-Y416 HydrophobicContact CD2-CD2 3.52Å; L28-Y416 HydrophobicContact CD2-CE2 3.87Å; L28-Y416 HydrophobicContact CD2-CG 4.22Å; V31-Y416 WeakPolarHBondContact CG1-O 3.48Å; V127-Y416 HydrophobicContact CG1-CD1 4.23Å; V127-Y416 HydrophobicContact CG1-CE1 4.2Å; V131-Y416 HydrophobicContact CG1-CE1 4.08Å; V132-Y416 HydrophobicContact CG2-CD1 3.38Å; V132-Y416 HydrophobicContact CG2-CE1 3.66Å; V132-Y416 HydrophobicContact CG2-CG 4.04Å; T135-Y416 HydrophobicContact CG2-CE2 3.91Å; T135-Y416 PolarHBondContact OG1-OH 3.41Å; N158-Y416 PolarHBondContact OD1-OH 3.47Å; N413-Y416 WeakPolarHBondContact O-CD2 3.42Å; N413-Y416 PolarHBondContact O-N 3.27Å; T414-Y416 PolarHBondContact O-N 3.08Å; Y416-N418 PolarHBondContact O-N 3.27Å; Y416-N418 VanDerWaalsContact O-N 3.09Å; Y416-N419 PolarHBondContact O-N 3.13Å; Y416-N419 PolarHBondContact O-ND2 3.28Å; Y416-N419 VanDerWaalsContact O-ND2 3.1Å
417	L	97.4	Very high	94.3	Very high	46 Å²	46	32.2 Å²	32.2	24%	0.241	17%	0.169	C	C	.	.	H	α-helix	trans	-55.9	-26.3	174.8	-69.5	171	0	0	0	112.4	L27 V31 V393 T414 Y415 N419 M420 S421	L27-L417 HydrophobicContact CD1-CD1 4.24Å; L27-L417 HydrophobicContact CD1-CD2 3.56Å; L27-L417 HydrophobicContact CD1-CG 3.89Å; V31-L417 HydrophobicContact CG2-CD2 4.2Å; V393-L417 HydrophobicContact CB-CB 4.35Å; V393-L417 HydrophobicContact CG1-CB 3.97Å; V393-L417 HydrophobicContact CG1-CD1 4.4Å; T414-L417 HydrophobicContact CG2-CD1 4.46Å; T414-L417 WeakPolarHBondContact O-CB 3.44Å; T414-L417 VanDerWaalsContact O-CG 3.31Å; T414-L417 WeakPolarHBondContact O-CG 3.46Å; T414-L417 PolarHBondContact O-N 3.06Å; Y415-L417 PolarHBondContact O-N 3.37Å; L417-N419 VanDerWaalsContact C-N 3.27Å; L417-N419 PolarHBondContact O-N 3.09Å; L417-M420 HydrophobicContact CD2-CE 3.6Å; L417-M420 HydrophobicContact CD2-CG 4.42Å; L417-M420 HydrophobicContact CD2-SD 4.09Å; L417-M420 VanDerWaalsContact O-CG 3.32Å; L417-M420 WeakPolarHBondContact O-CG 3.32Å; L417-M420 PolarHBondContact O-N 3.46Å; L417-S421 WeakPolarHBondContact O-CB 3.07Å; L417-S421 PolarHBondContact O-N 3.08Å; L417-S421 VanDerWaalsContact O-N 3.11Å; L417-S421 PolarHBondContact O-OG 3.35Å
418	N	96	Very high	94.3	Very high	9 Å²	9	33.8 Å²	33.8	5%	0.048	18%	0.176	C	C	.	.	H	α-helix	trans	-53.6	-44.6	174.5	-176.7	61.3	0	0	0	112	Y390 V393 Y415 Y416 M420 S421	Y390-N418 WeakPolarHBondContact CB-OD1 3.36Å; V393-N418 HydrophobicContact CG2-CB 3.83Å; Y415-N418 VanDerWaalsContact O-CB 3.27Å; Y415-N418 WeakPolarHBondContact O-CB 3.41Å; Y415-N418 PolarHBondContact O-N 3.47Å; Y416-N418 PolarHBondContact O-N 3.27Å; Y416-N418 VanDerWaalsContact O-N 3.09Å; N418-M420 VanDerWaalsContact C-N 3.34Å; N418-M420 PolarHBondContact O-N 3.46Å; N418-S421 PolarHBondContact O-N 3.32Å
419	N	97.3	Very high	94	Very high	2 Å²	2	34 Å²	34	1%	0.011	18%	0.175	C	C	.	.	H	α-helix	trans	-71	-27.5	-173.6	-53.6	-80.4	0	0	0	112.9	N39 D124 V127 Y416 L417	N39-N419 PolarHBondContact ND2-O 3.08Å; D124-N419 HydrophobicContact CB-CB 4.11Å; D124-N419 WeakPolarHBondContact CB-O 3.42Å; D124-N419 PolarHBondContact OD1-OD1 2.92Å; V127-N419 HydrophobicContact CB-CB 4.48Å; V127-N419 HydrophobicContact CG1-CB 4.18Å; V127-N419 VanDerWaalsContact CG1-CG 3.41Å; V127-N419 WeakPolarHBondContact CG1-ND2 3.45Å; V127-N419 WeakPolarHBondContact CG1-OD1 3.33Å; Y416-N419 PolarHBondContact O-N 3.13Å; Y416-N419 PolarHBondContact O-ND2 3.28Å; Y416-N419 VanDerWaalsContact O-ND2 3.1Å; L417-N419 VanDerWaalsContact C-N 3.27Å; L417-N419 PolarHBondContact O-N 3.09Å
420	M	95.9	Very high	93.6	Very high	21 Å²	21	33.4 Å²	33.4	10%	0.103	17%	0.174	C	C	.	.	H	α-helix	trans	-88	-18.6	174.1	74.2	151.2	88.8	0	0	113.6	V31 L417 N418 P423	V31-M420 HydrophobicContact CB-CE 3.77Å; V31-M420 HydrophobicContact CG1-CB 4.42Å; V31-M420 HydrophobicContact CG1-CE 4.42Å; V31-M420 HydrophobicContact CG2-CE 3.31Å; L417-M420 HydrophobicContact CD2-CE 3.6Å; L417-M420 HydrophobicContact CD2-CG 4.42Å; L417-M420 HydrophobicContact CD2-SD 4.09Å; L417-M420 VanDerWaalsContact O-CG 3.32Å; L417-M420 WeakPolarHBondContact O-CG 3.32Å; L417-M420 PolarHBondContact O-N 3.46Å; N418-M420 VanDerWaalsContact C-N 3.34Å; N418-M420 PolarHBondContact O-N 3.46Å; M420-P423 WeakPolarHBondContact O-CD 3.47Å
421	S	96.1	Very high	92.9	Very high	21 Å²	21	34.4 Å²	34.4	15%	0.147	18%	0.179	C	C	.	.	H	α-helix	trans	-75.2	-31.3	-169.3	-69.6	0	0	0	0	113	L417 N418 L424 I425	L417-S421 WeakPolarHBondContact O-CB 3.07Å; L417-S421 PolarHBondContact O-N 3.08Å; L417-S421 VanDerWaalsContact O-N 3.11Å; L417-S421 PolarHBondContact O-OG 3.35Å; N418-S421 PolarHBondContact O-N 3.32Å; S421-L424 WeakPolarHBondContact O-CB 3.32Å; S421-L424 PolarHBondContact O-N 2.99Å; S421-I425 WeakPolarHBondContact O-CG1 3.23Å; S421-I425 PolarHBondContact O-N 3.43Å
422	N	92.2	Very high	92	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-56.3	-49.7	-173.5	-72.7	-19.1	0	0	0	113.8	D124 V386 L424 I425 Y426	D124-N422 PolarHBondContact OD2-ND2 3.22Å; V386-N422 WeakPolarHBondContact CG1-OD1 3.2Å; N422-L424 VanDerWaalsContact C-N 3.3Å; N422-L424 PolarHBondContact O-N 2.89Å; N422-I425 WeakPolarHBondContact O-CB 3.22Å; N422-I425 PolarHBondContact O-N 2.95Å; N422-Y426 HydrophobicContact CB-CE2 4.01Å; N422-Y426 WeakPolarHBondContact O-CD2 3.44Å; N422-Y426 WeakPolarHBondContact O-CE2 3.47Å; N422-Y426 PolarHBondContact O-N 2.89Å
423	P	93.3	Very high	91.5	Very high	10 Å²	10	32.7 Å²	32.7	7%	0.065	18%	0.18	C	C	.	.	H	α-helix	trans	-53.1	-42.8	172.2	-28.2	35.2	0	0	0	114.2	G38 N39 V42 M420 Y426 C427	G38-P423 VanDerWaalsContact CA-CG 3.49Å; G38-P423 WeakPolarHBondContact O-CG 3.4Å; N39-P423 WeakPolarHBondContact OD1-CD 3.48Å; N39-P423 WeakPolarHBondContact OD1-CG 3.28Å; V42-P423 HydrophobicContact CG2-CB 4.11Å; V42-P423 HydrophobicContact CG2-CG 4.05Å; M420-P423 WeakPolarHBondContact O-CD 3.47Å; P423-Y426 PolarHBondContact O-N 3.25Å; P423-C427 PolarHBondContact O-N 3.37Å; P423-C427 PolarHBondContact O-SG 3.48Å; P423-C427 VanDerWaalsContact O-SG 3.42Å
424	L	94.4	Very high	91	Very high	97 Å²	97	37.9 Å²	37.9	51%	0.508	20%	0.199	S	C	.	.	H	α-helix	trans	-63.7	-44.9	178.3	-62.6	174.5	0	0	0	110.9	S421 N422 Y426 C427 F428	S421-L424 WeakPolarHBondContact O-CB 3.32Å; S421-L424 PolarHBondContact O-N 2.99Å; N422-L424 VanDerWaalsContact C-N 3.3Å; N422-L424 PolarHBondContact O-N 2.89Å; L424-Y426 VanDerWaalsContact C-N 3.32Å; L424-Y426 PolarHBondContact O-N 2.85Å; L424-C427 WeakPolarHBondContact O-CB 3.48Å; L424-C427 PolarHBondContact O-N 3.27Å; L424-F428 WeakPolarHBondContact O-CD2 3.24Å; L424-F428 PolarHBondContact O-N 2.97Å; L424-F428 VanDerWaalsContact O-N 3.07Å
425	I	93.9	Very high	90.3	Very high	15 Å²	15	43.4 Å²	43.4	8%	0.077	22%	0.221	C	C	.	.	H	α-helix	trans	-58.3	-44.9	177	-64.1	166.1	0	0	0	110.4	V382 V385 V386 V389 S421 N422 C427 F428 M429	V382-I425 HydrophobicContact CG1-CG2 4.06Å; V385-I425 HydrophobicContact CB-CG2 4.36Å; V385-I425 HydrophobicContact CG1-CD1 4.25Å; V385-I425 HydrophobicContact CG1-CG1 4.2Å; V385-I425 HydrophobicContact CG1-CG2 4.09Å; V386-I425 HydrophobicContact CB-CD1 4.39Å; V386-I425 HydrophobicContact CG2-CD1 3.79Å; V386-I425 HydrophobicContact CG2-CG2 4.15Å; V389-I425 HydrophobicContact CB-CD1 4.44Å; V389-I425 HydrophobicContact CG2-CD1 4.12Å; S421-I425 WeakPolarHBondContact O-CG1 3.23Å; S421-I425 PolarHBondContact O-N 3.43Å; N422-I425 WeakPolarHBondContact O-CB 3.22Å; N422-I425 PolarHBondContact O-N 2.95Å; I425-C427 PolarHBondContact O-N 3.3Å; I425-F428 PolarHBondContact O-N 2.92Å; I425-M429 HydrophobicContact CG2-CG 4.42Å; I425-M429 HydrophobicContact CG2-SD 3.78Å; I425-M429 WeakPolarHBondContact O-CB 3.5Å; I425-M429 PolarHBondContact O-N 3.01Å
426	Y	90.3	Very high	89.5	Confident	1 Å²	1	44.7 Å²	44.7	0%	0.004	23%	0.227	C	C	.	.	H	α-helix	trans	-65.5	-38.8	177.4	-60	-51.5	0	0	0	112.9	V42 I117 V382 N422 P423 L424 F428 S430	V42-Y426 HydrophobicContact CG1-CD2 4.32Å; V42-Y426 HydrophobicContact CG1-CE2 4.26Å; V42-Y426 HydrophobicContact CG2-CD2 3.79Å; V42-Y426 HydrophobicContact CG2-CE2 4.3Å; I117-Y426 HydrophobicContact CD1-CE1 4.14Å; I117-Y426 HydrophobicContact CG1-CE1 3.95Å; I117-Y426 HydrophobicContact CG2-CE1 4.1Å; I117-Y426 HydrophobicContact CG2-CE2 4.07Å; V382-Y426 HydrophobicContact CG1-CD1 3.73Å; V382-Y426 HydrophobicContact CG1-CE1 3.68Å; N422-Y426 HydrophobicContact CB-CE2 4.01Å; N422-Y426 WeakPolarHBondContact O-CD2 3.44Å; N422-Y426 WeakPolarHBondContact O-CE2 3.47Å; N422-Y426 PolarHBondContact O-N 2.89Å; P423-Y426 PolarHBondContact O-N 3.25Å; L424-Y426 VanDerWaalsContact C-N 3.32Å; L424-Y426 PolarHBondContact O-N 2.85Å; Y426-F428 PolarHBondContact O-N 3.35Å; Y426-S430 WeakPolarHBondContact O-CA 3.49Å; Y426-S430 VanDerWaalsContact O-CB 3.29Å; Y426-S430 WeakPolarHBondContact O-CB 3.49Å; Y426-S430 PolarHBondContact O-N 2.92Å
427	C	88.8	Confident	88.9	Confident	46 Å²	46	46 Å²	46	31%	0.311	23%	0.234	S	C	.	.	H	α-helix	trans	-57.7	-45.3	174.5	-79.4	0	0	0	0	112	P423 L424 I425 R434	P423-C427 PolarHBondContact O-N 3.37Å; P423-C427 PolarHBondContact O-SG 3.48Å; P423-C427 VanDerWaalsContact O-SG 3.42Å; L424-C427 WeakPolarHBondContact O-CB 3.48Å; L424-C427 PolarHBondContact O-N 3.27Å; I425-C427 PolarHBondContact O-N 3.3Å; C427-R434 WeakPolarHBondContact O-CD 3.41Å; C427-R434 WeakPolarHBondContact O-CG 3.48Å
428	F	90.4	Very high	88.1	Confident	159 Å²	159	50.3 Å²	50.3	70%	0.697	25%	0.25	S	S	*	.	H	α-helix	trans	-80.1	-41.1	-177.9	-73.6	-70.5	0	0	0	113.3	L424 I425 Y426	L424-F428 WeakPolarHBondContact O-CD2 3.24Å; L424-F428 PolarHBondContact O-N 2.97Å; L424-F428 VanDerWaalsContact O-N 3.07Å; I425-F428 PolarHBondContact O-N 2.92Å; Y426-F428 PolarHBondContact O-N 3.35Å
429	M	86.5	Confident	87.1	Confident	65 Å²	65	51.1 Å²	51.1	32%	0.32	26%	0.255	S	S	.	.	H	α-helix	trans	-100.6	-20.7	-167.4	-59.8	-174.3	71	0	0	114.7	V382 V385 I425	V382-M429 HydrophobicContact CG2-CB 3.77Å; V382-M429 HydrophobicContact CG2-CE 4.42Å; V385-M429 HydrophobicContact CB-CE 4.22Å; V385-M429 HydrophobicContact CB-SD 3.65Å; V385-M429 HydrophobicContact CG1-SD 3.86Å; V385-M429 HydrophobicContact CG2-CE 3.57Å; V385-M429 HydrophobicContact CG2-SD 3.55Å; V385-M429 VanDerWaalsContact CG2-SD 3.55Å; I425-M429 HydrophobicContact CG2-CG 4.42Å; I425-M429 HydrophobicContact CG2-SD 3.78Å; I425-M429 WeakPolarHBondContact O-CB 3.5Å; I425-M429 PolarHBondContact O-N 3.01Å
430	S	84	Confident	86.2	Confident	17 Å²	17	53.2 Å²	53.2	12%	0.119	27%	0.266	C	S	.	.			trans	-104.7	99.2	-175.7	-177.2	0	0	0	0	112.4	Y426 A432 F433 R434	Y426-S430 WeakPolarHBondContact O-CA 3.49Å; Y426-S430 VanDerWaalsContact O-CB 3.29Å; Y426-S430 WeakPolarHBondContact O-CB 3.49Å; Y426-S430 PolarHBondContact O-N 2.92Å; S430-A432 PolarHBondContact O-N 2.99Å; S430-F433 WeakPolarHBondContact O-CB 3.13Å; S430-F433 PolarHBondContact O-N 2.84Å; S430-F433 VanDerWaalsContact O-N 3.17Å; S430-F433 WeakPolarHBondContact OG-CB 3.48Å; S430-F433 PolarHBondContact OG-N 3.34Å; S430-F433 VanDerWaalsContact OG-N 3.12Å; S430-R434 PolarHBondContact O-N 3.05Å
431	N	80.4	Confident	85.4	Confident	78 Å²	78	57.5 Å²	57.5	42%	0.417	28%	0.284	S	S	.	.	H	α-helix	trans	-56.6	-36.4	171	-72.4	-13.5	0	0	0	112.5	R434 K435	N431-R434 PolarHBondContact OD1-NH2 3.19Å; N431-K435 WeakPolarHBondContact O-CG 3.39Å; N431-K435 PolarHBondContact O-N 3.02Å; N431-K435 VanDerWaalsContact O-N 3.11Å
432	A	76.3	Confident	84.3	Confident	58 Å²	58	62.9 Å²	62.9	48%	0.479	31%	0.305	S	S	.	.	H	α-helix	trans	-65.8	-44.4	177.9	0	0	0	0	0	111.1	S430 K435 K436	S430-A432 PolarHBondContact O-N 2.99Å; A432-K435 PolarHBondContact O-N 3.39Å; A432-K436 WeakPolarHBondContact O-CG 3.26Å; A432-K436 PolarHBondContact O-N 3.14Å; A432-K436 VanDerWaalsContact O-N 3.11Å
433	F	83	Confident	82.8	Confident	3 Å²	3	64.6 Å²	64.6	1%	0.013	31%	0.314	C	S	.	.	H	α-helix	trans	-60.8	-51.2	176.1	-179	-103.5	0	0	0	111.2	V42 V45 Y46 S430 K435 K436 L437	V42-F433 HydrophobicContact CG2-CE2 4.12Å; V42-F433 HydrophobicContact CG2-CZ 4.14Å; V45-F433 HydrophobicContact CB-CD2 4.23Å; V45-F433 HydrophobicContact CB-CE2 3.79Å; V45-F433 HydrophobicContact CG1-CD2 3.66Å; V45-F433 HydrophobicContact CG1-CE2 3.77Å; V45-F433 HydrophobicContact CG2-CD2 4.46Å; V45-F433 HydrophobicContact CG2-CE2 3.84Å; V45-F433 HydrophobicContact CG2-CZ 4.36Å; Y46-F433 AromaticContact CE2-CD2 3.98Å; Y46-F433 HydrophobicContact CE2-CD2 3.98Å; Y46-F433 HydrophobicContact CE2-CE2 4.49Å; S430-F433 WeakPolarHBondContact O-CB 3.13Å; S430-F433 PolarHBondContact O-N 2.84Å; S430-F433 VanDerWaalsContact O-N 3.17Å; S430-F433 WeakPolarHBondContact OG-CB 3.48Å; S430-F433 PolarHBondContact OG-N 3.34Å; S430-F433 VanDerWaalsContact OG-N 3.12Å; F433-K435 VanDerWaalsContact C-N 3.31Å; F433-K435 PolarHBondContact O-N 3Å; F433-K436 CarbonylContact O-C 3.31Å; F433-K436 PolarHBondContact O-N 2.99Å; F433-L437 HydrophobicContact CE1-CB 4.49Å; F433-L437 HydrophobicContact CE1-CD2 3.93Å; F433-L437 HydrophobicContact CZ-CD1 4.41Å; F433-L437 HydrophobicContact CZ-CD2 4.41Å; F433-L437 WeakPolarHBondContact O-CB 3.48Å; F433-L437 PolarHBondContact O-N 3.44Å
434	R	85.1	Confident	80.9	Confident	109 Å²	109	68.4 Å²	68.4	41%	0.411	34%	0.341	S	S	.	.	H	α-helix	trans	-56	-41.2	178.2	-72	-167.7	-77.8	-169.8	-0.1	113.4	C427 S430 N431 K438	C427-R434 WeakPolarHBondContact O-CD 3.41Å; C427-R434 WeakPolarHBondContact O-CG 3.48Å; S430-R434 PolarHBondContact O-N 3.05Å; N431-R434 PolarHBondContact OD1-NH2 3.19Å; R434-K438 WeakPolarHBondContact O-CB 3.21Å; R434-K438 WeakPolarHBondContact O-CG 3.38Å; R434-K438 PolarHBondContact O-N 2.81Å
435	K	81.9	Confident	78.7	Confident	145 Å²	145	69 Å²	69	63%	0.63	34%	0.343	S	S	*	.	H	α-helix	trans	-62.3	-47.2	175.8	-74.6	179.2	-178.8	-174.1	0	111.1	N431 A432 F433 K438 I439	N431-K435 WeakPolarHBondContact O-CG 3.39Å; N431-K435 PolarHBondContact O-N 3.02Å; N431-K435 VanDerWaalsContact O-N 3.11Å; A432-K435 PolarHBondContact O-N 3.39Å; F433-K435 VanDerWaalsContact C-N 3.31Å; F433-K435 PolarHBondContact O-N 3Å; K435-K438 PolarHBondContact O-N 3.35Å; K435-I439 WeakPolarHBondContact O-CD1 3.05Å; K435-I439 VanDerWaalsContact O-CG1 3.23Å; K435-I439 WeakPolarHBondContact O-CG1 3.44Å; K435-I439 PolarHBondContact O-N 2.88Å
436	K	79.5	Confident	76.4	Confident	37 Å²	37	76.8 Å²	76.8	16%	0.161	37%	0.372	C	S	.	.	H	α-helix	trans	-64	-41.5	177.1	-67.2	-177.5	177.6	-172.8	0	112.8	V45 A432 F433 I439 L440	V45-K436 HydrophobicContact CG1-CB 3.5Å; V45-K436 HydrophobicContact CG1-CD 3.83Å; V45-K436 HydrophobicContact CG1-CG 4.33Å; A432-K436 WeakPolarHBondContact O-CG 3.26Å; A432-K436 PolarHBondContact O-N 3.14Å; A432-K436 VanDerWaalsContact O-N 3.11Å; F433-K436 CarbonylContact O-C 3.31Å; F433-K436 PolarHBondContact O-N 2.99Å; K436-I439 WeakPolarHBondContact O-CB 3.42Å; K436-I439 PolarHBondContact O-N 3.46Å; K436-L440 PolarHBondContact O-N 2.82Å
437	L	83.8	Confident	73.9	Confident	28 Å²	28	81.2 Å²	81.2	15%	0.147	40%	0.403	C	S	.	.	H	α-helix	trans	-63.3	-44.3	177.5	-170.8	66.4	0	0	0	111.9	L41 V45 F433 I439 L440 F441	L41-L437 HydrophobicContact CD2-CD1 4.41Å; V45-L437 HydrophobicContact CG2-CB 4.34Å; V45-L437 HydrophobicContact CG2-CD1 3.87Å; F433-L437 HydrophobicContact CE1-CB 4.49Å; F433-L437 HydrophobicContact CE1-CD2 3.93Å; F433-L437 HydrophobicContact CZ-CD1 4.41Å; F433-L437 HydrophobicContact CZ-CD2 4.41Å; F433-L437 WeakPolarHBondContact O-CB 3.48Å; F433-L437 PolarHBondContact O-N 3.44Å; L437-I439 VanDerWaalsContact C-N 3.27Å; L437-I439 PolarHBondContact O-N 3.44Å; L437-L440 HydrophobicContact CD1-CD2 4.49Å; L437-L440 WeakPolarHBondContact O-CB 3.29Å; L437-L440 PolarHBondContact O-N 3.25Å; L437-L440 VanDerWaalsContact O-N 3.15Å; L437-F441 HydrophobicContact CD1-CD2 4.07Å; L437-F441 HydrophobicContact CD1-CE2 3.53Å; L437-F441 HydrophobicContact CD1-CZ 4.45Å; L437-F441 HydrophobicContact CD2-CE2 4.3Å; L437-F441 HydrophobicContact CG-CD2 3.95Å; L437-F441 HydrophobicContact CG-CE2 3.71Å; L437-F441 WeakPolarHBondContact O-CD2 3.09Å; L437-F441 PolarHBondContact O-N 3.23Å; L437-F441 VanDerWaalsContact O-N 3.13Å
438	K	81.9	Confident	71.5	Confident	135 Å²	135	84.4 Å²	84.4	59%	0.587	42%	0.424	S	S	*	.	H	α-helix	trans	-56	-43.8	173.2	-76.9	-179	-179.8	-171	0	111.2	R434 K435 L440 F441 F442	R434-K438 WeakPolarHBondContact O-CB 3.21Å; R434-K438 WeakPolarHBondContact O-CG 3.38Å; R434-K438 PolarHBondContact O-N 2.81Å; K435-K438 PolarHBondContact O-N 3.35Å; K438-L440 VanDerWaalsContact C-N 3.31Å; K438-L440 PolarHBondContact O-N 3.21Å; K438-F441 PolarHBondContact O-N 2.91Å; K438-F442 HydrophobicContact CB-CD2 4.02Å; K438-F442 HydrophobicContact CB-CE2 4.24Å; K438-F442 HydrophobicContact CG-CD2 4.49Å; K438-F442 HydrophobicContact CG-CE2 4.21Å; K438-F442 WeakPolarHBondContact O-CB 3.2Å; K438-F442 WeakPolarHBondContact O-CD2 3.01Å; K438-F442 PolarHBondContact O-N 3.45Å
439	I	73.8	Confident	68.9	Low	27 Å²	27	85 Å²	85	14%	0.138	43%	0.427	C	S	.	.	H	α-helix	trans	-62.6	-41.1	179.1	-64.7	154.5	0	0	0	111.2	Y59 K435 K436 L437 N443	Y59-I439 HydrophobicContact CD2-CD1 3.81Å; Y59-I439 HydrophobicContact CD2-CG1 4.1Å; Y59-I439 HydrophobicContact CD2-CG2 3.98Å; Y59-I439 HydrophobicContact CE1-CD1 4.05Å; Y59-I439 HydrophobicContact CE2-CD1 3.08Å; Y59-I439 HydrophobicContact CE2-CG1 3.5Å; Y59-I439 VanDerWaalsContact CE2-CG1 3.5Å; Y59-I439 HydrophobicContact CE2-CG2 4.25Å; Y59-I439 VanDerWaalsContact OH-CD1 3.29Å; Y59-I439 WeakPolarHBondContact OH-CD1 3.5Å; K435-I439 WeakPolarHBondContact O-CD1 3.05Å; K435-I439 VanDerWaalsContact O-CG1 3.23Å; K435-I439 WeakPolarHBondContact O-CG1 3.44Å; K435-I439 PolarHBondContact O-N 2.88Å; K436-I439 WeakPolarHBondContact O-CB 3.42Å; K436-I439 PolarHBondContact O-N 3.46Å; L437-I439 VanDerWaalsContact C-N 3.27Å; L437-I439 PolarHBondContact O-N 3.44Å; I439-N443 WeakPolarHBondContact CG2-ND2 3.35Å; I439-N443 VanDerWaalsContact O-CB 3.29Å; I439-N443 WeakPolarHBondContact O-CB 3.23Å; I439-N443 PolarHBondContact O-N 3.08Å; I439-N443 VanDerWaalsContact O-N 3.14Å; I439-N443 PolarHBondContact O-ND2 3.47Å
440	L	77.8	Confident	66.5	Low	46 Å²	46	86.5 Å²	86.5	24%	0.241	44%	0.442	C	S	.	.	H	α-helix	trans	-58.5	-50	177.5	-169.5	69.2	0	0	0	111.1	V45 K436 L437 K438	V45-L440 HydrophobicContact CG2-CD2 4.21Å; K436-L440 PolarHBondContact O-N 2.82Å; L437-L440 HydrophobicContact CD1-CD2 4.49Å; L437-L440 WeakPolarHBondContact O-CB 3.29Å; L437-L440 PolarHBondContact O-N 3.25Å; L437-L440 VanDerWaalsContact O-N 3.15Å; K438-L440 VanDerWaalsContact C-N 3.31Å; K438-L440 PolarHBondContact O-N 3.21Å
441	F	80.7	Confident	64	Low	110 Å²	110	96.3 Å²	96.3	48%	0.482	48%	0.478	S	S	.	.	H	α-helix	trans	-73.4	-45.1	-179.2	-72.8	-66.9	0	0	0	113.9	L41 L437 K438 N443 S444	L41-F441 HydrophobicContact CD2-CZ 4.03Å; L437-F441 HydrophobicContact CD1-CD2 4.07Å; L437-F441 HydrophobicContact CD1-CE2 3.53Å; L437-F441 HydrophobicContact CD1-CZ 4.45Å; L437-F441 HydrophobicContact CD2-CE2 4.3Å; L437-F441 HydrophobicContact CG-CD2 3.95Å; L437-F441 HydrophobicContact CG-CE2 3.71Å; L437-F441 WeakPolarHBondContact O-CD2 3.09Å; L437-F441 PolarHBondContact O-N 3.23Å; L437-F441 VanDerWaalsContact O-N 3.13Å; K438-F441 PolarHBondContact O-N 2.91Å; F441-N443 PolarHBondContact O-N 3.06Å; F441-S444 PolarHBondContact O-N 3.48Å
442	F	72.9	Confident	62	Low	135 Å²	135	101.2 Å²	101.2	59%	0.592	50%	0.498	S	S	*	.	H	α-helix	trans	-74.4	-24.7	-174.4	-74.7	-68.3	0	0	0	113.7	K438 R446	K438-F442 HydrophobicContact CB-CD2 4.02Å; K438-F442 HydrophobicContact CB-CE2 4.24Å; K438-F442 HydrophobicContact CG-CD2 4.49Å; K438-F442 HydrophobicContact CG-CE2 4.21Å; K438-F442 WeakPolarHBondContact O-CB 3.2Å; K438-F442 WeakPolarHBondContact O-CD2 3.01Å; K438-F442 PolarHBondContact O-N 3.45Å; F442-R446 PolarHBondContact O-N 2.91Å
443	N	59.1	Low	60	Low	35 Å²	35	105.1 Å²	105.1	19%	0.187	51%	0.511	C	S	.	.	H	α-helix	trans	-79	-28	174.9	-77.1	-22.4	0	0	0	113.2	L55 I439 F441 I445 R446 S447	L55-N443 HydrophobicContact CD2-CB 4.01Å; I439-N443 WeakPolarHBondContact CG2-ND2 3.35Å; I439-N443 VanDerWaalsContact O-CB 3.29Å; I439-N443 WeakPolarHBondContact O-CB 3.23Å; I439-N443 PolarHBondContact O-N 3.08Å; I439-N443 VanDerWaalsContact O-N 3.14Å; I439-N443 PolarHBondContact O-ND2 3.47Å; F441-N443 PolarHBondContact O-N 3.06Å; N443-I445 PolarHBondContact O-N 3.39Å; N443-R446 PolarHBondContact O-N 3.21Å; N443-S447 PolarHBondContact O-N 3.16Å
444	S	53.9	Low	57.7	Low	91 Å²	91	114.2 Å²	114.2	64%	0.636	55%	0.551	S	S	*	*	H	α-helix	trans	-61	-33.6	171.3	-110.3	0	0	0	0	111.7	F441	F441-S444 PolarHBondContact O-N 3.48Å
445	I	49.5	Very low	55.4	Low	109 Å²	109	116.3 Å²	116.3	56%	0.559	57%	0.57	S	S	*	*	H	α-helix	trans	-81.8	-31.7	-177.8	-59.1	168.9	0	0	0	112	N443	N443-I445 PolarHBondContact O-N 3.39Å
446	R	43.8	Very low	53.1	Low	178 Å²	178	116.3 Å²	116.3	67%	0.672	58%	0.577	S	S	*	*	H	α-helix	trans	-80.4	-20.9	-177.9	-130.1	175.5	-174.4	164.1	1.4	113.7	F442 N443 C448 K449	F442-R446 PolarHBondContact O-N 2.91Å; N443-R446 PolarHBondContact O-N 3.21Å; R446-C448 VanDerWaalsContact C-N 3.27Å; R446-C448 PolarHBondContact O-N 2.78Å; R446-K449 PolarHBondContact O-N 3.48Å
447	S	39.8	Very low	50.9	Low	94 Å²	94	121.6 Å²	121.6	66%	0.657	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	-24.6	176.9	-148.2	0	0	0	0	113	N443	N443-S447 PolarHBondContact O-N 3.16Å
448	C	36.4	Very low	48.6	Very low	113 Å²	113	130.2 Å²	130.2	76%	0.764	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-18.6	175.9	-67.5	0	0	0	0	114.2	R446	R446-C448 VanDerWaalsContact C-N 3.27Å; R446-C448 PolarHBondContact O-N 2.78Å
449	K	37.1	Very low	46.1	Very low	172 Å²	172	130.2 Å²	130.2	75%	0.748	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	-12	-176.4	-89	-179.4	174.6	176.4	0	115.3	R446	R446-K449 PolarHBondContact O-N 3.48Å
450	C	35.2	Very low	44.1	Very low	96 Å²	96	137.1 Å²	137.1	65%	0.649	70%	0.696	S	S	*	*	S	Bend	trans	-93.5	0.6	-175.5	-69.7	0	0	0	0	115.4
451	Y	32.7	Very low	41.9	Very low	223 Å²	223	142.3 Å²	142.3	88%	0.875	72%	0.719	S	S	*	*	S	Bend	trans	-86.8	-11.2	177.2	-156	-102.2	0	0	0	113.7
452	H	37.4	Very low	39.8	Very low	181 Å²	181	142.7 Å²	142.7	84%	0.838	73%	0.732	S	S	*	*	S	Bend	trans	-105.4	5.6	-169.3	-140.9	-53.7	0	0	0	115.9
453	N	33.8	Very low	38	Very low	140 Å²	140	143.6 Å²	143.6	75%	0.749	74%	0.738	S	S	*	*			trans	-132	49.3	-173.6	-156	12.3	0	0	0	114.3
454	K	35.7	Very low	36.9	Very low	195 Å²	195	149.2 Å²	149.2	85%	0.848	76%	0.763	S	S	*	*			trans	-111.4	10.2	179.9	-129.1	-178.6	-177.3	-175.2	0	115.5
455	N	36.7	Very low	35.9	Very low	153 Å²	153	153.3 Å²	153.3	82%	0.818	78%	0.777	S	S	*	*	S	Bend	trans	-116.2	5.2	-171.2	-78.1	6.3	0	0	0	116.9
456	N	32.8	Very low	35.3	Very low	145 Å²	145	154.9 Å²	154.9	78%	0.775	78%	0.782	S	S	*	*			trans	-144.4	84.7	-176.8	-87.7	-27.1	0	0	0	113.2
457	T	35.1	Very low	34.7	Very low	147 Å²	147	154.2 Å²	154.2	90%	0.902	79%	0.786	S	S	*	*			trans	-151.2	115.8	149.5	28.2	0	0	0	0	110.1
458	K	34.2	Very low	34.4	Very low	210 Å²	210	161 Å²	161	91%	0.913	80%	0.797	S	S	*	*			trans	-64.7	143	-177	-73.8	169.2	171	175.4	0	112.4
459	V	30.5	Very low	34	Very low	134 Å²	134	164.6 Å²	164.6	81%	0.812	80%	0.802	S	S	*	*			trans	-57.5	131.4	167.2	176.4	0	0	0	0	110.4
460	L	31.2	Very low	34	Very low	172 Å²	172	164.3 Å²	164.3	90%	0.901	80%	0.803	S	S	*	*			trans	-138.6	112.4	161.9	-156.4	78.1	0	0	0	109
461	H	32	Very low	34	Very low	156 Å²	156	165 Å²	165	72%	0.722	81%	0.806	S	S	*	*			trans	-87.2	152.2	175.8	-130.1	-60.4	0	0	0	109.8
462	P	36.7	Very low	34.2	Very low	118 Å²	118	162.3 Å²	162.3	77%	0.766	80%	0.802	S	S	*	*			trans	-128.9	159.3	132	14.9	5.4	0	0	0	112.9
463	H	35.2	Very low	34.1	Very low	154 Å²	154	162.5 Å²	162.5	71%	0.713	80%	0.803	S	S	*	*			trans	-91.9	161.9	-168.4	-113.3	-105.7	0	0	0	112.8
464	H	35.7	Very low	34.3	Very low	153 Å²	153	163 Å²	163	71%	0.708	80%	0.804	S	S	*	*			trans	73.4	106	160.9	-66.4	-68.8	0	0	0	119.8
465	L	33.5	Very low	34.1	Very low	177 Å²	177	161.6 Å²	161.6	93%	0.927	80%	0.801	S	S	*	*				-171.2	146.7	106.7	-106.6	136.3	0	0	0	112.3
466	H	35.1	Very low	34.4	Very low	142 Å²	142	162.2 Å²	162.2	66%	0.657	80%	0.798	S	S	*	*			trans	-72.9	156.6	-158.3	-97	-98.7	0	0	0	117.2
467	H	32.6	Very low	35.2	Very low	163 Å²	163	159 Å²	159	76%	0.755	79%	0.786	S	S	*	*			trans	49.4	121.9	145.5	-71.3	-48.9	0	0	0	118.2
468	R	31.9	Very low	35.9	Very low	238 Å²	238	158.6 Å²	158.6	90%	0.898	77%	0.773	S	S	*	*				-175.8	136.5	68.6	-125	175.3	-175.4	176.2	0.6	108.1
469	Q	29.7	Very low	36.5	Very low	187 Å²	187	158.2 Å²	158.2	87%	0.874	77%	0.766	S	S	*	*			trans	-76.1	140.7	171.7	-73.1	167.3	-24.7	0	0	110.6
470	H	37	Very low	37.4	Very low	166 Å²	166	158.4 Å²	158.4	77%	0.769	76%	0.758	S	S	*	*			trans	-150.6	130.3	148.4	-107	-72	0	0	0	109.4
471	P	33.7	Very low	38.7	Very low	110 Å²	110	155.4 Å²	155.4	71%	0.714	74%	0.739	S	S	*	*			trans	-95.4	132.9	176.7	34.7	-26.8	0	0	0	110.1
472	H	38.7	Very low	39.9	Very low	167 Å²	167	157.1 Å²	157.1	77%	0.773	74%	0.739	S	S	*	*			trans	-144	110.2	164.6	-86.8	-71.3	0	0	0	112.3
473	H	33.6	Very low	40.9	Very low	186 Å²	186	159 Å²	159	86%	0.861	73%	0.732	S	S	*	*			trans	-47.6	126.4	146.1	-90.7	-94.3	0	0	0	110.1
474	L	37.8	Very low	42.3	Very low	150 Å²	150	157.6 Å²	157.6	79%	0.785	73%	0.726	S	S	*	*			trans	-167.3	116.1	148.1	-108.7	132.5	0	0	0	112.9
475	Q	33.5	Very low	43.8	Very low	165 Å²	165	158.7 Å²	158.7	77%	0.771	72%	0.724	S	S	*	*			trans	0.7	139.2	157.9	-88.6	136.4	-34.4	0	0	120.6	P477	Q475-P477 VanDerWaalsContact C-CD 3.41Å; Q475-P477 WeakPolarHBondContact O-CD 3.34Å
476	H	41.8	Very low	45.1	Very low	166 Å²	166	155.2 Å²	155.2	77%	0.769	70%	0.698	S	S	*	*			trans	-101.2	84.2	166.9	-95.7	-54.5	0	0	0	112.9
477	P	49.8	Very low	46.6	Very low	79 Å²	79	154.6 Å²	154.6	51%	0.513	69%	0.694	S	S	.	*			trans	-92	-18.2	166.5	14.1	-1.4	0	0	0	113.8	Q475 R479	Q475-P477 VanDerWaalsContact C-CD 3.41Å; Q475-P477 WeakPolarHBondContact O-CD 3.34Å; P477-R479 PolarHBondContact O-N 3.39Å
478	H	50.5	Low	48.4	Very low	137 Å²	137	152.4 Å²	152.4	63%	0.634	68%	0.684	S	S	*	*	H	α-helix	trans	-75	-24.9	-170.4	-81.1	-61.2	0	0	0	116	R482	H478-R482 PolarHBondContact O-N 3.22Å
479	R	45.5	Very low	50.1	Low	202 Å²	202	147.5 Å²	147.5	76%	0.762	67%	0.671	S	S	*	*	H	α-helix	trans	-70.6	-37.9	178.2	-93.8	-175.3	174.9	-175.9	0.1	112.2	P477 Y483	P477-R479 PolarHBondContact O-N 3.39Å; R479-Y483 PolarHBondContact O-N 2.88Å; R479-Y483 VanDerWaalsContact O-N 3.13Å
480	H	49.8	Very low	51.6	Low	139 Å²	139	145 Å²	145	64%	0.644	66%	0.659	S	S	*	*	H	α-helix	trans	-70.8	-39.3	179.6	-110.9	-57.5	0	0	0	112.4	Y483 Q484	H480-Y483 PolarHBondContact O-N 2.92Å; H480-Q484 PolarHBondContact O-N 3.29Å
481	Q	58.4	Low	53	Low	108 Å²	108	141.4 Å²	141.4	51%	0.505	65%	0.645	S	S	.	*	H	α-helix	trans	-64.8	-40.8	174.6	-94	-179.6	-10.7	0	0	112.8	Q484 R485	Q481-Q484 PolarHBondContact O-N 3.3Å; Q481-R485 WeakPolarHBondContact O-CG 3.28Å; Q481-R485 PolarHBondContact O-N 3.33Å
482	R	57.3	Low	54.7	Low	193 Å²	193	143.9 Å²	143.9	73%	0.728	64%	0.64	S	S	*	*	H	α-helix	trans	-63.9	-40.1	175.4	-85.8	-174	174.4	-171.7	-1	112.1	H478 R486	H478-R482 PolarHBondContact O-N 3.22Å; R482-R486 WeakPolarHBondContact O-CG 3.44Å; R482-R486 PolarHBondContact O-N 2.88Å; R482-R486 VanDerWaalsContact O-N 3.12Å
483	Y	57.7	Low	55.7	Low	156 Å²	156	137.3 Å²	137.3	61%	0.612	62%	0.615	S	S	*	*	H	α-helix	trans	-63.9	-44.9	175.9	-177.4	-98.2	0	0	0	112.2	R479 H480 R486 K487	R479-Y483 PolarHBondContact O-N 2.88Å; R479-Y483 VanDerWaalsContact O-N 3.13Å; H480-Y483 PolarHBondContact O-N 2.92Å; Y483-R486 PolarHBondContact O-N 3.47Å; Y483-K487 PolarHBondContact O-N 3.1Å
484	Q	65.5	Low	56.9	Low	125 Å²	125	137 Å²	137	58%	0.584	61%	0.606	S	S	*	*	H	α-helix	trans	-64.4	-42.8	177.4	-74.9	-163.9	-10.4	0	0	112.5	H480 Q481 R486 K487 Q488	H480-Q484 PolarHBondContact O-N 3.29Å; Q481-Q484 PolarHBondContact O-N 3.3Å; Q484-R486 VanDerWaalsContact C-N 3.33Å; Q484-R486 PolarHBondContact O-N 3.31Å; Q484-K487 PolarHBondContact O-N 3.12Å; Q484-Q488 PolarHBondContact O-N 3.47Å
485	R	66.1	Low	58.4	Low	176 Å²	176	135.4 Å²	135.4	66%	0.664	60%	0.595	S	S	*	*	H	α-helix	trans	-59.3	-41.7	175.6	-75.9	-174.5	-177	-171	2.4	112.3	Q481 Q488 Q489	Q481-R485 WeakPolarHBondContact O-CG 3.28Å; Q481-R485 PolarHBondContact O-N 3.33Å; R485-Q488 PolarHBondContact O-N 2.9Å; R485-Q489 WeakPolarHBondContact O-CG 3.49Å; R485-Q489 PolarHBondContact O-N 3.48Å
486	R	60.7	Low	60	Low	105 Å²	105	132.4 Å²	132.4	40%	0.396	58%	0.583	S	S	.	*	H	α-helix	trans	-66.9	-40.4	176.5	-74.5	-177.5	175.2	-163.7	-2.4	112.5	E100 R482 Y483 Q484 Q488 Q489 H490	E100-R486 IonicContact OE1-NH1 3.19Å; E100-R486 IonicContact OE2-NH1 3.01Å; E100-R486 PolarHBondContact OE2-NH1 3.21Å; R482-R486 WeakPolarHBondContact O-CG 3.44Å; R482-R486 PolarHBondContact O-N 2.88Å; R482-R486 VanDerWaalsContact O-N 3.12Å; Y483-R486 PolarHBondContact O-N 3.47Å; Q484-R486 VanDerWaalsContact C-N 3.33Å; Q484-R486 PolarHBondContact O-N 3.31Å; R486-Q488 VanDerWaalsContact C-N 3.29Å; R486-Q488 PolarHBondContact O-N 3.42Å; R486-Q489 PolarHBondContact O-N 3.49Å; R486-H490 PolarHBondContact O-N 3Å
487	K	67.4	Low	60.9	Low	129 Å²	129	128 Å²	128	56%	0.561	57%	0.565	S	S	*	*	H	α-helix	trans	-60.5	-39.9	174.8	-170	178.5	178.7	-176.4	0	111.5	Y483 Q484 H490 L491	Y483-K487 PolarHBondContact O-N 3.1Å; Q484-K487 PolarHBondContact O-N 3.12Å; K487-H490 PolarHBondContact O-N 3.27Å; K487-L491 HydrophobicContact CG-CD1 4.47Å; K487-L491 PolarHBondContact O-N 3.18Å; K487-L491 VanDerWaalsContact O-N 3.11Å
488	Q	69.3	Low	61.3	Low	117 Å²	117	129 Å²	129	55%	0.547	57%	0.566	S	S	.	*	H	α-helix	trans	-71.9	-37.3	179.3	-140.5	162.3	8.6	0	0	112.4	Q484 R485 R486 L491 R492	Q484-Q488 PolarHBondContact O-N 3.47Å; R485-Q488 PolarHBondContact O-N 2.9Å; R486-Q488 VanDerWaalsContact C-N 3.29Å; R486-Q488 PolarHBondContact O-N 3.42Å; Q488-L491 PolarHBondContact O-N 2.83Å; Q488-R492 PolarHBondContact O-N 3.2Å
489	Q	67.3	Low	62	Low	134 Å²	134	127.1 Å²	127.1	63%	0.626	56%	0.56	S	S	*	*	H	α-helix	trans	-62.9	-41.2	171.5	-75	177.2	-7.4	0	0	112.2	R485 R486 L491 R492 A493	R485-Q489 WeakPolarHBondContact O-CG 3.49Å; R485-Q489 PolarHBondContact O-N 3.48Å; R486-Q489 PolarHBondContact O-N 3.49Å; Q489-L491 PolarHBondContact O-N 2.93Å; Q489-R492 PolarHBondContact O-N 3.05Å; Q489-A493 WeakPolarHBondContact O-CB 3Å; Q489-A493 PolarHBondContact O-N 3.33Å
490	H	61.1	Low	62.5	Low	135 Å²	135	122 Å²	122	63%	0.625	55%	0.547	S	S	*	.	H	α-helix	trans	-65.4	-35.3	175.8	-99.7	-65.1	0	0	0	113.6	R486 K487 R494	R486-H490 PolarHBondContact O-N 3Å; K487-H490 PolarHBondContact O-N 3.27Å; H490-R494 PolarHBondContact O-N 2.88Å; H490-R494 VanDerWaalsContact O-N 3.16Å
491	L	67.6	Low	62.4	Low	91 Å²	91	117.7 Å²	117.7	48%	0.476	53%	0.533	S	S	.	.	H	α-helix	trans	-67.9	-46.1	174.9	-80	159.9	0	0	0	111.5	K487 Q488 Q489 A493 R494 E495	K487-L491 HydrophobicContact CG-CD1 4.47Å; K487-L491 PolarHBondContact O-N 3.18Å; K487-L491 VanDerWaalsContact O-N 3.11Å; Q488-L491 PolarHBondContact O-N 2.83Å; Q489-L491 PolarHBondContact O-N 2.93Å; L491-A493 VanDerWaalsContact C-N 3.32Å; L491-A493 PolarHBondContact O-N 2.04Å; L491-R494 WeakPolarHBondContact O-CB 3.38Å; L491-R494 PolarHBondContact O-N 2.9Å; L491-R494 VanDerWaalsContact O-N 3.09Å; L491-E495 PolarHBondContact O-N 3.18Å
492	R	68.9	Low	61.9	Low	161 Å²	161	117.1 Å²	117.1	61%	0.608	53%	0.533	S	S	*	.	H	α-helix	trans	-61.1	-39.2	175	-73.9	-171.9	-165.2	164.5	3.5	112.9	Q488 Q489 R494 E495 L496	Q488-R492 PolarHBondContact O-N 3.2Å; Q489-R492 PolarHBondContact O-N 3.05Å; R492-R494 VanDerWaalsContact C-N 3.28Å; R492-R494 PolarHBondContact O-N 2.8Å; R492-E495 PolarHBondContact O-N 3.21Å; R492-L496 PolarHBondContact O-N 3.49Å
493	A	60.5	Low	61.4	Low	29 Å²	29	112.7 Å²	112.7	24%	0.24	52%	0.524	C	S	.	.	H	α-helix	trans	-63.1	-37	175.5	0	0	0	0	0	111.6	Q489 L491 I497	Q489-A493 WeakPolarHBondContact O-CB 3Å; Q489-A493 PolarHBondContact O-N 3.33Å; L491-A493 VanDerWaalsContact C-N 3.32Å; L491-A493 PolarHBondContact O-N 2.04Å; A493-I497 WeakPolarHBondContact O-CD1 3.17Å; A493-I497 VanDerWaalsContact O-CG1 3.23Å; A493-I497 WeakPolarHBondContact O-CG1 3.45Å; A493-I497 PolarHBondContact O-N 2.93Å; A493-I497 VanDerWaalsContact O-N 3.1Å
494	R	58.8	Low	60.7	Low	180 Å²	180	109.8 Å²	109.8	68%	0.679	52%	0.519	S	S	*	.	H	α-helix	trans	-67	-41.7	174	-90.8	-179.7	157.1	176.8	-6.5	113	H490 L491 R492 I497 N498	H490-R494 PolarHBondContact O-N 2.88Å; H490-R494 VanDerWaalsContact O-N 3.16Å; L491-R494 WeakPolarHBondContact O-CB 3.38Å; L491-R494 PolarHBondContact O-N 2.9Å; L491-R494 VanDerWaalsContact O-N 3.09Å; R492-R494 VanDerWaalsContact C-N 3.28Å; R492-R494 PolarHBondContact O-N 2.8Å; R494-I497 PolarHBondContact O-N 3.41Å; R494-N498 PolarHBondContact O-N 3.23Å
495	E	68.7	Low	59.6	Low	117 Å²	117	108.8 Å²	108.8	55%	0.547	52%	0.518	S	S	.	.	H	α-helix	trans	-64	-42.1	175.6	-75.2	171.5	175.5	0	0	111.8	L491 R492 I497 N498 N499	L491-E495 PolarHBondContact O-N 3.18Å; R492-E495 PolarHBondContact O-N 3.21Å; E495-I497 VanDerWaalsContact C-N 3.33Å; E495-I497 PolarHBondContact O-N 3.05Å; E495-N498 PolarHBondContact O-N 2.9Å; E495-N499 PolarHBondContact O-N 2.67Å
496	L	68	Low	58.5	Low	101 Å²	101	105.3 Å²	105.3	53%	0.529	51%	0.512	S	S	.	.	H	α-helix	trans	-61.2	-40.8	175.1	-80.2	164.1	0	0	0	112.2	R492 N499 I500	R492-L496 PolarHBondContact O-N 3.49Å; L496-N499 PolarHBondContact O-N 2.88Å; L496-I500 WeakPolarHBondContact O-CD1 3.47Å; L496-I500 VanDerWaalsContact O-CG1 3.24Å; L496-I500 WeakPolarHBondContact O-CG1 3.3Å; L496-I500 PolarHBondContact O-N 3.16Å
497	I	59.4	Low	57.6	Low	75 Å²	75	105.1 Å²	105.1	39%	0.385	52%	0.519	S	S	.	.	H	α-helix	trans	-64.9	-41.7	176.1	-69	164.8	0	0	0	110.8	I365 A493 R494 E495 I500 S501	I365-I497 HydrophobicContact CD1-CD1 4.34Å; A493-I497 WeakPolarHBondContact O-CD1 3.17Å; A493-I497 VanDerWaalsContact O-CG1 3.23Å; A493-I497 WeakPolarHBondContact O-CG1 3.45Å; A493-I497 PolarHBondContact O-N 2.93Å; A493-I497 VanDerWaalsContact O-N 3.1Å; R494-I497 PolarHBondContact O-N 3.41Å; E495-I497 VanDerWaalsContact C-N 3.33Å; E495-I497 PolarHBondContact O-N 3.05Å; I497-I500 PolarHBondContact O-N 3.24Å; I497-S501 PolarHBondContact O-N 2.9Å
498	N	59.4	Low	56.4	Low	100 Å²	100	104 Å²	104	54%	0.535	52%	0.519	S	S	.	.	H	α-helix	trans	-64.1	-40.7	176.7	-73.6	-5.6	0	0	0	111.9	R494 E495 S501 N502	R494-N498 PolarHBondContact O-N 3.23Å; E495-N498 PolarHBondContact O-N 2.9Å; N498-S501 PolarHBondContact O-N 3.35Å; N498-N502 PolarHBondContact O-N 3.23Å
499	N	63.7	Low	55	Low	97 Å²	97	103.4 Å²	103.4	52%	0.519	52%	0.52	S	S	.	.	H	α-helix	trans	-69.7	-35.3	178.3	-70.3	-3.5	0	0	0	112.6	E495 L496 S501 N503	E495-N499 PolarHBondContact O-N 2.67Å; L496-N499 PolarHBondContact O-N 2.88Å; N499-S501 VanDerWaalsContact C-N 3.33Å; N499-N503 WeakPolarHBondContact O-CB 3.39Å; N499-N503 PolarHBondContact O-N 3.25Å; N499-N503 VanDerWaalsContact O-N 3.07Å
500	I	55.9	Low	53.8	Low	93 Å²	93	102.6 Å²	102.6	48%	0.477	52%	0.52	S	S	.	.	H	α-helix	trans	-69.4	-34.2	173.6	-66.7	165.2	0	0	0	110.9	L496 I497 N504	L496-I500 WeakPolarHBondContact O-CD1 3.47Å; L496-I500 VanDerWaalsContact O-CG1 3.24Å; L496-I500 WeakPolarHBondContact O-CG1 3.3Å; L496-I500 PolarHBondContact O-N 3.16Å; I497-I500 PolarHBondContact O-N 3.24Å; I500-N504 PolarHBondContact O-N 3.39Å; I500-N504 PolarHBondContact O-ND2 3.27Å
501	S	48.7	Very low	52.8	Low	49 Å²	49	102.1 Å²	102.1	34%	0.343	52%	0.52	S	S	.	.	H	α-helix	trans	-67.4	-40.5	175.7	-162.5	0	0	0	0	111.9	I497 N498 N499	I497-S501 PolarHBondContact O-N 2.9Å; N498-S501 PolarHBondContact O-N 3.35Å; N499-S501 VanDerWaalsContact C-N 3.33Å
502	N	48.1	Very low	51.5	Low	97 Å²	97	103.6 Å²	103.6	52%	0.519	53%	0.528	S	S	.	.	H	α-helix	trans	-72.1	-39.7	179.5	-70.1	-6	0	0	0	112.3	N498 N504 D505 D506	N498-N502 PolarHBondContact O-N 3.23Å; N502-N504 PolarHBondContact O-N 3.1Å; N502-D505 PolarHBondContact O-N 2.92Å; N502-D506 PolarHBondContact O-N 3.42Å
503	N	45.9	Very low	50.2	Low	100 Å²	100	102.3 Å²	102.3	54%	0.535	53%	0.533	S	S	.	.	H	α-helix	trans	-71.1	-16.4	179.4	-74.5	-2	0	0	0	114.2	N499 N507	N499-N503 WeakPolarHBondContact O-CB 3.39Å; N499-N503 PolarHBondContact O-N 3.25Å; N499-N503 VanDerWaalsContact O-N 3.07Å; N503-N507 PolarHBondContact O-ND2 3.08Å
504	N	44.7	Very low	49.3	Very low	95 Å²	95	110 Å²	110	51%	0.508	56%	0.561	S	S	.	*	H	α-helix	trans	-87	-18.9	174.2	-78.5	-20.1	0	0	0	113	I500 N502 N508	I500-N504 PolarHBondContact O-N 3.39Å; I500-N504 PolarHBondContact O-ND2 3.27Å; N502-N504 PolarHBondContact O-N 3.1Å; N504-N508 PolarHBondContact O-ND2 3.41Å
505	D	41.9	Very low	48.3	Very low	103 Å²	103	107.3 Å²	107.3	55%	0.551	56%	0.564	S	S	*	*	H	α-helix	trans	-83	-31.6	173.3	-74	-23.6	0	0	0	111.1	N502	N502-D505 PolarHBondContact O-N 2.92Å
506	D	42.9	Very low	46.8	Very low	104 Å²	104	106.6 Å²	106.6	56%	0.556	57%	0.572	S	S	*	*	H	α-helix	trans	-75.1	-37	176.8	-69.8	-28.9	0	0	0	113	N502 N508 N509	N502-D506 PolarHBondContact O-N 3.42Å; D506-N508 VanDerWaalsContact C-N 3.27Å; D506-N508 PolarHBondContact O-N 2.97Å; D506-N509 PolarHBondContact O-N 2.97Å
507	N	42.1	Very low	45.3	Very low	100 Å²	100	107.3 Å²	107.3	54%	0.535	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.7	-12.5	178.5	-80.6	-37.6	0	0	0	114.5	N503 I511	N503-N507 PolarHBondContact O-ND2 3.08Å; N507-I511 WeakPolarHBondContact O-CD1 3.44Å
508	N	41.8	Very low	44.6	Very low	105 Å²	105	109.4 Å²	109.4	56%	0.561	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	-12	174	-86.9	-32.2	0	0	0	113.3	N504 D506	N504-N508 PolarHBondContact O-ND2 3.41Å; D506-N508 VanDerWaalsContact C-N 3.27Å; D506-N508 PolarHBondContact O-N 2.97Å
509	N	40.1	Very low	43.5	Very low	105 Å²	105	112.5 Å²	112.5	56%	0.561	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-23.1	175.4	-73.3	-28.9	0	0	0	113	D506	D506-N509 PolarHBondContact O-N 2.97Å
510	D	40.8	Very low	42.3	Very low	117 Å²	117	113.1 Å²	113.1	63%	0.626	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-13	176.2	-79.6	-22.6	0	0	0	114.4
511	I	41	Very low	41	Very low	125 Å²	125	121.4 Å²	121.4	64%	0.641	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-16.6	176	-62.7	176.3	0	0	0	111.7	N507	N507-I511 WeakPolarHBondContact O-CD1 3.44Å
512	I	41	Very low	40.6	Very low	123 Å²	123	125.1 Å²	125.1	63%	0.631	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-16.2	179.4	-63.9	176.7	0	0	0	112.4
513	N	40.5	Very low	40.2	Very low	133 Å²	133	126.5 Å²	126.5	71%	0.711	70%	0.695	S	S	*	*	S	Bend	trans	-99.1	10.8	-179.9	-79.4	-16.4	0	0	0	115.6
514	K	40.7	Very low	39.9	Very low	192 Å²	192	128 Å²	128	84%	0.835	70%	0.704	S	S	*	*	S	Bend	trans	-120.9	9.6	177.5	-87.2	-177.6	176.9	175.4	0	115.9
515	T	38.2	Very low	39.6	Very low	122 Å²	122	129.9 Å²	129.9	75%	0.748	72%	0.715	S	S	*	*	S	Bend	trans	-120.8	64.3	173.2	45.4	0	0	0	0	110.6
516	S	37.3	Very low	39.5	Very low	102 Å²	102	131.6 Å²	131.6	71%	0.713	73%	0.726	S	S	*	*			trans	-160.7	83.4	162.9	45.8	0	0	0	0	110
517	S	36	Very low	39.2	Very low	116 Å²	116	133.5 Å²	133.5	81%	0.811	74%	0.737	S	S	*	*			trans	-146.3	135.6	147.3	-90	0	0	0	0	109
518	P	44.7	Very low	39	Very low	120 Å²	120	135.9 Å²	135.9	78%	0.779	75%	0.751	S	S	*	*			trans	-82.1	135.4	-173.1	16.7	-0.6	0	0	0	110.1
519	N	36.6	Very low	38.8	Very low	164 Å²	164	138.2 Å²	138.2	88%	0.877	77%	0.766	S	S	*	*			trans	-70.4	121.8	154	-74.2	-24.4	0	0	0	107.7
520	S	39.3	Very low	38.7	Very low	111 Å²	111	141 Å²	141	78%	0.776	78%	0.783	S	S	*	*			trans	178.9	143	136.2	25.3	0	0	0	0	109.8
521	E	28.2	Very low	38.5	Very low	267 Å²	267	143.2 Å²	143.2	100%	1.248	80%	0.797	S	S	*	*			trans	-39.3	0	147.8	-69.9	170.9	132.8	0	0	113.5

Retrieved 521 of 521 residues in 1081.8 ms (Link to these results)

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