A0A3Q0KBI4_SCHMA Loading...

Cytochrome b561 domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KBI4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 296 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	48.9	Very low	42.5	Very low	252 Å²	252	165.3 Å²	165.3	100%	1.241	83%	0.831	S	S	*	*				0	118.8	0	-78.3	164.9	156.7	0	0	108.5
2	K	38.2	Very low	42	Very low	203 Å²	203	160.5 Å²	160.5	88%	0.883	83%	0.825	S	S	*	*			trans	-96.4	132.4	-179.3	-69.9	172.4	176.5	174.1	0	108.1
3	H	44.9	Very low	41.9	Very low	192 Å²	192	158.1 Å²	158.1	89%	0.889	82%	0.815	S	S	*	*			trans	-138.7	102.3	150.9	-107.1	-83.2	0	0	0	109.5
4	K	40.2	Very low	41.5	Very low	193 Å²	193	157.9 Å²	157.9	84%	0.839	82%	0.816	S	S	*	*			trans	-60.5	135.4	160.2	-93.2	174.5	165.5	-178.7	0	108.3
5	L	44.7	Very low	41.5	Very low	163 Å²	163	163.2 Å²	163.2	85%	0.853	82%	0.821	S	S	*	*			trans	-119.1	105.2	146.1	-134.2	89.1	0	0	0	107.5
6	A	42.2	Very low	41.6	Very low	81 Å²	81	165.5 Å²	165.5	67%	0.669	82%	0.817	S	S	*	*			trans	-85.9	123.2	174.6	0	0	0	0	0	108.6
7	I	45.4	Very low	41.8	Very low	154 Å²	154	168.1 Å²	168.1	79%	0.79	82%	0.823	S	S	*	*			trans	-111.2	102.3	160.3	-61	177	0	0	0	105.8
8	H	40	Very low	42.2	Very low	165 Å²	165	164.6 Å²	164.6	76%	0.764	80%	0.804	S	S	*	*			trans	-96.8	113.8	173.1	-127.8	-78.2	0	0	0	107.2	N10	H8-N10 PolarHBondContact O-N 3.41Å
9	P	47.1	Very low	42.8	Very low	104 Å²	104	160 Å²	160	68%	0.675	79%	0.788	S	S	*	*			trans	-81.9	105.7	163.1	29.6	-25.9	0	0	0	108	H11	P9-H11 VanDerWaalsContact C-N 3.32Å; P9-H11 PolarHBondContact O-N 3.24Å
10	N	34.4	Very low	43.9	Very low	143 Å²	143	160.7 Å²	160.7	77%	0.765	79%	0.786	S	S	*	*			trans	-64	90.4	164.4	-109.5	-18.2	0	0	0	108.9	H8 S12	H8-N10 PolarHBondContact O-N 3.41Å; N10-S12 VanDerWaalsContact C-N 3.35Å
11	H	41.2	Very low	45.1	Very low	168 Å²	168	163.3 Å²	163.3	78%	0.778	79%	0.788	S	S	*	*			trans	-98	65.5	161.4	-107.6	-50.8	0	0	0	109.6	P9 N13	P9-H11 VanDerWaalsContact C-N 3.32Å; P9-H11 PolarHBondContact O-N 3.24Å; H11-N13 PolarHBondContact O-N 2.77Å
12	S	37	Very low	46.4	Very low	108 Å²	108	154.6 Å²	154.6	76%	0.755	75%	0.751	S	S	*	*			trans	-70.4	77.1	158.3	56.7	0	0	0	0	108.4	N10	N10-S12 VanDerWaalsContact C-N 3.35Å
13	N	40.3	Very low	48.3	Very low	129 Å²	129	146.4 Å²	146.4	69%	0.69	72%	0.718	S	S	*	*			trans	-117.9	104.7	168.1	-141.2	-6	0	0	0	108.5	H11 R15	H11-N13 PolarHBondContact O-N 2.77Å; N13-R15 PolarHBondContact O-N 3.12Å
14	N	36.7	Very low	50	Low	156 Å²	156	139.9 Å²	139.9	83%	0.834	69%	0.689	S	S	*	*			trans	-33.6	92.3	170	-97.3	-30.5	0	0	0	111.5	R16	N14-R16 PolarHBondContact O-N 3.38Å
15	R	41.3	Very low	52.1	Low	237 Å²	237	135.1 Å²	135.1	89%	0.894	67%	0.672	S	S	*	*			trans	-66.1	88.1	161.5	-89	-175.7	172.7	-179.1	-0.7	106.1	N13 K17	N13-R15 PolarHBondContact O-N 3.12Å; R15-K17 VanDerWaalsContact C-N 3.32Å; R15-K17 PolarHBondContact O-N 3.46Å
16	R	44	Very low	54.1	Low	200 Å²	200	129.2 Å²	129.2	76%	0.755	64%	0.643	S	S	*	*			trans	-49.1	103.1	159.9	-73.5	-176.3	176.3	-177.7	-2.2	106.3	N14 H18	N14-R16 PolarHBondContact O-N 3.38Å; R16-H18 VanDerWaalsContact CB-CD2 3.47Å; R16-H18 WeakPolarHBondContact CB-CD2 3.38Å; R16-H18 WeakPolarHBondContact CD-NE2 3.41Å; R16-H18 PolarHBondContact O-N 2.98Å
17	K	43.5	Very low	56.3	Low	209 Å²	209	125.4 Å²	125.4	91%	0.909	61%	0.611	S	S	*	*			trans	-66	77	171.1	-75.6	179.6	177.6	175.7	0	107	R15	R15-K17 VanDerWaalsContact C-N 3.32Å; R15-K17 PolarHBondContact O-N 3.46Å
18	H	48.9	Very low	58.3	Low	106 Å²	106	121.9 Å²	121.9	49%	0.491	59%	0.591	S	S	.	*			trans	-68	141.4	-179.6	-91.2	-76.6	0	0	0	110.4	R16 K20	R16-H18 VanDerWaalsContact CB-CD2 3.47Å; R16-H18 WeakPolarHBondContact CB-CD2 3.38Å; R16-H18 WeakPolarHBondContact CD-NE2 3.41Å; R16-H18 PolarHBondContact O-N 2.98Å; H18-K20 PolarHBondContact O-N 3.08Å
19	P	54.7	Low	60.7	Low	77 Å²	77	118.4 Å²	118.4	50%	0.5	58%	0.577	S	S	.	*			trans	-78.6	76.7	-163.7	33.6	-37.4	0	0	0	111.7	R21 C22	P19-R21 PolarHBondContact O-N 3.38Å; P19-C22 HydrophobicContact CB-CB 3.93Å; P19-C22 HydrophobicContact CG-CB 4.27Å; P19-C22 PolarHBondContact O-N 3.11Å
20	K	64.1	Low	62.8	Low	173 Å²	173	113.5 Å²	113.5	75%	0.752	55%	0.545	S	S	*	.	H	α-helix	trans	-53.8	-26.2	177.5	-67	-177	179.7	177.9	0	113.5	H18 T23	H18-K20 PolarHBondContact O-N 3.08Å; K20-T23 PolarHBondContact O-OG1 3.25Å
21	R	70.4	Confident	65.4	Low	216 Å²	216	108.5 Å²	108.5	82%	0.815	52%	0.518	S	S	*	.	H	α-helix	trans	-76	-39.6	178.7	-65.9	-173.7	179.2	-174.1	-0.6	112.5	P19 L24 I25	P19-R21 PolarHBondContact O-N 3.38Å; R21-L24 PolarHBondContact O-N 3.04Å; R21-I25 WeakPolarHBondContact O-CD1 3.42Å; R21-I25 VanDerWaalsContact O-CG1 3.29Å; R21-I25 WeakPolarHBondContact O-CG1 3.49Å; R21-I25 PolarHBondContact O-N 3.44Å
22	C	75.8	Confident	67.9	Low	69 Å²	69	102.1 Å²	102.1	47%	0.466	50%	0.498	S	S	.	.	H	α-helix	trans	-64.7	-44.7	-176.7	-173.9	0	0	0	0	111.6	P19 L24 I25 V26	P19-C22 HydrophobicContact CB-CB 3.93Å; P19-C22 HydrophobicContact CG-CB 4.27Å; P19-C22 PolarHBondContact O-N 3.11Å; C22-L24 VanDerWaalsContact C-N 3.28Å; C22-L24 PolarHBondContact O-N 3.4Å; C22-I25 WeakPolarHBondContact O-CB 3.4Å; C22-I25 PolarHBondContact O-N 2.93Å; C22-I25 VanDerWaalsContact O-N 3.14Å; C22-V26 WeakPolarHBondContact O-CG2 3.36Å; C22-V26 PolarHBondContact O-N 3.42Å
23	T	77.9	Confident	70.5	Confident	32 Å²	32	99 Å²	99	20%	0.196	47%	0.473	C	S	.	.	H	α-helix	trans	-64.2	-32.8	179.4	52.9	0	0	0	0	113.2	K20 Y27 R275	K20-T23 PolarHBondContact O-OG1 3.25Å; T23-Y27 PolarHBondContact O-N 3.32Å; T23-R275 HydrophobicContact CG2-CB 4.34Å; T23-R275 HydrophobicContact CG2-CG 3.83Å
24	L	79.9	Confident	73	Confident	54 Å²	54	92.9 Å²	92.9	28%	0.283	44%	0.44	S	S	.	.	H	α-helix	trans	-73.8	-36	176.5	-173.9	140.8	0	0	0	111.2	R21 C22 Y27 H28	R21-L24 PolarHBondContact O-N 3.04Å; C22-L24 VanDerWaalsContact C-N 3.28Å; C22-L24 PolarHBondContact O-N 3.4Å; L24-Y27 PolarHBondContact O-N 3.11Å; L24-H28 VanDerWaalsContact CD2-CD2 3.46Å; L24-H28 WeakPolarHBondContact CD2-CD2 3.37Å; L24-H28 PolarHBondContact O-CD2 3.3Å; L24-H28 PolarHBondContact O-N 2.97Å; L24-H28 VanDerWaalsContact O-N 3.1Å
25	I	84.9	Confident	75.7	Confident	94 Å²	94	90.5 Å²	90.5	48%	0.482	42%	0.422	S	S	.	.	H	α-helix	trans	-62.7	-45.9	172.6	-67.4	162.7	0	0	0	110.3	R21 C22 Y27 H28 I29	R21-I25 WeakPolarHBondContact O-CD1 3.42Å; R21-I25 VanDerWaalsContact O-CG1 3.29Å; R21-I25 WeakPolarHBondContact O-CG1 3.49Å; R21-I25 PolarHBondContact O-N 3.44Å; C22-I25 WeakPolarHBondContact O-CB 3.4Å; C22-I25 PolarHBondContact O-N 2.93Å; C22-I25 VanDerWaalsContact O-N 3.14Å; I25-Y27 VanDerWaalsContact C-N 3.27Å; I25-Y27 PolarHBondContact O-N 3.17Å; I25-H28 PolarHBondContact O-N 3.43Å; I25-I29 HydrophobicContact CG2-CD1 3.76Å; I25-I29 HydrophobicContact CG2-CG1 4.28Å; I25-I29 WeakPolarHBondContact O-CG1 3.44Å; I25-I29 PolarHBondContact O-N 3.25Å
26	V	87.3	Confident	78.2	Confident	38 Å²	38	83.1 Å²	83.1	23%	0.23	40%	0.4	C	S	.	.	H	α-helix	trans	-57.8	-40.5	177	173.7	0	0	0	0	111.5	C22 I29 S30 A268	C22-V26 WeakPolarHBondContact O-CG2 3.36Å; C22-V26 PolarHBondContact O-N 3.42Å; V26-I29 PolarHBondContact O-N 3.41Å; V26-S30 PolarHBondContact O-N 2.97Å; V26-A268 HydrophobicContact CG1-CB 3.75Å
27	Y	86.9	Confident	80.5	Confident	1 Å²	1	73.6 Å²	73.6	0%	0.004	36%	0.364	C	S	.	.	H	α-helix	trans	-65.7	-35.5	175	-172.2	-104.7	0	0	0	113.1	T23 L24 I25 S30 L31 H122 A126 E140 Y272	T23-Y27 PolarHBondContact O-N 3.32Å; L24-Y27 PolarHBondContact O-N 3.11Å; I25-Y27 VanDerWaalsContact C-N 3.27Å; I25-Y27 PolarHBondContact O-N 3.17Å; Y27-S30 PolarHBondContact O-N 2.91Å; Y27-S30 PolarHBondContact O-OG 2.78Å; Y27-L31 PolarHBondContact O-N 2.95Å; Y27-H122 AromaticContact CD1-NE2 3.72Å; Y27-H122 AromaticContact CD2-CE1 3.6Å; Y27-H122 AromaticContact CE1-CE1 3.71Å; Y27-H122 AromaticContact CE1-NE2 3.34Å; Y27-H122 VanDerWaalsContact CE1-NE2 3.34Å; Y27-H122 WeakPolarHBondContact CE1-NE2 3.39Å; Y27-H122 AromaticContact CE2-CE1 3.14Å; Y27-H122 WeakPolarHBondContact CE2-CE1 3.43Å; Y27-H122 AromaticContact CE2-ND1 3.81Å; Y27-H122 AromaticContact CE2-NE2 3.7Å; Y27-H122 AromaticContact CZ-CD2 3.9Å; Y27-H122 AromaticContact CZ-CE1 3.19Å; Y27-H122 AromaticContact CZ-ND1 3.75Å; Y27-H122 AromaticContact CZ-NE2 3.31Å; Y27-H122 VanDerWaalsContact CZ-NE2 3.31Å; Y27-H122 PolarHBondContact O-NE2 2.97Å; Y27-A126 HydrophobicContact CE1-CB 4.42Å; Y27-E140 PolarHBondContact OH-OE2 3.35Å; Y27-Y272 AromaticContact CD2-CD1 3.44Å; Y27-Y272 HydrophobicContact CD2-CD1 3.44Å; Y27-Y272 VanDerWaalsContact CD2-CD1 3.44Å; Y27-Y272 HydrophobicContact CD2-CD2 4.34Å; Y27-Y272 AromaticContact CD2-CE1 3.97Å; Y27-Y272 HydrophobicContact CD2-CE1 3.97Å; Y27-Y272 AromaticContact CD2-CG 3.66Å; Y27-Y272 HydrophobicContact CD2-CG 3.66Å; Y27-Y272 AromaticContact CE2-CD1 3.8Å; Y27-Y272 HydrophobicContact CE2-CD1 3.8Å; Y27-Y272 HydrophobicContact CE2-CE1 4.13Å; Y27-Y272 HydrophobicContact CE2-CG 4.46Å; Y27-Y272 HydrophobicContact CG-CD1 4.07Å; Y27-Y272 HydrophobicContact CG-CD2 4.3Å; Y27-Y272 HydrophobicContact CG-CE1 4.3Å; Y27-Y272 HydrophobicContact CG-CG 4.07Å
28	H	87.7	Confident	82.8	Confident	81 Å²	81	64.3 Å²	64.3	38%	0.375	32%	0.324	S	S	.	.	H	α-helix	trans	-74	-31.8	173.5	-73.4	-64.2	0	0	0	112.9	L24 I25 S30 L31 G32	L24-H28 VanDerWaalsContact CD2-CD2 3.46Å; L24-H28 WeakPolarHBondContact CD2-CD2 3.37Å; L24-H28 PolarHBondContact O-CD2 3.3Å; L24-H28 PolarHBondContact O-N 2.97Å; L24-H28 VanDerWaalsContact O-N 3.1Å; I25-H28 PolarHBondContact O-N 3.43Å; H28-S30 VanDerWaalsContact C-N 3.31Å; H28-L31 WeakPolarHBondContact O-CB 3.44Å; H28-L31 PolarHBondContact O-N 2.95Å; H28-G32 PolarHBondContact O-N 2.96Å
29	I	90.9	Very high	84.9	Confident	92 Å²	92	62.6 Å²	62.6	47%	0.472	32%	0.317	S	S	.	.	H	α-helix	trans	-64	-40	172.7	-68.1	167.7	0	0	0	110	I25 V26 L31 G32 L33	I25-I29 HydrophobicContact CG2-CD1 3.76Å; I25-I29 HydrophobicContact CG2-CG1 4.28Å; I25-I29 WeakPolarHBondContact O-CG1 3.44Å; I25-I29 PolarHBondContact O-N 3.25Å; V26-I29 PolarHBondContact O-N 3.41Å; I29-L31 VanDerWaalsContact C-N 3.28Å; I29-L31 PolarHBondContact O-N 3.16Å; I29-G32 PolarHBondContact O-N 2.98Å; I29-G32 VanDerWaalsContact O-N 3.09Å; I29-L33 HydrophobicContact CG2-CD1 4Å; I29-L33 HydrophobicContact CG2-CG 4.24Å; I29-L33 WeakPolarHBondContact O-CG 3.36Å; I29-L33 PolarHBondContact O-N 3.22Å
30	S	90	Very high	86.7	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62.6	-34.8	178.3	67.6	0	0	0	0	112.8	V26 Y27 H28 L33 L34 H122 S265 V269	V26-S30 PolarHBondContact O-N 2.97Å; Y27-S30 PolarHBondContact O-N 2.91Å; Y27-S30 PolarHBondContact O-OG 2.78Å; H28-S30 VanDerWaalsContact C-N 3.31Å; S30-L33 PolarHBondContact O-N 2.87Å; S30-L34 VanDerWaalsContact O-CB 3.28Å; S30-L34 WeakPolarHBondContact O-CB 3.48Å; S30-L34 PolarHBondContact O-N 3.32Å; S30-H122 PolarHBondContact OG-CE1 2.85Å; S30-S265 PolarHBondContact O-OG 3.47Å; S30-V269 WeakPolarHBondContact OG-CG2 3.47Å
31	L	90.8	Very high	87.9	Confident	39 Å²	39	52.4 Å²	52.4	20%	0.204	27%	0.267	C	S	.	.	H	α-helix	trans	-60.5	-45.3	172	-179.4	62.8	0	0	0	111.8	Y27 H28 I29 L34 F35 F119 H122 I123	Y27-L31 PolarHBondContact O-N 2.95Å; H28-L31 WeakPolarHBondContact O-CB 3.44Å; H28-L31 PolarHBondContact O-N 2.95Å; I29-L31 VanDerWaalsContact C-N 3.28Å; I29-L31 PolarHBondContact O-N 3.16Å; L31-L34 PolarHBondContact O-N 3.18Å; L31-F35 PolarHBondContact O-N 2.81Å; L31-F119 HydrophobicContact CD1-CD2 3.66Å; L31-F119 HydrophobicContact CD1-CE2 3.32Å; L31-F119 HydrophobicContact CD1-CZ 4.18Å; L31-F119 HydrophobicContact CG-CE2 4.21Å; L31-H122 HydrophobicContact CD1-CB 4.31Å; L31-I123 HydrophobicContact CD1-CG1 3.85Å
32	G	92.1	Very high	88.9	Confident	34 Å²	34	45.6 Å²	45.6	35%	0.351	25%	0.246	S	C	.	.	H	α-helix	trans	-63.7	-44.9	177.5	0	0	0	0	0	112.3	H28 I29 F35 I36	H28-G32 PolarHBondContact O-N 2.96Å; I29-G32 PolarHBondContact O-N 2.98Å; I29-G32 VanDerWaalsContact O-N 3.09Å; G32-F35 PolarHBondContact O-N 2.81Å; G32-I36 VanDerWaalsContact O-CG1 3.29Å; G32-I36 WeakPolarHBondContact O-CG1 3.47Å; G32-I36 PolarHBondContact O-N 2.76Å; G32-I36 VanDerWaalsContact O-N 3.07Å
33	L	93.4	Very high	89.5	Confident	43 Å²	43	45.8 Å²	45.8	23%	0.225	24%	0.242	C	C	.	.	H	α-helix	trans	-61.1	-45.1	175.1	-69.3	173.6	0	0	0	111.5	I29 S30 F35 I36 G37 I261 L264	I29-L33 HydrophobicContact CG2-CD1 4Å; I29-L33 HydrophobicContact CG2-CG 4.24Å; I29-L33 WeakPolarHBondContact O-CG 3.36Å; I29-L33 PolarHBondContact O-N 3.22Å; S30-L33 PolarHBondContact O-N 2.87Å; L33-F35 VanDerWaalsContact C-N 3.31Å; L33-F35 PolarHBondContact O-N 3.36Å; L33-I36 PolarHBondContact O-N 3.45Å; L33-G37 PolarHBondContact O-N 2.92Å; L33-I261 HydrophobicContact CB-CG2 4.12Å; L33-I261 HydrophobicContact CD2-CG2 4.37Å; L33-I261 WeakPolarHBondContact O-CG2 3.31Å; L33-L264 HydrophobicContact CD1-CB 4.09Å
34	L	91.8	Very high	89.8	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.7	-43.3	179.3	-174.1	57.8	0	0	0	111.6	S30 L31 G37 I38 F119 L144 Y262	S30-L34 VanDerWaalsContact O-CB 3.28Å; S30-L34 WeakPolarHBondContact O-CB 3.48Å; S30-L34 PolarHBondContact O-N 3.32Å; L31-L34 PolarHBondContact O-N 3.18Å; L34-G37 PolarHBondContact O-N 2.96Å; L34-I38 HydrophobicContact CG-CD1 4.31Å; L34-I38 WeakPolarHBondContact O-CG1 3.38Å; L34-I38 PolarHBondContact O-N 3.16Å; L34-F119 HydrophobicContact CB-CD2 4.33Å; L34-F119 HydrophobicContact CD2-CB 3.79Å; L34-F119 HydrophobicContact CD2-CD2 3.94Å; L34-F119 HydrophobicContact CD2-CG 4.39Å; L34-F119 HydrophobicContact CG-CB 4.2Å; L34-F119 HydrophobicContact CG-CD2 4Å; L34-L144 HydrophobicContact CD1-CD2 3.42Å; L34-L144 VanDerWaalsContact CD1-CD2 3.42Å; L34-L144 HydrophobicContact CD2-CD2 3.99Å; L34-L144 HydrophobicContact CG-CD2 4.36Å; L34-Y262 HydrophobicContact CD1-CD1 3.65Å; L34-Y262 HydrophobicContact CD1-CE1 3.66Å
35	F	93.3	Very high	90.1	Very high	105 Å²	105	42.1 Å²	42.1	46%	0.461	22%	0.221	S	C	.	.	H	α-helix	trans	-61.6	-46.3	176.6	-176	-113.7	0	0	0	112.3	L31 G32 L33 G37 I38 I39 F119	L31-F35 PolarHBondContact O-N 2.81Å; G32-F35 PolarHBondContact O-N 2.81Å; L33-F35 VanDerWaalsContact C-N 3.31Å; L33-F35 PolarHBondContact O-N 3.36Å; F35-G37 VanDerWaalsContact C-N 3.33Å; F35-G37 PolarHBondContact O-N 3.26Å; F35-I38 PolarHBondContact O-N 2.89Å; F35-I39 HydrophobicContact CD1-CD1 3.84Å; F35-I39 HydrophobicContact CE1-CD1 3.37Å; F35-I39 HydrophobicContact CE2-CD1 4.19Å; F35-I39 HydrophobicContact CG-CD1 4.43Å; F35-I39 HydrophobicContact CZ-CD1 3.58Å; F35-I39 HydrophobicContact CZ-CG1 4.43Å; F35-I39 WeakPolarHBondContact O-CG1 3.31Å; F35-I39 PolarHBondContact O-N 3.41Å; F35-I39 VanDerWaalsContact O-N 3.08Å; F35-F119 HydrophobicContact CB-CE2 3.74Å; F35-F119 HydrophobicContact CB-CZ 4.15Å; F35-F119 HydrophobicContact CD2-CE1 4.2Å; F35-F119 HydrophobicContact CD2-CE2 4.03Å; F35-F119 AromaticContact CD2-CZ 3.59Å; F35-F119 HydrophobicContact CD2-CZ 3.59Å; F35-F119 HydrophobicContact CE2-CZ 4.41Å; F35-F119 HydrophobicContact CG-CE2 4.32Å; F35-F119 HydrophobicContact CG-CZ 4.23Å
36	I	93.8	Very high	90	Very high	82 Å²	82	42.4 Å²	42.4	42%	0.421	23%	0.227	S	C	.	.	H	α-helix	trans	-61.5	-44.2	177.1	-65.8	164.4	0	0	0	110.2	G32 L33 I38 I39 L40 I261	G32-I36 VanDerWaalsContact O-CG1 3.29Å; G32-I36 WeakPolarHBondContact O-CG1 3.47Å; G32-I36 PolarHBondContact O-N 2.76Å; G32-I36 VanDerWaalsContact O-N 3.07Å; L33-I36 PolarHBondContact O-N 3.45Å; I36-I38 VanDerWaalsContact C-N 3.35Å; I36-I38 PolarHBondContact O-N 3.09Å; I36-I39 PolarHBondContact O-N 3.49Å; I36-L40 HydrophobicContact CG2-CD1 4.19Å; I36-L40 HydrophobicContact CG2-CG 4.35Å; I36-L40 WeakPolarHBondContact O-CG 3.49Å; I36-L40 PolarHBondContact O-N 2.83Å; I36-I261 HydrophobicContact CG2-CD1 3.82Å
37	G	92.5	Very high	89.8	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-58.5	-43.1	176.6	0	0	0	0	0	112.7	L33 L34 F35 L40 T41 Y262	L33-G37 PolarHBondContact O-N 2.92Å; L34-G37 PolarHBondContact O-N 2.96Å; F35-G37 VanDerWaalsContact C-N 3.33Å; F35-G37 PolarHBondContact O-N 3.26Å; G37-L40 PolarHBondContact O-N 3.44Å; G37-T41 WeakPolarHBondContact O-CB 3.48Å; G37-T41 PolarHBondContact O-N 3Å; G37-T41 PolarHBondContact O-OG1 3.47Å; G37-Y262 PolarHBondContact O-OH 3.02Å
38	I	92.6	Very high	89.1	Confident	14 Å²	14	47 Å²	47	7%	0.072	25%	0.247	C	C	.	.	H	α-helix	trans	-61.1	-46.8	175.3	-67.9	166	0	0	0	111.3	L34 F35 I36 L40 T41 I42 L112 A115 I116 F119 Y262	L34-I38 HydrophobicContact CG-CD1 4.31Å; L34-I38 WeakPolarHBondContact O-CG1 3.38Å; L34-I38 PolarHBondContact O-N 3.16Å; F35-I38 PolarHBondContact O-N 2.89Å; I36-I38 VanDerWaalsContact C-N 3.35Å; I36-I38 PolarHBondContact O-N 3.09Å; I38-L40 PolarHBondContact O-N 2.93Å; I38-T41 PolarHBondContact O-N 3.02Å; I38-I42 HydrophobicContact CG2-CD1 3.77Å; I38-I42 HydrophobicContact CG2-CG1 4.44Å; I38-I42 VanDerWaalsContact O-CG1 3.29Å; I38-I42 WeakPolarHBondContact O-CG1 3.45Å; I38-I42 PolarHBondContact O-N 2.89Å; I38-L112 HydrophobicContact CG2-CD1 4.31Å; I38-A115 HydrophobicContact CG1-CB 4.11Å; I38-I116 HydrophobicContact CD1-CG1 4.5Å; I38-I116 HydrophobicContact CG2-CG1 4.3Å; I38-F119 HydrophobicContact CD1-CB 3.66Å; I38-F119 HydrophobicContact CD1-CD1 4.48Å; I38-F119 HydrophobicContact CD1-CD2 4.3Å; I38-F119 HydrophobicContact CD1-CG 3.92Å; I38-Y262 WeakPolarHBondContact CA-OH 3.3Å; I38-Y262 HydrophobicContact CG1-CE1 4.03Å; I38-Y262 WeakPolarHBondContact CG1-OH 3.32Å; I38-Y262 PolarHBondContact N-OH 3.29Å
39	I	93.4	Very high	88.3	Confident	70 Å²	70	50.8 Å²	50.8	36%	0.359	26%	0.258	S	S	.	.	H	α-helix	trans	-61	-48.2	178.8	-68.9	170.7	0	0	0	110.6	F35 I36 T41 I42 I43	F35-I39 HydrophobicContact CD1-CD1 3.84Å; F35-I39 HydrophobicContact CE1-CD1 3.37Å; F35-I39 HydrophobicContact CE2-CD1 4.19Å; F35-I39 HydrophobicContact CG-CD1 4.43Å; F35-I39 HydrophobicContact CZ-CD1 3.58Å; F35-I39 HydrophobicContact CZ-CG1 4.43Å; F35-I39 WeakPolarHBondContact O-CG1 3.31Å; F35-I39 PolarHBondContact O-N 3.41Å; F35-I39 VanDerWaalsContact O-N 3.08Å; I36-I39 PolarHBondContact O-N 3.49Å; I39-T41 VanDerWaalsContact C-N 3.29Å; I39-T41 PolarHBondContact O-N 3.24Å; I39-I42 PolarHBondContact O-N 3.36Å; I39-I43 HydrophobicContact CG2-CD1 3.64Å; I39-I43 HydrophobicContact CG2-CG1 4.37Å; I39-I43 VanDerWaalsContact O-CG1 3.28Å; I39-I43 WeakPolarHBondContact O-CG1 3.38Å; I39-I43 PolarHBondContact O-N 3.44Å
40	L	91.8	Very high	87.3	Confident	35 Å²	35	46.6 Å²	46.6	18%	0.183	24%	0.237	C	C	.	.	H	α-helix	trans	-63.1	-37.5	179.2	-68.6	-176.7	0	0	0	112.1	I36 G37 I38 I43 G44 L254 A258 I261	I36-L40 HydrophobicContact CG2-CD1 4.19Å; I36-L40 HydrophobicContact CG2-CG 4.35Å; I36-L40 WeakPolarHBondContact O-CG 3.49Å; I36-L40 PolarHBondContact O-N 2.83Å; G37-L40 PolarHBondContact O-N 3.44Å; I38-L40 PolarHBondContact O-N 2.93Å; L40-I43 PolarHBondContact O-N 3Å; L40-G44 PolarHBondContact O-N 3.38Å; L40-L254 HydrophobicContact CD2-CD2 4.36Å; L40-A258 HydrophobicContact CB-CB 3.7Å; L40-I261 HydrophobicContact CD1-CD1 3.5Å
41	T	89.3	Confident	86.3	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.006	24%	0.238	C	C	.	.	H	α-helix	trans	-64.2	-46	175.6	-56.5	0	0	0	0	110.8	G37 I38 I39 I43 G44 L45 L112 I151 A258 Y262	G37-T41 WeakPolarHBondContact O-CB 3.48Å; G37-T41 PolarHBondContact O-N 3Å; G37-T41 PolarHBondContact O-OG1 3.47Å; I38-T41 PolarHBondContact O-N 3.02Å; I39-T41 VanDerWaalsContact C-N 3.29Å; I39-T41 PolarHBondContact O-N 3.24Å; T41-I43 VanDerWaalsContact C-N 3.35Å; T41-I43 PolarHBondContact O-N 3.42Å; T41-G44 PolarHBondContact O-N 3.31Å; T41-L45 HydrophobicContact CG2-CD1 3.8Å; T41-L45 HydrophobicContact CG2-CG 4.16Å; T41-L45 WeakPolarHBondContact O-CB 3.38Å; T41-L45 WeakPolarHBondContact O-CG 3.4Å; T41-L45 PolarHBondContact O-N 3.08Å; T41-L112 HydrophobicContact CG2-CD1 4.08Å; T41-I151 HydrophobicContact CG2-CD1 4.11Å; T41-A258 WeakPolarHBondContact OG1-CB 3.49Å; T41-Y262 WeakPolarHBondContact OG1-CE2 3.34Å; T41-Y262 PolarHBondContact OG1-OH 3.47Å
42	I	90.7	Very high	85.4	Confident	73 Å²	73	45.6 Å²	45.6	37%	0.374	23%	0.231	S	C	.	.	H	α-helix	trans	-60.1	-46.3	175.9	-67.6	166.5	0	0	0	110.6	I38 I39 G44 L45 T46 L112	I38-I42 HydrophobicContact CG2-CD1 3.77Å; I38-I42 HydrophobicContact CG2-CG1 4.44Å; I38-I42 VanDerWaalsContact O-CG1 3.29Å; I38-I42 WeakPolarHBondContact O-CG1 3.45Å; I38-I42 PolarHBondContact O-N 2.89Å; I39-I42 PolarHBondContact O-N 3.36Å; I42-G44 PolarHBondContact O-N 3.01Å; I42-L45 PolarHBondContact O-N 3.5Å; I42-T46 HydrophobicContact CG2-CG2 4.3Å; I42-T46 WeakPolarHBondContact O-CB 3.47Å; I42-T46 VanDerWaalsContact O-CG2 3.22Å; I42-T46 WeakPolarHBondContact O-CG2 3.37Å; I42-T46 PolarHBondContact O-N 3.43Å; I42-T46 PolarHBondContact O-OG1 3.05Å; I42-L112 HydrophobicContact CG1-CD1 3.92Å; I42-L112 HydrophobicContact CG1-CD2 4.17Å
43	I	88.6	Confident	84.5	Confident	74 Å²	74	44 Å²	44	38%	0.379	21%	0.214	S	C	.	.	H	α-helix	trans	-61.7	-45.5	177.8	-67.4	167.9	0	0	0	110.4	I39 L40 T41 T46 T47 L254	I39-I43 HydrophobicContact CG2-CD1 3.64Å; I39-I43 HydrophobicContact CG2-CG1 4.37Å; I39-I43 VanDerWaalsContact O-CG1 3.28Å; I39-I43 WeakPolarHBondContact O-CG1 3.38Å; I39-I43 PolarHBondContact O-N 3.44Å; L40-I43 PolarHBondContact O-N 3Å; T41-I43 VanDerWaalsContact C-N 3.35Å; T41-I43 PolarHBondContact O-N 3.42Å; I43-T46 WeakPolarHBondContact CA-OG1 3.22Å; I43-T46 PolarHBondContact O-N 2.94Å; I43-T46 PolarHBondContact O-OG1 3.14Å; I43-T46 VanDerWaalsContact O-OG1 3.09Å; I43-T47 WeakPolarHBondContact O-CB 3.43Å; I43-T47 PolarHBondContact O-N 2.85Å; I43-T47 PolarHBondContact O-OG1 3.14Å; I43-L254 HydrophobicContact CG2-CD1 4.26Å
44	G	84.5	Confident	83.5	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.9	-46.1	179.1	0	0	0	0	0	112.6	L40 T41 I42 T47	L40-G44 PolarHBondContact O-N 3.38Å; T41-G44 PolarHBondContact O-N 3.31Å; I42-G44 PolarHBondContact O-N 3.01Å; G44-T47 PolarHBondContact O-N 2.87Å
45	L	85.1	Confident	82.6	Confident	9 Å²	9	44.7 Å²	44.7	5%	0.047	22%	0.215	C	C	.	.	H	α-helix	trans	-69.1	-35.2	179.3	-67.5	176.9	0	0	0	112.7	T41 I42 T47 L73 F74 L112 L255	T41-L45 HydrophobicContact CG2-CD1 3.8Å; T41-L45 HydrophobicContact CG2-CG 4.16Å; T41-L45 WeakPolarHBondContact O-CB 3.38Å; T41-L45 WeakPolarHBondContact O-CG 3.4Å; T41-L45 PolarHBondContact O-N 3.08Å; I42-L45 PolarHBondContact O-N 3.5Å; L45-T47 VanDerWaalsContact C-N 3.31Å; L45-L73 HydrophobicContact CD2-CD2 3.43Å; L45-L73 VanDerWaalsContact CD2-CD2 3.43Å; L45-F74 HydrophobicContact CB-CD2 4.48Å; L45-F74 HydrophobicContact CB-CE2 4.14Å; L45-F74 HydrophobicContact CD2-CE2 4.2Å; L45-L112 HydrophobicContact CD1-CB 4.4Å; L45-L112 HydrophobicContact CD1-CD2 4.07Å; L45-L255 HydrophobicContact CD2-CD2 4.24Å; L45-L255 HydrophobicContact CG-CD2 4.25Å
46	T	84.5	Confident	81.7	Confident	99 Å²	99	43.1 Å²	43.1	61%	0.607	21%	0.206	S	C	*	.	H	α-helix	trans	-78.6	-16.3	177.9	53.9	0	0	0	0	113.1	I42 I43 K48	I42-T46 HydrophobicContact CG2-CG2 4.3Å; I42-T46 WeakPolarHBondContact O-CB 3.47Å; I42-T46 VanDerWaalsContact O-CG2 3.22Å; I42-T46 WeakPolarHBondContact O-CG2 3.37Å; I42-T46 PolarHBondContact O-N 3.43Å; I42-T46 PolarHBondContact O-OG1 3.05Å; I43-T46 WeakPolarHBondContact CA-OG1 3.22Å; I43-T46 PolarHBondContact O-N 2.94Å; I43-T46 PolarHBondContact O-OG1 3.14Å; I43-T46 VanDerWaalsContact O-OG1 3.09Å; T46-K48 PolarHBondContact O-N 2.89Å
47	T	81.8	Confident	80.6	Confident	38 Å²	38	39.8 Å²	39.8	23%	0.233	19%	0.189	C	C	.	.			trans	-72.9	128.4	-179.3	-63.7	0	0	0	0	111.2	I43 G44 L45 R49 S251	I43-T47 WeakPolarHBondContact O-CB 3.43Å; I43-T47 PolarHBondContact O-N 2.85Å; I43-T47 PolarHBondContact O-OG1 3.14Å; G44-T47 PolarHBondContact O-N 2.87Å; L45-T47 VanDerWaalsContact C-N 3.31Å; T47-R49 HydrophobicContact CG2-CB 3.87Å; T47-R49 HydrophobicContact CG2-CG 4.35Å; T47-R49 PolarHBondContact O-N 3.2Å; T47-S251 VanDerWaalsContact CG2-CB 3.45Å
48	K	72.2	Confident	79.8	Confident	98 Å²	98	44.6 Å²	44.6	43%	0.426	21%	0.211	S	C	.	.	S	Bend	trans	-79.5	12.4	-179.8	-52	-168.5	171.3	-160	0	114.4	T46 S75	T46-K48 PolarHBondContact O-N 2.89Å; K48-S75 VanDerWaalsContact CD-OG 3.31Å; K48-S75 WeakPolarHBondContact CD-OG 3.22Å; K48-S75 VanDerWaalsContact CE-OG 3.23Å; K48-S75 WeakPolarHBondContact CE-OG 3.35Å; K48-S75 PolarHBondContact NZ-OG 3.43Å
49	R	70.5	Confident	78.7	Confident	161 Å²	161	46 Å²	46	61%	0.608	22%	0.216	S	C	*	.			trans	-132.8	48.6	-162.1	-57.9	-168.5	179.5	-174	-0.3	112.3	T47 L249 S251	T47-R49 HydrophobicContact CG2-CB 3.87Å; T47-R49 HydrophobicContact CG2-CG 4.35Å; T47-R49 PolarHBondContact O-N 3.2Å; R49-L249 HydrophobicContact CB-CD1 4.16Å; R49-L249 VanDerWaalsContact O-CB 3.25Å; R49-L249 WeakPolarHBondContact O-CB 3.49Å; R49-L249 WeakPolarHBondContact O-CD1 3.44Å; R49-S251 PolarHBondContact O-OG 2.98Å
50	L	70.5	Confident	77.7	Confident	3 Å²	3	50.5 Å²	50.5	2%	0.016	24%	0.241	C	C	.	.	S	Bend	trans	-66.6	-46.7	173.6	-83.5	124.3	0	0	0	110.6	V71 L73 L249 S251 F252 L255	L50-V71 WeakPolarHBondContact CB-O 3.41Å; L50-V71 PolarHBondContact N-O 3.13Å; L50-L73 HydrophobicContact CD1-CB 3.87Å; L50-L249 PolarHBondContact O-N 3.17Å; L50-L249 VanDerWaalsContact O-N 3.11Å; L50-S251 WeakPolarHBondContact CA-OG 3.41Å; L50-S251 PolarHBondContact N-OG 3.08Å; L50-F252 HydrophobicContact CD2-CD2 3.87Å; L50-L255 HydrophobicContact CD2-CD1 3.74Å; L50-L255 HydrophobicContact CG-CD1 4.47Å
51	F	69.2	Low	76.8	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.018	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	161.2	173.6	63.2	-76.3	0	0	0	110.3	I53 V71 W101 I162 L245	F51-I53 HydrophobicContact CD2-CG1 3.87Å; F51-I53 HydrophobicContact CE2-CD1 3.79Å; F51-I53 HydrophobicContact CE2-CG1 3.62Å; F51-V71 HydrophobicContact CD1-CB 3.85Å; F51-V71 HydrophobicContact CD1-CG1 4.21Å; F51-V71 HydrophobicContact CD2-CB 4.24Å; F51-V71 HydrophobicContact CD2-CG2 4.27Å; F51-V71 HydrophobicContact CE1-CB 3.25Å; F51-V71 HydrophobicContact CE1-CG1 3.23Å; F51-V71 HydrophobicContact CE1-CG2 4.02Å; F51-V71 HydrophobicContact CE2-CB 3.74Å; F51-V71 HydrophobicContact CE2-CG1 4.29Å; F51-V71 HydrophobicContact CE2-CG2 3.56Å; F51-V71 HydrophobicContact CG-CB 4.3Å; F51-V71 HydrophobicContact CZ-CB 3.2Å; F51-V71 HydrophobicContact CZ-CG1 3.29Å; F51-V71 HydrophobicContact CZ-CG2 3.41Å; F51-V71 VanDerWaalsContact CZ-CG2 3.41Å; F51-V71 PolarHBondContact N-O 3.4Å; F51-V71 PolarHBondContact O-N 3.39Å; F51-W101 AromaticContact CE1-CH2 3.95Å; F51-W101 HydrophobicContact CE1-CH2 3.95Å; F51-I162 HydrophobicContact CD1-CD1 3.29Å; F51-I162 HydrophobicContact CD1-CG1 3.65Å; F51-I162 HydrophobicContact CD1-CG2 4.35Å; F51-I162 HydrophobicContact CD2-CG2 4.05Å; F51-I162 HydrophobicContact CE1-CB 4.43Å; F51-I162 HydrophobicContact CE1-CD1 3.31Å; F51-I162 HydrophobicContact CE1-CG1 3.22Å; F51-I162 HydrophobicContact CE1-CG2 4.45Å; F51-I162 HydrophobicContact CE2-CG1 4.12Å; F51-I162 HydrophobicContact CE2-CG2 4.1Å; F51-I162 HydrophobicContact CG-CD1 4.11Å; F51-I162 HydrophobicContact CG-CG1 4.28Å; F51-I162 HydrophobicContact CG-CG2 4.16Å; F51-I162 HydrophobicContact CZ-CB 4.39Å; F51-I162 HydrophobicContact CZ-CD1 4.1Å; F51-I162 HydrophobicContact CZ-CG1 3.48Å; F51-I162 VanDerWaalsContact CZ-CG1 3.48Å; F51-I162 HydrophobicContact CZ-CG2 4.31Å; F51-L245 HydrophobicContact CD2-CD2 4.41Å
52	H	72.4	Confident	75.8	Confident	15 Å²	15	55.7 Å²	55.7	7%	0.069	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	128.7	172.7	-63.3	-44.6	0	0	0	109.1	Y54 H68 P70 T246 L249	H52-Y54 HydrophobicContact CB-CD2 4.11Å; H52-Y54 HydrophobicContact CB-CE2 3.47Å; H52-Y54 VanDerWaalsContact CB-CE2 3.47Å; H52-H68 WeakPolarHBondContact CB-NE2 3.41Å; H52-H68 AromaticContact CD2-NE2 3.69Å; H52-H68 AromaticContact CE1-CE1 3.79Å; H52-H68 AromaticContact CE1-NE2 3.56Å; H52-H68 AromaticContact CG-NE2 3.13Å; H52-H68 AromaticContact ND1-CE1 3.64Å; H52-H68 AromaticContact ND1-NE2 3.03Å; H52-H68 PolarHBondContact ND1-NE2 2.87Å; H52-H68 AromaticContact NE2-NE2 3.93Å; H52-P70 WeakPolarHBondContact ND1-CA 3.29Å; H52-P70 WeakPolarHBondContact ND1-CB 3.37Å; H52-T246 HydrophobicContact CB-CG2 4.15Å; H52-T246 WeakPolarHBondContact CB-OG1 3.4Å; H52-T246 PolarHBondContact N-OG1 2.72Å; H52-T246 VanDerWaalsContact N-OG1 3.12Å; H52-T246 PolarHBondContact O-N 3.34Å; H52-T246 PolarHBondContact O-OG1 3.28Å; H52-L249 HydrophobicContact CB-CD1 4.49Å; H52-L249 WeakPolarHBondContact CD2-CD1 3.34Å; H52-L249 VanDerWaalsContact NE2-CD1 3.31Å; H52-L249 WeakPolarHBondContact NE2-CD1 3.09Å
53	I	71.8	Confident	75	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	127.8	165.9	-46.9	175.5	0	0	0	106.9	F51 I55 I69 V71 I165 L173 L243 L245	F51-I53 HydrophobicContact CD2-CG1 3.87Å; F51-I53 HydrophobicContact CE2-CD1 3.79Å; F51-I53 HydrophobicContact CE2-CG1 3.62Å; I53-I55 HydrophobicContact CG2-CG1 4.46Å; I53-I69 HydrophobicContact CB-CB 4.11Å; I53-I69 PolarHBondContact N-O 2.81Å; I53-I69 PolarHBondContact O-N 3.27Å; I53-V71 HydrophobicContact CD1-CG2 4.2Å; I53-V71 HydrophobicContact CG1-CG2 4.43Å; I53-I165 HydrophobicContact CD1-CG2 4.08Å; I53-L173 HydrophobicContact CG2-CD2 4.17Å; I53-L243 HydrophobicContact CG2-CD1 4.1Å; I53-L243 HydrophobicContact CG2-CG 4.22Å; I53-L245 HydrophobicContact CB-CD1 4.36Å; I53-L245 HydrophobicContact CG1-CD1 4.01Å; I53-L245 HydrophobicContact CG2-CD1 4.02Å
54	Y	72.9	Confident	74.4	Confident	52 Å²	52	52.5 Å²	52.5	20%	0.204	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	128.7	170.8	-68.6	-89.2	0	0	0	109.2	H52 H66 V67 H68 Y244 T246	H52-Y54 HydrophobicContact CB-CD2 4.11Å; H52-Y54 HydrophobicContact CB-CE2 3.47Å; H52-Y54 VanDerWaalsContact CB-CE2 3.47Å; Y54-H66 AromaticContact CD1-CD2 3.74Å; Y54-V67 CarbonylContact C-O 3.55Å; Y54-V67 VanDerWaalsContact CA-O 3.3Å; Y54-V67 WeakPolarHBondContact CA-O 3.5Å; Y54-H68 HydrophobicContact CD1-CB 4.31Å; Y54-H68 AromaticContact CD1-CD2 3.94Å; Y54-H68 HydrophobicContact CE1-CB 4.06Å; Y54-H68 AromaticContact CE1-CD2 3.32Å; Y54-H68 WeakPolarHBondContact CE1-CD2 3.38Å; Y54-H68 AromaticContact CE1-CG 3.85Å; Y54-H68 AromaticContact CE2-CD2 3.88Å; Y54-H68 AromaticContact CZ-CD2 3.29Å; Y54-H68 AromaticContact CZ-NE2 3.61Å; Y54-H68 PolarHBondContact OH-CD2 3.48Å; Y54-H68 PolarHBondContact OH-NE2 3.01Å; Y54-Y244 PolarHBondContact N-O 3.09Å; Y54-Y244 PolarHBondContact O-N 2.93Å; Y54-T246 HydrophobicContact CD2-CG2 3.9Å; Y54-T246 HydrophobicContact CE2-CG2 3.48Å; Y54-T246 VanDerWaalsContact CE2-CG2 3.48Å
55	I	73.6	Confident	74	Confident	5 Å²	5	56.1 Å²	56.1	3%	0.026	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	119.1	172.3	-46.5	168.5	0	0	0	106.9	I53 H66 V67 I69 L173 L177 F241	I53-I55 HydrophobicContact CG2-CG1 4.46Å; I55-H66 CarbonylContact O-C 3.58Å; I55-H66 WeakPolarHBondContact O-CA 3.38Å; I55-H66 WeakPolarHBondContact O-CB 3.49Å; I55-V67 HydrophobicContact CB-CB 4.03Å; I55-V67 HydrophobicContact CB-CG2 4.29Å; I55-V67 HydrophobicContact CD1-CB 3.97Å; I55-V67 HydrophobicContact CD1-CG1 4.29Å; I55-V67 HydrophobicContact CD1-CG2 4.29Å; I55-V67 HydrophobicContact CG1-CB 4.22Å; I55-V67 PolarHBondContact N-O 2.99Å; I55-V67 PolarHBondContact O-N 3.21Å; I55-I69 HydrophobicContact CD1-CD1 4.31Å; I55-L173 HydrophobicContact CD1-CD2 3.19Å; I55-L173 HydrophobicContact CD1-CG 4.46Å; I55-L173 HydrophobicContact CG1-CD2 3.71Å; I55-L177 HydrophobicContact CD1-CD1 4.46Å; I55-L177 HydrophobicContact CD1-CD2 4.32Å; I55-L177 HydrophobicContact CD1-CG 4.47Å; I55-L177 HydrophobicContact CG2-CD1 4.44Å; I55-F241 HydrophobicContact CG2-CB 4.29Å; I55-F241 HydrophobicContact CG2-CD1 4.2Å
56	Y	74	Confident	73.7	Confident	73 Å²	73	57.3 Å²	57.3	29%	0.286	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	135	173.6	-66.6	-92.5	0	0	0	109.6	H66 F241 A242 Y244	Y56-H66 HydrophobicContact CD1-CB 3.77Å; Y56-H66 HydrophobicContact CE1-CB 3.79Å; Y56-H66 HydrophobicContact CG-CB 4.3Å; Y56-F241 WeakPolarHBondContact O-CA 3.31Å; Y56-A242 PolarHBondContact N-O 3.44Å; Y56-A242 PolarHBondContact O-N 3.03Å; Y56-A242 VanDerWaalsContact O-N 3.14Å; Y56-Y244 AromaticContact CD2-CD2 3.48Å; Y56-Y244 HydrophobicContact CD2-CD2 3.48Å; Y56-Y244 VanDerWaalsContact CD2-CD2 3.48Å; Y56-Y244 AromaticContact CD2-CE2 3.88Å; Y56-Y244 HydrophobicContact CD2-CE2 3.88Å; Y56-Y244 HydrophobicContact CD2-CG 4.47Å; Y56-Y244 AromaticContact CE2-CD2 3.66Å; Y56-Y244 HydrophobicContact CE2-CD2 3.66Å; Y56-Y244 HydrophobicContact CE2-CE2 4.24Å; Y56-Y244 HydrophobicContact CE2-CG 4.25Å
57	D	71.8	Confident	73.1	Confident	11 Å²	11	52.7 Å²	52.7	6%	0.059	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	111	171	-162.7	-4.3	0	0	0	108.1	R59 A62 K63 F64	D57-R59 VanDerWaalsContact OD1-CB 3.26Å; D57-R59 WeakPolarHBondContact OD1-CB 3.3Å; D57-R59 VanDerWaalsContact OD1-CG 3.28Å; D57-R59 WeakPolarHBondContact OD1-CG 3.2Å; D57-R59 IonicContact OD1-CZ 3.9Å; D57-R59 PolarHBondContact OD1-N 3.11Å; D57-R59 IonicContact OD1-NE 2.98Å; D57-R59 PolarHBondContact OD1-NE 3.25Å; D57-R59 IonicContact OD1-NH2 3.65Å; D57-R59 IonicContact OD2-CZ 3.39Å; D57-R59 IonicContact OD2-NE 3.38Å; D57-R59 IonicContact OD2-NH2 2.61Å; D57-R59 PolarHBondContact OD2-NH2 2.95Å; D57-A62 HydrophobicContact CB-CB 4.31Å; D57-K63 PolarHBondContact OD2-N 3.13Å; D57-F64 HydrophobicContact CB-CD1 4.15Å; D57-F64 HydrophobicContact CB-CD2 3.95Å; D57-F64 HydrophobicContact CB-CE1 3.95Å; D57-F64 HydrophobicContact CB-CE2 3.72Å; D57-F64 HydrophobicContact CB-CG 4.17Å; D57-F64 HydrophobicContact CB-CZ 3.73Å; D57-F64 VanDerWaalsContact CB-O 3.28Å; D57-F64 WeakPolarHBondContact CB-O 3.34Å; D57-F64 WeakPolarHBondContact OD2-CE1 3.14Å
58	H	75.3	Confident	73	Confident	101 Å²	101	52 Å²	52	47%	0.468	25%	0.247	S	C	.	.			trans	-97.7	7.5	176.9	-75.4	-70	0	0	0	112.5	E240 A242	H58-E240 PolarHBondContact N-O 3.23Å; H58-A242 WeakPolarHBondContact CD2-CB 3.37Å; H58-A242 VanDerWaalsContact NE2-CB 3.35Å; H58-A242 WeakPolarHBondContact NE2-CB 2.88Å
59	R	68.7	Low	73.1	Confident	44 Å²	44	47.3 Å²	47.3	17%	0.166	23%	0.227	C	C	.	.			trans	-63.8	153.2	174.2	-66.9	-179.9	-77.6	-177	4.1	111	D57 P61 A62 L182 E240 F241	D57-R59 VanDerWaalsContact OD1-CB 3.26Å; D57-R59 WeakPolarHBondContact OD1-CB 3.3Å; D57-R59 VanDerWaalsContact OD1-CG 3.28Å; D57-R59 WeakPolarHBondContact OD1-CG 3.2Å; D57-R59 IonicContact OD1-CZ 3.9Å; D57-R59 PolarHBondContact OD1-N 3.11Å; D57-R59 IonicContact OD1-NE 2.98Å; D57-R59 PolarHBondContact OD1-NE 3.25Å; D57-R59 IonicContact OD1-NH2 3.65Å; D57-R59 IonicContact OD2-CZ 3.39Å; D57-R59 IonicContact OD2-NE 3.38Å; D57-R59 IonicContact OD2-NH2 2.61Å; D57-R59 PolarHBondContact OD2-NH2 2.95Å; R59-P61 CarbonylContact O-C 3.27Å; R59-P61 VanDerWaalsContact O-C 3.27Å; R59-A62 WeakPolarHBondContact O-CA 3.41Å; R59-A62 WeakPolarHBondContact O-CB 3.07Å; R59-A62 PolarHBondContact O-N 3.48Å; R59-L182 PolarHBondContact NH2-O 3.25Å; R59-E240 HydrophobicContact CG-CB 3.77Å; R59-E240 HydrophobicContact CG-CG 3.92Å; R59-F241 VanDerWaalsContact NH2-CE1 3.32Å
60	N	71.9	Confident	73.1	Confident	164 Å²	164	40.1 Å²	40.1	88%	0.877	20%	0.201	S	C	*	.	S	Bend	trans	-123.1	103.9	175.2	-79	-35.3	0	0	0	109.2
61	P	72.7	Confident	73.1	Confident	121 Å²	121	40 Å²	40	79%	0.786	20%	0.2	S	C	*	.	S	Bend	cis	-77.6	141.2	2.4	31.9	-33.9	0	0	0	112.5	R59	R59-P61 CarbonylContact O-C 3.27Å; R59-P61 VanDerWaalsContact O-C 3.27Å
62	A	69.5	Low	73.2	Confident	25 Å²	25	39.8 Å²	39.8	21%	0.207	20%	0.199	C	C	.	.			trans	-65.4	143.3	172.5	0	0	0	0	0	109.1	D57 R59 L83	D57-A62 HydrophobicContact CB-CB 4.31Å; R59-A62 WeakPolarHBondContact O-CA 3.41Å; R59-A62 WeakPolarHBondContact O-CB 3.07Å; R59-A62 PolarHBondContact O-N 3.48Å; A62-L83 HydrophobicContact CB-CD1 4.41Å; A62-L83 HydrophobicContact CB-CD2 4.35Å; A62-L83 WeakPolarHBondContact O-CD1 3.29Å
63	K	73.3	Confident	73.2	Confident	80 Å²	80	39.2 Å²	39.2	35%	0.348	20%	0.197	S	C	.	.	S	Bend	trans	-87.4	-32.1	173.7	-71.2	-172.3	175.7	-173.8	0	111.4	D57 E184	D57-K63 PolarHBondContact OD2-N 3.13Å; K63-E184 IonicContact NZ-OE1 2.72Å; K63-E184 PolarHBondContact NZ-OE1 3.38Å
64	F	76.4	Confident	73.2	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	163.4	179.3	58	-87.8	0	0	0	110.6	D57 V67 V80 W82 L177 L182 F241	D57-F64 HydrophobicContact CB-CD1 4.15Å; D57-F64 HydrophobicContact CB-CD2 3.95Å; D57-F64 HydrophobicContact CB-CE1 3.95Å; D57-F64 HydrophobicContact CB-CE2 3.72Å; D57-F64 HydrophobicContact CB-CG 4.17Å; D57-F64 HydrophobicContact CB-CZ 3.73Å; D57-F64 VanDerWaalsContact CB-O 3.28Å; D57-F64 WeakPolarHBondContact CB-O 3.34Å; D57-F64 WeakPolarHBondContact OD2-CE1 3.14Å; F64-V67 HydrophobicContact CD2-CG2 3.79Å; F64-V67 HydrophobicContact CE2-CB 4.47Å; F64-V67 HydrophobicContact CE2-CG2 3.3Å; F64-V67 HydrophobicContact CZ-CG2 3.78Å; F64-V80 HydrophobicContact CB-CG1 3.88Å; F64-V80 HydrophobicContact CG-CG1 4.35Å; F64-W82 HydrophobicContact CB-CE3 4.19Å; F64-W82 HydrophobicContact CB-CZ3 4.49Å; F64-L177 HydrophobicContact CE1-CD2 4.49Å; F64-L177 HydrophobicContact CZ-CD2 4.07Å; F64-L182 HydrophobicContact CD1-CB 4.46Å; F64-L182 HydrophobicContact CD1-CD2 3.83Å; F64-L182 HydrophobicContact CE1-CB 4.02Å; F64-L182 HydrophobicContact CE1-CD1 4.42Å; F64-L182 HydrophobicContact CE1-CD2 4.23Å; F64-L182 HydrophobicContact CE1-CG 4.46Å; F64-F241 HydrophobicContact CE1-CE1 4.35Å; F64-F241 HydrophobicContact CZ-CD1 4.39Å; F64-F241 HydrophobicContact CZ-CE1 4.01Å
65	H	76.2	Confident	72.7	Confident	76 Å²	76	42.1 Å²	42.1	35%	0.352	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	-52.8	178.3	-176.3	-56.8	0	0	0	111	T81	H65-T81 HydrophobicContact CB-CG2 4.39Å; H65-T81 WeakPolarHBondContact CB-O 3.32Å; H65-T81 PolarHBondContact N-O 3.22Å
66	H	78.5	Confident	72.5	Confident	34 Å²	34	42.8 Å²	42.8	16%	0.157	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	150.5	173.5	64.1	-80.5	0	0	0	112.1	Y54 I55 Y56 T81	Y54-H66 AromaticContact CD1-CD2 3.74Å; I55-H66 CarbonylContact O-C 3.58Å; I55-H66 WeakPolarHBondContact O-CA 3.38Å; I55-H66 WeakPolarHBondContact O-CB 3.49Å; Y56-H66 HydrophobicContact CD1-CB 3.77Å; Y56-H66 HydrophobicContact CE1-CB 3.79Å; Y56-H66 HydrophobicContact CG-CB 4.3Å; H66-T81 VanDerWaalsContact CE1-CB 3.47Å; H66-T81 WeakPolarHBondContact CE1-CB 3.26Å; H66-T81 PolarHBondContact CE1-OG1 2.92Å; H66-T81 PolarHBondContact N-O 3.28Å; H66-T81 PolarHBondContact NE2-OG1 3.38Å; H66-T81 PolarHBondContact O-N 3.11Å
67	V	73	Confident	72.1	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	126.5	165.4	-172.3	0	0	0	0	107.8	Y54 I55 F64 I69 T78 Y79 V80 L177 L182	Y54-V67 CarbonylContact C-O 3.55Å; Y54-V67 VanDerWaalsContact CA-O 3.3Å; Y54-V67 WeakPolarHBondContact CA-O 3.5Å; I55-V67 HydrophobicContact CB-CB 4.03Å; I55-V67 HydrophobicContact CB-CG2 4.29Å; I55-V67 HydrophobicContact CD1-CB 3.97Å; I55-V67 HydrophobicContact CD1-CG1 4.29Å; I55-V67 HydrophobicContact CD1-CG2 4.29Å; I55-V67 HydrophobicContact CG1-CB 4.22Å; I55-V67 PolarHBondContact N-O 2.99Å; I55-V67 PolarHBondContact O-N 3.21Å; F64-V67 HydrophobicContact CD2-CG2 3.79Å; F64-V67 HydrophobicContact CE2-CB 4.47Å; F64-V67 HydrophobicContact CE2-CG2 3.3Å; F64-V67 HydrophobicContact CZ-CG2 3.78Å; V67-I69 HydrophobicContact CG1-CD1 4.47Å; V67-I69 HydrophobicContact CG1-CG1 4Å; V67-T78 HydrophobicContact CG1-CG2 3.63Å; V67-Y79 CarbonylContact C-O 3.42Å; V67-Y79 WeakPolarHBondContact CA-O 3.34Å; V67-V80 HydrophobicContact CB-CG2 4.12Å; V67-V80 HydrophobicContact CG1-CG2 3.83Å; V67-V80 HydrophobicContact CG2-CG2 3.7Å; V67-L177 HydrophobicContact CG2-CD2 3.94Å; V67-L182 HydrophobicContact CG2-CD1 4.34Å
68	H	78.9	Confident	71.8	Confident	23 Å²	23	40.6 Å²	40.6	11%	0.106	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	114.7	174.4	177.1	-131.7	0	0	0	109.6	H52 Y54 P70 Y79	H52-H68 WeakPolarHBondContact CB-NE2 3.41Å; H52-H68 AromaticContact CD2-NE2 3.69Å; H52-H68 AromaticContact CE1-CE1 3.79Å; H52-H68 AromaticContact CE1-NE2 3.56Å; H52-H68 AromaticContact CG-NE2 3.13Å; H52-H68 AromaticContact ND1-CE1 3.64Å; H52-H68 AromaticContact ND1-NE2 3.03Å; H52-H68 PolarHBondContact ND1-NE2 2.87Å; H52-H68 AromaticContact NE2-NE2 3.93Å; Y54-H68 HydrophobicContact CD1-CB 4.31Å; Y54-H68 AromaticContact CD1-CD2 3.94Å; Y54-H68 HydrophobicContact CE1-CB 4.06Å; Y54-H68 AromaticContact CE1-CD2 3.32Å; Y54-H68 WeakPolarHBondContact CE1-CD2 3.38Å; Y54-H68 AromaticContact CE1-CG 3.85Å; Y54-H68 AromaticContact CE2-CD2 3.88Å; Y54-H68 AromaticContact CZ-CD2 3.29Å; Y54-H68 AromaticContact CZ-NE2 3.61Å; Y54-H68 PolarHBondContact OH-CD2 3.48Å; Y54-H68 PolarHBondContact OH-NE2 3.01Å; H68-P70 WeakPolarHBondContact O-CD 3.27Å; H68-Y79 PolarHBondContact N-O 2.95Å; H68-Y79 PolarHBondContact O-N 3.43Å
69	I	73.3	Confident	71.9	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	91.6	176	-46.1	175	0	0	0	108.3	I53 I55 V67 V71 L76 T78 L173	I53-I69 HydrophobicContact CB-CB 4.11Å; I53-I69 PolarHBondContact N-O 2.81Å; I53-I69 PolarHBondContact O-N 3.27Å; I55-I69 HydrophobicContact CD1-CD1 4.31Å; V67-I69 HydrophobicContact CG1-CD1 4.47Å; V67-I69 HydrophobicContact CG1-CG1 4Å; I69-V71 HydrophobicContact CG2-CG2 3.81Å; I69-V71 PolarHBondContact O-N 2.81Å; I69-L76 HydrophobicContact CG2-CD2 4.44Å; I69-T78 HydrophobicContact CD1-CG2 4.46Å; I69-T78 HydrophobicContact CG1-CG2 3.84Å; I69-L173 HydrophobicContact CD1-CD2 3.99Å
70	P	71.4	Confident	72.2	Confident	10 Å²	10	36 Å²	36	7%	0.065	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	114.6	162.4	25.5	-32.2	0	0	0	109.5	H52 H68 N77 Y79	H52-P70 WeakPolarHBondContact ND1-CA 3.29Å; H52-P70 WeakPolarHBondContact ND1-CB 3.37Å; H68-P70 WeakPolarHBondContact O-CD 3.27Å; P70-N77 WeakPolarHBondContact CD-O 3.38Å; P70-N77 WeakPolarHBondContact CG-O 3.35Å; P70-Y79 HydrophobicContact CG-CD2 3.76Å; P70-Y79 HydrophobicContact CG-CE2 3.54Å
71	V	70.5	Confident	72.5	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	115.6	175.4	-176.3	0	0	0	0	108	L50 F51 I53 I69 L76 W101	L50-V71 WeakPolarHBondContact CB-O 3.41Å; L50-V71 PolarHBondContact N-O 3.13Å; F51-V71 HydrophobicContact CD1-CB 3.85Å; F51-V71 HydrophobicContact CD1-CG1 4.21Å; F51-V71 HydrophobicContact CD2-CB 4.24Å; F51-V71 HydrophobicContact CD2-CG2 4.27Å; F51-V71 HydrophobicContact CE1-CB 3.25Å; F51-V71 HydrophobicContact CE1-CG1 3.23Å; F51-V71 HydrophobicContact CE1-CG2 4.02Å; F51-V71 HydrophobicContact CE2-CB 3.74Å; F51-V71 HydrophobicContact CE2-CG1 4.29Å; F51-V71 HydrophobicContact CE2-CG2 3.56Å; F51-V71 HydrophobicContact CG-CB 4.3Å; F51-V71 HydrophobicContact CZ-CB 3.2Å; F51-V71 HydrophobicContact CZ-CG1 3.29Å; F51-V71 HydrophobicContact CZ-CG2 3.41Å; F51-V71 VanDerWaalsContact CZ-CG2 3.41Å; F51-V71 PolarHBondContact N-O 3.4Å; F51-V71 PolarHBondContact O-N 3.39Å; I53-V71 HydrophobicContact CD1-CG2 4.2Å; I53-V71 HydrophobicContact CG1-CG2 4.43Å; I69-V71 HydrophobicContact CG2-CG2 3.81Å; I69-V71 PolarHBondContact O-N 2.81Å; V71-L76 HydrophobicContact CB-CD2 4.26Å; V71-L76 HydrophobicContact CG1-CD2 3.85Å; V71-L76 HydrophobicContact CG1-CG 4.06Å; V71-L76 HydrophobicContact CG2-CD2 3.77Å; V71-W101 HydrophobicContact CG1-CH2 3.88Å; V71-W101 HydrophobicContact CG1-CZ2 3.7Å
72	G	71	Confident	72.8	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.131	C	C	.	.			trans	-103.6	163.3	162.8	0	0	0	0	0	110.6	F74 S75	G72-F74 PolarHBondContact O-N 3.31Å; G72-S75 WeakPolarHBondContact CA-O 3.48Å; G72-S75 PolarHBondContact N-O 2.86Å
73	L	72.1	Confident	72.9	Confident	3 Å²	3	31.1 Å²	31.1	2%	0.016	15%	0.147	C	C	.	.	S	Bend	trans	-59.2	-39.7	179.4	-160	74.5	0	0	0	110.7	L45 L50 W101 R105 A158	L45-L73 HydrophobicContact CD2-CD2 3.43Å; L45-L73 VanDerWaalsContact CD2-CD2 3.43Å; L50-L73 HydrophobicContact CD1-CB 3.87Å; L73-W101 HydrophobicContact CD1-CZ2 4.27Å; L73-R105 HydrophobicContact CG-CG 4.14Å; L73-R105 PolarHBondContact O-NE 3.46Å; L73-R105 PolarHBondContact O-NH2 2.87Å; L73-A158 HydrophobicContact CD1-CB 4.07Å
74	F	72.4	Confident	72.9	Confident	89 Å²	89	31.4 Å²	31.4	39%	0.39	16%	0.158	S	C	.	.	S	Bend	trans	-112.6	-5.4	-178.9	-63.8	-76.5	0	0	0	115.5	L45 G72 R105 L109	L45-F74 HydrophobicContact CB-CD2 4.48Å; L45-F74 HydrophobicContact CB-CE2 4.14Å; L45-F74 HydrophobicContact CD2-CE2 4.2Å; G72-F74 PolarHBondContact O-N 3.31Å; F74-R105 HydrophobicContact CD1-CG 4.34Å; F74-R105 HydrophobicContact CE1-CB 3.96Å; F74-R105 HydrophobicContact CE1-CG 3.97Å; F74-R105 HydrophobicContact CZ-CB 4.33Å; F74-R105 HydrophobicContact CZ-CG 4.45Å; F74-L109 HydrophobicContact CE1-CD1 4.07Å; F74-L109 HydrophobicContact CE1-CD2 4.38Å; F74-L109 HydrophobicContact CE1-CG 4.24Å; F74-L109 HydrophobicContact CE2-CD2 4.49Å; F74-L109 HydrophobicContact CZ-CD1 4.13Å; F74-L109 HydrophobicContact CZ-CD2 3.78Å; F74-L109 HydrophobicContact CZ-CG 3.77Å
75	S	62.9	Low	72.7	Confident	24 Å²	24	37.7 Å²	37.7	17%	0.168	19%	0.19	C	C	.	.			trans	-136.3	117.7	-179	-172.1	0	0	0	0	109.3	K48 G72 N77	K48-S75 VanDerWaalsContact CD-OG 3.31Å; K48-S75 WeakPolarHBondContact CD-OG 3.22Å; K48-S75 VanDerWaalsContact CE-OG 3.23Å; K48-S75 WeakPolarHBondContact CE-OG 3.35Å; K48-S75 PolarHBondContact NZ-OG 3.43Å; G72-S75 WeakPolarHBondContact CA-O 3.48Å; G72-S75 PolarHBondContact N-O 2.86Å; S75-N77 PolarHBondContact OG-OD1 3.37Å; S75-N77 VanDerWaalsContact OG-OD1 3.13Å
76	L	67.8	Low	72.6	Confident	19 Å²	19	40.3 Å²	40.3	10%	0.099	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-109.9	113.4	164.1	-75.2	108.9	0	0	0	106.9	I69 V71 N93 L94 I96	I69-L76 HydrophobicContact CG2-CD2 4.44Å; V71-L76 HydrophobicContact CB-CD2 4.26Å; V71-L76 HydrophobicContact CG1-CD2 3.85Å; V71-L76 HydrophobicContact CG1-CG 4.06Å; V71-L76 HydrophobicContact CG2-CD2 3.77Å; L76-N93 VanDerWaalsContact O-CG 3.3Å; L76-N93 PolarHBondContact O-OD1 3.48Å; L76-L94 HydrophobicContact CD2-CB 4.1Å; L76-L94 HydrophobicContact CD2-CD2 4.06Å; L76-L94 HydrophobicContact CD2-CG 4.32Å; L76-I96 HydrophobicContact CD2-CD1 3.82Å; L76-I96 HydrophobicContact CD2-CG1 4.18Å
77	N	66.1	Low	72.4	Confident	38 Å²	38	44.4 Å²	44.4	20%	0.203	22%	0.219	C	C	.	.			trans	-118.3	108.7	173.1	-76.8	26.2	0	0	0	106.9	P70 S75 Y79	P70-N77 WeakPolarHBondContact CD-O 3.38Å; P70-N77 WeakPolarHBondContact CG-O 3.35Å; S75-N77 PolarHBondContact OG-OD1 3.37Å; S75-N77 VanDerWaalsContact OG-OD1 3.13Å; N77-Y79 HydrophobicContact CB-CE2 3.71Å; N77-Y79 PolarHBondContact ND2-OH 2.93Å; N77-Y79 VanDerWaalsContact O-CD2 3.3Å; N77-Y79 WeakPolarHBondContact O-CD2 3.46Å; N77-Y79 VanDerWaalsContact O-CE2 3.31Å; N77-Y79 WeakPolarHBondContact O-CE2 3.27Å
78	T	66.9	Low	72.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.229	C	C	.	.			trans	-85.1	131.4	178.6	-56.1	0	0	0	0	109.9	V67 I69 L90 N93	V67-T78 HydrophobicContact CG1-CG2 3.63Å; I69-T78 HydrophobicContact CD1-CG2 4.46Å; I69-T78 HydrophobicContact CG1-CG2 3.84Å; T78-L90 HydrophobicContact CG2-CB 4.14Å; T78-L90 HydrophobicContact CG2-CD2 3.8Å; T78-L90 HydrophobicContact CG2-CG 4.5Å; T78-L90 PolarHBondContact O-N 2.9Å; T78-N93 PolarHBondContact N-OD1 2.83Å
79	Y	76.2	Confident	72.1	Confident	48 Å²	48	50 Å²	50	19%	0.188	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	138.7	177	-58.7	-80.8	0	0	0	109.8	V67 H68 P70 N77 K87 S88 I89	V67-Y79 CarbonylContact C-O 3.42Å; V67-Y79 WeakPolarHBondContact CA-O 3.34Å; H68-Y79 PolarHBondContact N-O 2.95Å; H68-Y79 PolarHBondContact O-N 3.43Å; P70-Y79 HydrophobicContact CG-CD2 3.76Å; P70-Y79 HydrophobicContact CG-CE2 3.54Å; N77-Y79 HydrophobicContact CB-CE2 3.71Å; N77-Y79 PolarHBondContact ND2-OH 2.93Å; N77-Y79 VanDerWaalsContact O-CD2 3.3Å; N77-Y79 WeakPolarHBondContact O-CD2 3.46Å; N77-Y79 VanDerWaalsContact O-CE2 3.31Å; N77-Y79 WeakPolarHBondContact O-CE2 3.27Å; Y79-K87 VanDerWaalsContact CB-CE 3.47Å; Y79-K87 HydrophobicContact CD1-CD 4.3Å; Y79-K87 HydrophobicContact CD1-CG 4.29Å; Y79-S88 WeakPolarHBondContact CA-O 3.37Å; Y79-I89 HydrophobicContact CD1-CG1 3.95Å; Y79-I89 HydrophobicContact CE1-CD1 4.31Å; Y79-I89 HydrophobicContact CE1-CG1 3.79Å
80	V	75	Confident	71.7	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	128.4	169	168.1	0	0	0	0	109.2	F64 V67 W82 S88 L90 L182	F64-V80 HydrophobicContact CB-CG1 3.88Å; F64-V80 HydrophobicContact CG-CG1 4.35Å; V67-V80 HydrophobicContact CB-CG2 4.12Å; V67-V80 HydrophobicContact CG1-CG2 3.83Å; V67-V80 HydrophobicContact CG2-CG2 3.7Å; V80-W82 HydrophobicContact CG1-CD2 4.14Å; V80-W82 HydrophobicContact CG1-CE3 4.47Å; V80-W82 HydrophobicContact CG1-CZ2 4.31Å; V80-S88 PolarHBondContact N-O 3.22Å; V80-S88 PolarHBondContact O-N 3.39Å; V80-S88 PolarHBondContact O-OG 2.88Å; V80-L90 HydrophobicContact CB-CD1 3.52Å; V80-L90 HydrophobicContact CG2-CD1 3.19Å; V80-L90 HydrophobicContact CG2-CD2 3.74Å; V80-L90 HydrophobicContact CG2-CG 4.11Å; V80-L182 HydrophobicContact CG2-CD1 3.98Å
81	T	77.7	Confident	71	Confident	16 Å²	16	58 Å²	58	10%	0.098	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	110.3	168.8	-62.1	0	0	0	0	107.9	H65 H66 M85	H65-T81 HydrophobicContact CB-CG2 4.39Å; H65-T81 WeakPolarHBondContact CB-O 3.32Å; H65-T81 PolarHBondContact N-O 3.22Å; H66-T81 VanDerWaalsContact CE1-CB 3.47Å; H66-T81 WeakPolarHBondContact CE1-CB 3.26Å; H66-T81 PolarHBondContact CE1-OG1 2.92Å; H66-T81 PolarHBondContact N-O 3.28Å; H66-T81 PolarHBondContact NE2-OG1 3.38Å; H66-T81 PolarHBondContact O-N 3.11Å; T81-M85 HydrophobicContact CG2-SD 4.23Å
82	W	79.5	Confident	70.4	Confident	89 Å²	89	63.1 Å²	63.1	34%	0.337	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	166.1	176.2	-63.2	104.5	0	0	0	110.9	F64 V80 S84 M85 E86 S88 L182	F64-W82 HydrophobicContact CB-CE3 4.19Å; F64-W82 HydrophobicContact CB-CZ3 4.49Å; V80-W82 HydrophobicContact CG1-CD2 4.14Å; V80-W82 HydrophobicContact CG1-CE3 4.47Å; V80-W82 HydrophobicContact CG1-CZ2 4.31Å; W82-S84 WeakPolarHBondContact CB-OG 3.39Å; W82-S84 PolarHBondContact O-N 3.29Å; W82-M85 WeakPolarHBondContact O-CA 3.49Å; W82-M85 PolarHBondContact O-N 2.96Å; W82-E86 PolarHBondContact N-O 3.05Å; W82-S88 PolarHBondContact NE1-OG 3.4Å; W82-L182 HydrophobicContact CH2-CD2 3.83Å; W82-L182 HydrophobicContact CZ3-CD2 4.1Å
83	L	71.8	Confident	69.8	Low	104 Å²	104	66.2 Å²	66.2	55%	0.545	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-23.9	172.6	-72.7	169.5	0	0	0	112.8	A62 M85	A62-L83 HydrophobicContact CB-CD1 4.41Å; A62-L83 HydrophobicContact CB-CD2 4.35Å; A62-L83 WeakPolarHBondContact O-CD1 3.29Å; L83-M85 PolarHBondContact O-N 3.26Å
84	S	73.4	Confident	69.2	Low	85 Å²	85	66.5 Å²	66.5	59%	0.594	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-0.6	172	59.6	0	0	0	0	114	W82 E86	W82-S84 WeakPolarHBondContact CB-OG 3.39Å; W82-S84 PolarHBondContact O-N 3.29Å; S84-E86 PolarHBondContact O-N 3.41Å; S84-E86 VanDerWaalsContact OG-CB 3.28Å; S84-E86 WeakPolarHBondContact OG-CB 3.49Å; S84-E86 PolarHBondContact OG-N 2.98Å
85	M	72.8	Confident	68.5	Low	133 Å²	133	70.2 Å²	70.2	66%	0.655	35%	0.354	S	S	*	.			trans	62.1	6.9	-167.5	-63.3	-69.2	-171.8	0	0	114.4	T81 W82 L83	T81-M85 HydrophobicContact CG2-SD 4.23Å; W82-M85 WeakPolarHBondContact O-CA 3.49Å; W82-M85 PolarHBondContact O-N 2.96Å; L83-M85 PolarHBondContact O-N 3.26Å
86	E	72.6	Confident	68.4	Low	130 Å²	130	69.3 Å²	69.3	61%	0.607	35%	0.347	S	S	*	.			trans	-69.7	133	172.5	-171.4	173.7	178.9	0	0	110	W82 S84	W82-E86 PolarHBondContact N-O 3.05Å; S84-E86 PolarHBondContact O-N 3.41Å; S84-E86 VanDerWaalsContact OG-CB 3.28Å; S84-E86 WeakPolarHBondContact OG-CB 3.49Å; S84-E86 PolarHBondContact OG-N 2.98Å
87	K	74.2	Confident	68.1	Low	121 Å²	121	72.4 Å²	72.4	53%	0.526	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	113.5	177.8	-174.9	172.8	179.9	169.9	0	108.9	Y79	Y79-K87 VanDerWaalsContact CB-CE 3.47Å; Y79-K87 HydrophobicContact CD1-CD 4.3Å; Y79-K87 HydrophobicContact CD1-CG 4.29Å
88	S	74.1	Confident	68.3	Low	30 Å²	30	73.7 Å²	73.7	21%	0.21	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	149.2	173.3	63.7	0	0	0	0	110.6	Y79 V80 W82	Y79-S88 WeakPolarHBondContact CA-O 3.37Å; V80-S88 PolarHBondContact N-O 3.22Å; V80-S88 PolarHBondContact O-N 3.39Å; V80-S88 PolarHBondContact O-OG 2.88Å; W82-S88 PolarHBondContact NE1-OG 3.4Å
89	I	72.1	Confident	68.9	Low	110 Å²	110	80.7 Å²	80.7	56%	0.564	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	132.2	170.8	-57.2	175.9	0	0	0	106.3	Y79	Y79-I89 HydrophobicContact CD1-CG1 3.95Å; Y79-I89 HydrophobicContact CE1-CD1 4.31Å; Y79-I89 HydrophobicContact CE1-CG1 3.79Å
90	L	64.6	Low	69.1	Low	12 Å²	12	82.9 Å²	82.9	6%	0.063	42%	0.422	C	S	.	.			trans	-77.6	132.9	174.2	-100.7	56.3	0	0	0	110.1	T78 V80 Q92 N180 L182	T78-L90 HydrophobicContact CG2-CB 4.14Å; T78-L90 HydrophobicContact CG2-CD2 3.8Å; T78-L90 HydrophobicContact CG2-CG 4.5Å; T78-L90 PolarHBondContact O-N 2.9Å; V80-L90 HydrophobicContact CB-CD1 3.52Å; V80-L90 HydrophobicContact CG2-CD1 3.19Å; V80-L90 HydrophobicContact CG2-CD2 3.74Å; V80-L90 HydrophobicContact CG2-CG 4.11Å; L90-Q92 VanDerWaalsContact C-N 3.29Å; L90-Q92 PolarHBondContact O-N 3.47Å; L90-N180 WeakPolarHBondContact CB-OD1 3.28Å; L90-N180 HydrophobicContact CD2-CB 3.54Å; L90-N180 HydrophobicContact CG-CB 3.9Å; L90-N180 VanDerWaalsContact CG-CG 3.49Å; L90-N180 VanDerWaalsContact CG-OD1 3.22Å; L90-N180 WeakPolarHBondContact CG-OD1 3.11Å; L90-L182 HydrophobicContact CD2-CD1 4.06Å
91	D	56.9	Low	69.4	Low	166 Å²	166	82.9 Å²	82.9	89%	0.888	42%	0.422	S	S	*	.	S	Bend	trans	-65.6	-36.2	-179.6	-72.7	-27.4	0	0	0	111.3
92	Q	57.1	Low	69.7	Low	109 Å²	109	84.7 Å²	84.7	51%	0.509	43%	0.433	S	S	.	.	S	Bend	trans	-102.4	98.6	178	-162	159.5	9.5	0	0	110.6	L90 S179 N180	L90-Q92 VanDerWaalsContact C-N 3.29Å; L90-Q92 PolarHBondContact O-N 3.47Å; Q92-S179 VanDerWaalsContact OE1-CB 3.23Å; Q92-S179 PolarHBondContact OE1-OG 3.45Å; Q92-N180 PolarHBondContact N-OD1 2.91Å; Q92-N180 PolarHBondContact O-ND2 3.35Å
93	N	59.2	Low	70.1	Confident	64 Å²	64	83.7 Å²	83.7	34%	0.342	43%	0.433	S	S	.	.			trans	-70.5	152.1	173.4	-70.8	-57.8	0	0	0	110.9	L76 T78 E95	L76-N93 VanDerWaalsContact O-CG 3.3Å; L76-N93 PolarHBondContact O-OD1 3.48Å; T78-N93 PolarHBondContact N-OD1 2.83Å; N93-E95 PolarHBondContact O-N 2.96Å
94	L	59.8	Low	70.8	Confident	10 Å²	10	78.7 Å²	78.7	5%	0.052	41%	0.408	C	S	.	.			trans	-60.5	100.5	169.3	179.8	68.4	0	0	0	109.2	L76 I96 I172 V176	L76-L94 HydrophobicContact CD2-CB 4.1Å; L76-L94 HydrophobicContact CD2-CD2 4.06Å; L76-L94 HydrophobicContact CD2-CG 4.32Å; L94-I96 HydrophobicContact CD2-CD1 3.87Å; L94-I96 HydrophobicContact CD2-CG1 3.71Å; L94-I96 HydrophobicContact CG-CD1 4.41Å; L94-I96 HydrophobicContact CG-CG1 3.72Å; L94-I96 PolarHBondContact O-N 3.34Å; L94-I96 VanDerWaalsContact O-N 3.16Å; L94-I172 HydrophobicContact CD1-CG2 3.38Å; L94-V176 HydrophobicContact CB-CG2 3.92Å; L94-V176 HydrophobicContact CD1-CG2 3.28Å; L94-V176 HydrophobicContact CG-CG2 4.16Å
95	E	57.6	Low	71.5	Confident	166 Å²	166	77.7 Å²	77.7	78%	0.776	39%	0.391	S	S	*	.			trans	-81	91.9	169.6	-166	174.1	-173.9	0	0	107.9	N93 S97	N93-E95 PolarHBondContact O-N 2.96Å; E95-S97 PolarHBondContact O-N 3.5Å
96	I	61.6	Low	72.4	Confident	6 Å²	6	75.3 Å²	75.3	3%	0.031	38%	0.38	C	S	.	.			trans	-73.3	81.5	166.1	-49.2	174.7	0	0	0	106.3	L76 L94 D98 W101 I165	L76-I96 HydrophobicContact CD2-CD1 3.82Å; L76-I96 HydrophobicContact CD2-CG1 4.18Å; L94-I96 HydrophobicContact CD2-CD1 3.87Å; L94-I96 HydrophobicContact CD2-CG1 3.71Å; L94-I96 HydrophobicContact CG-CD1 4.41Å; L94-I96 HydrophobicContact CG-CG1 3.72Å; L94-I96 PolarHBondContact O-N 3.34Å; L94-I96 VanDerWaalsContact O-N 3.16Å; I96-D98 HydrophobicContact CG2-CB 4.06Å; I96-D98 PolarHBondContact O-N 2.81Å; I96-W101 HydrophobicContact CB-CB 4.43Å; I96-W101 HydrophobicContact CB-CG 4.2Å; I96-W101 HydrophobicContact CG2-CB 3.62Å; I96-W101 HydrophobicContact CG2-CD2 4.33Å; I96-W101 HydrophobicContact CG2-CG 3.8Å; I96-I165 HydrophobicContact CD1-CD1 3.77Å
97	S	60.8	Low	73.3	Confident	83 Å²	83	71.5 Å²	71.5	58%	0.58	36%	0.362	S	S	*	.			trans	-82.6	7.3	173.8	55.8	0	0	0	0	112.3	E95 L99	E95-S97 PolarHBondContact O-N 3.5Å; S97-L99 PolarHBondContact O-N 3.45Å
98	D	71	Confident	74	Confident	66 Å²	66	65.8 Å²	65.8	35%	0.353	34%	0.338	S	S	.	.			trans	-55	134.5	177.8	-69.7	-46.4	0	0	0	110.8	I96 R100 W101 T102	I96-D98 HydrophobicContact CG2-CB 4.06Å; I96-D98 PolarHBondContact O-N 2.81Å; D98-R100 PolarHBondContact O-N 2.88Å; D98-W101 PolarHBondContact O-N 3.36Å; D98-T102 PolarHBondContact O-N 3.39Å; D98-T102 PolarHBondContact O-OG1 2.95Å
99	L	79.4	Confident	74.8	Confident	147 Å²	147	68.6 Å²	68.6	77%	0.77	35%	0.35	S	S	*	.	H	α-helix	trans	-50.8	-36.6	-178.5	-179.4	67.7	0	0	0	111.1	S97 L103	S97-L99 PolarHBondContact O-N 3.45Å; L99-L103 WeakPolarHBondContact O-CB 3.31Å; L99-L103 PolarHBondContact O-N 3.19Å
100	R	79.8	Confident	75.8	Confident	94 Å²	94	66.8 Å²	66.8	36%	0.355	34%	0.341	S	S	.	.	H	α-helix	trans	-71.2	-41.6	-178.1	-66.9	179.3	69	-155.3	12.8	112.4	D98 L103 A104 E161	D98-R100 PolarHBondContact O-N 2.88Å; R100-L103 PolarHBondContact O-N 3.29Å; R100-A104 WeakPolarHBondContact O-CB 3.32Å; R100-A104 PolarHBondContact O-N 3.4Å; R100-E161 VanDerWaalsContact CB-CD 3.43Å; R100-E161 HydrophobicContact CB-CG 3.69Å; R100-E161 WeakPolarHBondContact CB-OE1 3.4Å; R100-E161 WeakPolarHBondContact CD-OE1 3.44Å; R100-E161 WeakPolarHBondContact CG-OE1 3.49Å; R100-E161 IonicContact CZ-OE1 3.75Å; R100-E161 IonicContact NE-OE1 2.85Å; R100-E161 PolarHBondContact NE-OE1 3.42Å; R100-E161 IonicContact NH1-OE1 3.94Å; R100-E161 PolarHBondContact NH1-OE1 2.8Å
101	W	81.5	Confident	77.1	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-67.8	-40.3	174.8	-164.4	-101	0	0	0	111.8	F51 V71 L73 I96 D98 L103 A104 R105 A158 E161 I162	F51-W101 AromaticContact CE1-CH2 3.95Å; F51-W101 HydrophobicContact CE1-CH2 3.95Å; V71-W101 HydrophobicContact CG1-CH2 3.88Å; V71-W101 HydrophobicContact CG1-CZ2 3.7Å; L73-W101 HydrophobicContact CD1-CZ2 4.27Å; I96-W101 HydrophobicContact CB-CB 4.43Å; I96-W101 HydrophobicContact CB-CG 4.2Å; I96-W101 HydrophobicContact CG2-CB 3.62Å; I96-W101 HydrophobicContact CG2-CD2 4.33Å; I96-W101 HydrophobicContact CG2-CG 3.8Å; D98-W101 PolarHBondContact O-N 3.36Å; W101-L103 VanDerWaalsContact C-N 3.35Å; W101-A104 WeakPolarHBondContact O-CB 3.15Å; W101-A104 PolarHBondContact O-N 3.33Å; W101-R105 WeakPolarHBondContact O-CG 3.45Å; W101-R105 PolarHBondContact O-N 2.96Å; W101-A158 HydrophobicContact CH2-CB 4.3Å; W101-A158 HydrophobicContact CZ3-CB 3.95Å; W101-E161 HydrophobicContact CE3-CB 3.73Å; W101-E161 HydrophobicContact CE3-CG 4.22Å; W101-E161 HydrophobicContact CZ3-CB 4.13Å; W101-I162 HydrophobicContact CZ3-CG1 4.19Å
102	T	84.4	Confident	78.8	Confident	54 Å²	54	59.6 Å²	59.6	33%	0.331	30%	0.302	S	S	.	.	H	α-helix	trans	-63.3	-42.2	173.7	-60.4	0	0	0	0	111.2	D98 A104 R105 I106	D98-T102 PolarHBondContact O-N 3.39Å; D98-T102 PolarHBondContact O-OG1 2.95Å; T102-A104 PolarHBondContact O-N 3.14Å; T102-R105 WeakPolarHBondContact O-CB 3.34Å; T102-R105 PolarHBondContact O-N 3.17Å; T102-I106 HydrophobicContact CG2-CD1 3.91Å; T102-I106 VanDerWaalsContact O-CG1 3.31Å; T102-I106 WeakPolarHBondContact O-CG1 3.36Å; T102-I106 PolarHBondContact O-N 3.05Å
103	L	87.5	Confident	80.6	Confident	67 Å²	67	59.9 Å²	59.9	35%	0.351	31%	0.307	S	S	.	.	H	α-helix	trans	-63.5	-40.8	175.1	-173.8	63.5	0	0	0	111.6	L99 R100 W101 R105 I106 M107 L157	L99-L103 WeakPolarHBondContact O-CB 3.31Å; L99-L103 PolarHBondContact O-N 3.19Å; R100-L103 PolarHBondContact O-N 3.29Å; W101-L103 VanDerWaalsContact C-N 3.35Å; L103-R105 VanDerWaalsContact C-N 3.33Å; L103-R105 PolarHBondContact O-N 3.3Å; L103-I106 PolarHBondContact O-N 3.5Å; L103-M107 HydrophobicContact CD1-CE 3.93Å; L103-M107 HydrophobicContact CD1-CG 4.2Å; L103-M107 HydrophobicContact CG-CG 4.29Å; L103-M107 WeakPolarHBondContact O-CB 3.29Å; L103-M107 VanDerWaalsContact O-CG 3.32Å; L103-M107 WeakPolarHBondContact O-CG 3.36Å; L103-M107 PolarHBondContact O-N 2.93Å; L103-L157 HydrophobicContact CB-CD1 4.25Å; L103-L157 HydrophobicContact CD2-CD1 3.7Å; L103-L157 HydrophobicContact CG-CD1 3.78Å
104	A	86.1	Confident	82.3	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59.2	-43.2	175.4	0	0	0	0	0	111.9	R100 W101 T102 S108 G154 L157 A158	R100-A104 WeakPolarHBondContact O-CB 3.32Å; R100-A104 PolarHBondContact O-N 3.4Å; W101-A104 WeakPolarHBondContact O-CB 3.15Å; W101-A104 PolarHBondContact O-N 3.33Å; T102-A104 PolarHBondContact O-N 3.14Å; A104-S108 WeakPolarHBondContact O-CB 3.42Å; A104-S108 PolarHBondContact O-N 3.06Å; A104-S108 PolarHBondContact O-OG 3.06Å; A104-G154 WeakPolarHBondContact CB-O 3.5Å; A104-L157 HydrophobicContact CB-CB 3.89Å; A104-A158 HydrophobicContact CB-CB 4.29Å
105	R	88.5	Confident	83.8	Confident	63 Å²	63	57.4 Å²	57.4	24%	0.238	29%	0.294	C	S	.	.	H	α-helix	trans	-60.9	-50	174	-72.1	170.7	173.1	170.5	0.6	111.7	L73 F74 W101 T102 L103 S108 L109	L73-R105 HydrophobicContact CG-CG 4.14Å; L73-R105 PolarHBondContact O-NE 3.46Å; L73-R105 PolarHBondContact O-NH2 2.87Å; F74-R105 HydrophobicContact CD1-CG 4.34Å; F74-R105 HydrophobicContact CE1-CB 3.96Å; F74-R105 HydrophobicContact CE1-CG 3.97Å; F74-R105 HydrophobicContact CZ-CB 4.33Å; F74-R105 HydrophobicContact CZ-CG 4.45Å; W101-R105 WeakPolarHBondContact O-CG 3.45Å; W101-R105 PolarHBondContact O-N 2.96Å; T102-R105 WeakPolarHBondContact O-CB 3.34Å; T102-R105 PolarHBondContact O-N 3.17Å; L103-R105 VanDerWaalsContact C-N 3.33Å; L103-R105 PolarHBondContact O-N 3.3Å; R105-S108 PolarHBondContact O-N 3.01Å; R105-L109 WeakPolarHBondContact O-CG 3.46Å; R105-L109 PolarHBondContact O-N 3.35Å
106	I	90.7	Very high	85.5	Confident	84 Å²	84	52.4 Å²	52.4	43%	0.431	27%	0.272	S	S	.	.	H	α-helix	trans	-63.1	-47.5	-177.9	-68.5	167.6	0	0	0	110.5	T102 L103 S108 L109 I110	T102-I106 HydrophobicContact CG2-CD1 3.91Å; T102-I106 VanDerWaalsContact O-CG1 3.31Å; T102-I106 WeakPolarHBondContact O-CG1 3.36Å; T102-I106 PolarHBondContact O-N 3.05Å; L103-I106 PolarHBondContact O-N 3.5Å; I106-S108 VanDerWaalsContact C-N 3.34Å; I106-S108 PolarHBondContact O-N 3.01Å; I106-L109 PolarHBondContact O-N 3.28Å; I106-I110 HydrophobicContact CG2-CD1 3.64Å; I106-I110 HydrophobicContact CG2-CG1 4.32Å; I106-I110 VanDerWaalsContact O-CG1 3.29Å; I106-I110 WeakPolarHBondContact O-CG1 3.28Å; I106-I110 PolarHBondContact O-N 3.38Å
107	M	91.5	Very high	87	Confident	49 Å²	49	54.5 Å²	54.5	24%	0.241	29%	0.286	C	S	.	.	H	α-helix	trans	-62	-41.8	179	-72.7	-63.9	-179.2	0	0	111.8	L103 L109 I110 G111 C150 I153	L103-M107 HydrophobicContact CD1-CE 3.93Å; L103-M107 HydrophobicContact CD1-CG 4.2Å; L103-M107 HydrophobicContact CG-CG 4.29Å; L103-M107 WeakPolarHBondContact O-CB 3.29Å; L103-M107 VanDerWaalsContact O-CG 3.32Å; L103-M107 WeakPolarHBondContact O-CG 3.36Å; L103-M107 PolarHBondContact O-N 2.93Å; M107-L109 VanDerWaalsContact C-N 3.34Å; M107-L109 PolarHBondContact O-N 2.61Å; M107-I110 PolarHBondContact O-N 3.22Å; M107-G111 PolarHBondContact O-N 3.43Å; M107-C150 WeakPolarHBondContact O-CB 3.31Å; M107-I153 HydrophobicContact CG-CG2 4.2Å
108	S	88.7	Confident	88.5	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.014	26%	0.258	C	S	.	.	H	α-helix	trans	-63.1	-38.9	175.8	-58.9	0	0	0	0	112.3	A104 R105 I106 G111 L112	A104-S108 WeakPolarHBondContact O-CB 3.42Å; A104-S108 PolarHBondContact O-N 3.06Å; A104-S108 PolarHBondContact O-OG 3.06Å; R105-S108 PolarHBondContact O-N 3.01Å; I106-S108 VanDerWaalsContact C-N 3.34Å; I106-S108 PolarHBondContact O-N 3.01Å; S108-G111 PolarHBondContact O-N 3.49Å; S108-L112 PolarHBondContact O-N 3.4Å
109	L	91.8	Very high	89.5	Confident	88 Å²	88	49.3 Å²	49.3	46%	0.461	25%	0.249	S	C	.	.	H	α-helix	trans	-68.5	-42.5	175.5	-71.5	174.4	0	0	0	112.4	F74 R105 I106 M107 G111 L112 L113	F74-L109 HydrophobicContact CE1-CD1 4.07Å; F74-L109 HydrophobicContact CE1-CD2 4.38Å; F74-L109 HydrophobicContact CE1-CG 4.24Å; F74-L109 HydrophobicContact CE2-CD2 4.49Å; F74-L109 HydrophobicContact CZ-CD1 4.13Å; F74-L109 HydrophobicContact CZ-CD2 3.78Å; F74-L109 HydrophobicContact CZ-CG 3.77Å; R105-L109 WeakPolarHBondContact O-CG 3.46Å; R105-L109 PolarHBondContact O-N 3.35Å; I106-L109 PolarHBondContact O-N 3.28Å; M107-L109 VanDerWaalsContact C-N 3.34Å; M107-L109 PolarHBondContact O-N 2.61Å; L109-G111 VanDerWaalsContact C-N 3.29Å; L109-G111 PolarHBondContact O-N 3.18Å; L109-L112 PolarHBondContact O-N 3.1Å; L109-L113 WeakPolarHBondContact O-CB 3.34Å; L109-L113 PolarHBondContact O-N 3.04Å
110	I	93.8	Very high	90.1	Very high	73 Å²	73	46.5 Å²	46.5	37%	0.374	23%	0.234	S	C	.	.	H	α-helix	trans	-61.3	-43.2	175.1	-67.9	167.8	0	0	0	109.7	I106 M107 L113 T114	I106-I110 HydrophobicContact CG2-CD1 3.64Å; I106-I110 HydrophobicContact CG2-CG1 4.32Å; I106-I110 VanDerWaalsContact O-CG1 3.29Å; I106-I110 WeakPolarHBondContact O-CG1 3.28Å; I106-I110 PolarHBondContact O-N 3.38Å; M107-I110 PolarHBondContact O-N 3.22Å; I110-L113 PolarHBondContact O-N 2.73Å; I110-T114 HydrophobicContact CG2-CG2 4.29Å; I110-T114 WeakPolarHBondContact O-CB 3.37Å; I110-T114 VanDerWaalsContact O-CG2 3.28Å; I110-T114 WeakPolarHBondContact O-CG2 3.38Å; I110-T114 PolarHBondContact O-N 3.12Å; I110-T114 PolarHBondContact O-OG1 3.48Å
111	G	91.3	Very high	90.6	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59.1	-46.6	175.1	0	0	0	0	0	112.9	M107 S108 L109 T114 A115	M107-G111 PolarHBondContact O-N 3.43Å; S108-G111 PolarHBondContact O-N 3.49Å; L109-G111 VanDerWaalsContact C-N 3.29Å; L109-G111 PolarHBondContact O-N 3.18Å; G111-T114 WeakPolarHBondContact CA-OG1 3.36Å; G111-T114 PolarHBondContact O-N 3.47Å; G111-T114 PolarHBondContact O-OG1 3.33Å; G111-A115 WeakPolarHBondContact O-CB 3.38Å; G111-A115 PolarHBondContact O-N 2.89Å
112	L	92.7	Very high	90.9	Very high	27 Å²	27	44.2 Å²	44.2	14%	0.141	23%	0.228	C	C	.	.	H	α-helix	trans	-63.5	-44.4	176.1	179.9	63.6	0	0	0	112.1	I38 T41 I42 L45 S108 L109 A115 I116	I38-L112 HydrophobicContact CG2-CD1 4.31Å; T41-L112 HydrophobicContact CG2-CD1 4.08Å; I42-L112 HydrophobicContact CG1-CD1 3.92Å; I42-L112 HydrophobicContact CG1-CD2 4.17Å; L45-L112 HydrophobicContact CD1-CB 4.4Å; L45-L112 HydrophobicContact CD1-CD2 4.07Å; S108-L112 PolarHBondContact O-N 3.4Å; L109-L112 PolarHBondContact O-N 3.1Å; L112-A115 PolarHBondContact O-N 2.77Å; L112-I116 HydrophobicContact CD1-CD1 4.23Å; L112-I116 HydrophobicContact CD1-CG1 4.49Å; L112-I116 HydrophobicContact CG-CD1 4.03Å; L112-I116 VanDerWaalsContact O-CG1 3.3Å; L112-I116 WeakPolarHBondContact O-CG1 3.3Å; L112-I116 PolarHBondContact O-N 2.87Å
113	L	94.8	Very high	91.2	Very high	115 Å²	115	45.1 Å²	45.1	60%	0.602	23%	0.231	S	C	*	.	H	α-helix	trans	-65.7	-40.2	-179.9	-172.6	66.9	0	0	0	111.7	L109 I110 I116 T117	L109-L113 WeakPolarHBondContact O-CB 3.34Å; L109-L113 PolarHBondContact O-N 3.04Å; I110-L113 PolarHBondContact O-N 2.73Å; L113-I116 PolarHBondContact O-N 3.37Å; L113-T117 WeakPolarHBondContact O-CG2 3.37Å; L113-T117 PolarHBondContact O-N 3.32Å; L113-T117 PolarHBondContact O-OG1 2.92Å; L113-T117 VanDerWaalsContact O-OG1 3.05Å
114	T	94.1	Very high	91.2	Very high	21 Å²	21	45.8 Å²	45.8	13%	0.129	23%	0.234	C	C	.	.	H	α-helix	trans	-67.1	-36.5	175.1	50.4	0	0	0	0	111.9	I110 G111 T117 S118 I146 A147	I110-T114 HydrophobicContact CG2-CG2 4.29Å; I110-T114 WeakPolarHBondContact O-CB 3.37Å; I110-T114 VanDerWaalsContact O-CG2 3.28Å; I110-T114 WeakPolarHBondContact O-CG2 3.38Å; I110-T114 PolarHBondContact O-N 3.12Å; I110-T114 PolarHBondContact O-OG1 3.48Å; G111-T114 WeakPolarHBondContact CA-OG1 3.36Å; G111-T114 PolarHBondContact O-N 3.47Å; G111-T114 PolarHBondContact O-OG1 3.33Å; T114-T117 VanDerWaalsContact CA-OG1 3.3Å; T114-T117 WeakPolarHBondContact CA-OG1 3.42Å; T114-T117 PolarHBondContact O-OG1 2.85Å; T114-S118 WeakPolarHBondContact O-CB 3.26Å; T114-S118 PolarHBondContact O-N 3.47Å; T114-I146 HydrophobicContact CG2-CG2 3.97Å; T114-A147 WeakPolarHBondContact OG1-CA 3.47Å; T114-A147 WeakPolarHBondContact OG1-CB 3.35Å
115	A	92	Very high	91.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.6	-43.8	171.9	0	0	0	0	0	112.4	I38 G111 L112 S118 F119 A147 Y262	I38-A115 HydrophobicContact CG1-CB 4.11Å; G111-A115 WeakPolarHBondContact O-CB 3.38Å; G111-A115 PolarHBondContact O-N 2.89Å; L112-A115 PolarHBondContact O-N 2.77Å; A115-S118 PolarHBondContact O-N 2.89Å; A115-F119 WeakPolarHBondContact O-CB 3.43Å; A115-F119 PolarHBondContact O-N 2.9Å; A115-A147 HydrophobicContact CB-CB 4.01Å; A115-Y262 HydrophobicContact CB-CE1 3.87Å
116	I	93.9	Very high	90.9	Very high	61 Å²	61	44 Å²	44	31%	0.313	23%	0.231	S	C	.	.	H	α-helix	trans	-63.9	-45.9	177.8	-68.1	165.3	0	0	0	110.9	I38 L112 L113 S118 F119 I120	I38-I116 HydrophobicContact CD1-CG1 4.5Å; I38-I116 HydrophobicContact CG2-CG1 4.3Å; L112-I116 HydrophobicContact CD1-CD1 4.23Å; L112-I116 HydrophobicContact CD1-CG1 4.49Å; L112-I116 HydrophobicContact CG-CD1 4.03Å; L112-I116 VanDerWaalsContact O-CG1 3.3Å; L112-I116 WeakPolarHBondContact O-CG1 3.3Å; L112-I116 PolarHBondContact O-N 2.87Å; L113-I116 PolarHBondContact O-N 3.37Å; I116-S118 VanDerWaalsContact C-N 3.33Å; I116-S118 PolarHBondContact O-N 2.93Å; I116-F119 WeakPolarHBondContact O-CB 3.4Å; I116-F119 PolarHBondContact O-N 2.89Å; I116-F119 VanDerWaalsContact O-N 3.17Å; I116-I120 HydrophobicContact CG2-CD1 4.04Å; I116-I120 WeakPolarHBondContact O-CG1 3.39Å; I116-I120 PolarHBondContact O-N 3.46Å
117	T	93.2	Very high	90.5	Very high	51 Å²	51	46.7 Å²	46.7	31%	0.313	24%	0.242	S	C	.	.	H	α-helix	trans	-62.8	-41.5	176.9	51	0	0	0	0	111.4	L113 T114 F119 I120 I121	L113-T117 WeakPolarHBondContact O-CG2 3.37Å; L113-T117 PolarHBondContact O-N 3.32Å; L113-T117 PolarHBondContact O-OG1 2.92Å; L113-T117 VanDerWaalsContact O-OG1 3.05Å; T114-T117 VanDerWaalsContact CA-OG1 3.3Å; T114-T117 WeakPolarHBondContact CA-OG1 3.42Å; T114-T117 PolarHBondContact O-OG1 2.85Å; T117-F119 VanDerWaalsContact C-N 3.31Å; T117-F119 PolarHBondContact O-N 3.17Å; T117-I120 PolarHBondContact O-N 3.35Å; T117-I121 VanDerWaalsContact O-CG1 3.29Å; T117-I121 WeakPolarHBondContact O-CG1 3.14Å; T117-I121 PolarHBondContact O-N 3.38Å
118	S	91.3	Very high	90	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-59.8	-40.7	172.7	-167.7	0	0	0	0	112.4	T114 A115 I116 I121 H122 L144	T114-S118 WeakPolarHBondContact O-CB 3.26Å; T114-S118 PolarHBondContact O-N 3.47Å; A115-S118 PolarHBondContact O-N 2.89Å; I116-S118 VanDerWaalsContact C-N 3.33Å; I116-S118 PolarHBondContact O-N 2.93Å; S118-I121 PolarHBondContact O-N 3.3Å; S118-H122 WeakPolarHBondContact O-CB 3.41Å; S118-H122 PolarHBondContact O-N 2.97Å; S118-L144 WeakPolarHBondContact OG-CD2 3.15Å; S118-L144 VanDerWaalsContact OG-CG 3.31Å; S118-L144 WeakPolarHBondContact OG-CG 3.27Å
119	F	92.3	Very high	89.1	Confident	39 Å²	39	57.7 Å²	57.7	17%	0.171	28%	0.283	C	S	.	.	H	α-helix	trans	-64.2	-42.2	177.3	180	-105.5	0	0	0	112.2	L31 L34 F35 I38 A115 I116 T117 H122 I123	L31-F119 HydrophobicContact CD1-CD2 3.66Å; L31-F119 HydrophobicContact CD1-CE2 3.32Å; L31-F119 HydrophobicContact CD1-CZ 4.18Å; L31-F119 HydrophobicContact CG-CE2 4.21Å; L34-F119 HydrophobicContact CB-CD2 4.33Å; L34-F119 HydrophobicContact CD2-CB 3.79Å; L34-F119 HydrophobicContact CD2-CD2 3.94Å; L34-F119 HydrophobicContact CD2-CG 4.39Å; L34-F119 HydrophobicContact CG-CB 4.2Å; L34-F119 HydrophobicContact CG-CD2 4Å; F35-F119 HydrophobicContact CB-CE2 3.74Å; F35-F119 HydrophobicContact CB-CZ 4.15Å; F35-F119 HydrophobicContact CD2-CE1 4.2Å; F35-F119 HydrophobicContact CD2-CE2 4.03Å; F35-F119 AromaticContact CD2-CZ 3.59Å; F35-F119 HydrophobicContact CD2-CZ 3.59Å; F35-F119 HydrophobicContact CE2-CZ 4.41Å; F35-F119 HydrophobicContact CG-CE2 4.32Å; F35-F119 HydrophobicContact CG-CZ 4.23Å; I38-F119 HydrophobicContact CD1-CB 3.66Å; I38-F119 HydrophobicContact CD1-CD1 4.48Å; I38-F119 HydrophobicContact CD1-CD2 4.3Å; I38-F119 HydrophobicContact CD1-CG 3.92Å; A115-F119 WeakPolarHBondContact O-CB 3.43Å; A115-F119 PolarHBondContact O-N 2.9Å; I116-F119 WeakPolarHBondContact O-CB 3.4Å; I116-F119 PolarHBondContact O-N 2.89Å; I116-F119 VanDerWaalsContact O-N 3.17Å; T117-F119 VanDerWaalsContact C-N 3.31Å; T117-F119 PolarHBondContact O-N 3.17Å; F119-H122 PolarHBondContact O-N 2.96Å; F119-I123 HydrophobicContact CD1-CD1 3.8Å; F119-I123 HydrophobicContact CE1-CD1 3.32Å; F119-I123 HydrophobicContact CE1-CG1 4.4Å; F119-I123 HydrophobicContact CE2-CD1 4.25Å; F119-I123 HydrophobicContact CG-CD1 4.45Å; F119-I123 HydrophobicContact CZ-CD1 3.59Å; F119-I123 HydrophobicContact CZ-CG1 4.37Å; F119-I123 WeakPolarHBondContact O-CG1 3.43Å; F119-I123 PolarHBondContact O-N 3.42Å
120	I	92	Very high	87.6	Confident	88 Å²	88	59.3 Å²	59.3	45%	0.451	30%	0.297	S	S	.	.	H	α-helix	trans	-62.2	-46.6	174.8	-66	165.7	0	0	0	110.4	I116 T117 H122 I123 I124	I116-I120 HydrophobicContact CG2-CD1 4.04Å; I116-I120 WeakPolarHBondContact O-CG1 3.39Å; I116-I120 PolarHBondContact O-N 3.46Å; T117-I120 PolarHBondContact O-N 3.35Å; I120-H122 VanDerWaalsContact C-N 3.32Å; I120-H122 PolarHBondContact O-N 2.91Å; I120-I123 PolarHBondContact O-N 3.36Å; I120-I124 HydrophobicContact CG2-CD1 3.78Å; I120-I124 HydrophobicContact CG2-CG1 4.46Å; I120-I124 VanDerWaalsContact O-CG1 3.27Å; I120-I124 WeakPolarHBondContact O-CG1 3.37Å; I120-I124 PolarHBondContact O-N 2.94Å
121	I	89.6	Confident	86.1	Confident	46 Å²	46	59.5 Å²	59.5	24%	0.236	30%	0.299	C	S	.	.	H	α-helix	trans	-58.9	-45.4	176.5	-67.7	165.5	0	0	0	110.4	T117 S118 I123 I124 L125 E140 F143	T117-I121 VanDerWaalsContact O-CG1 3.29Å; T117-I121 WeakPolarHBondContact O-CG1 3.14Å; T117-I121 PolarHBondContact O-N 3.38Å; S118-I121 PolarHBondContact O-N 3.3Å; I121-I123 PolarHBondContact O-N 3.37Å; I121-I124 PolarHBondContact O-N 2.9Å; I121-L125 HydrophobicContact CG2-CD1 3.8Å; I121-L125 HydrophobicContact CG2-CG 4.31Å; I121-L125 WeakPolarHBondContact O-CG 3.38Å; I121-L125 PolarHBondContact O-N 2.97Å; I121-E140 HydrophobicContact CG2-CB 4.44Å; I121-E140 HydrophobicContact CG2-CG 4.49Å; I121-F143 HydrophobicContact CD1-CD2 3.62Å; I121-F143 HydrophobicContact CD1-CE2 3.6Å; I121-F143 HydrophobicContact CD1-CZ 4.45Å
122	H	89.7	Confident	85	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59.5	-44.3	178.2	-165	107.8	0	0	0	111.7	Y27 S30 L31 S118 F119 I120 L125 A126 E140	Y27-H122 AromaticContact CD1-NE2 3.72Å; Y27-H122 AromaticContact CD2-CE1 3.6Å; Y27-H122 AromaticContact CE1-CE1 3.71Å; Y27-H122 AromaticContact CE1-NE2 3.34Å; Y27-H122 VanDerWaalsContact CE1-NE2 3.34Å; Y27-H122 WeakPolarHBondContact CE1-NE2 3.39Å; Y27-H122 AromaticContact CE2-CE1 3.14Å; Y27-H122 WeakPolarHBondContact CE2-CE1 3.43Å; Y27-H122 AromaticContact CE2-ND1 3.81Å; Y27-H122 AromaticContact CE2-NE2 3.7Å; Y27-H122 AromaticContact CZ-CD2 3.9Å; Y27-H122 AromaticContact CZ-CE1 3.19Å; Y27-H122 AromaticContact CZ-ND1 3.75Å; Y27-H122 AromaticContact CZ-NE2 3.31Å; Y27-H122 VanDerWaalsContact CZ-NE2 3.31Å; Y27-H122 PolarHBondContact O-NE2 2.97Å; S30-H122 PolarHBondContact OG-CE1 2.85Å; L31-H122 HydrophobicContact CD1-CB 4.31Å; S118-H122 WeakPolarHBondContact O-CB 3.41Å; S118-H122 PolarHBondContact O-N 2.97Å; F119-H122 PolarHBondContact O-N 2.96Å; I120-H122 VanDerWaalsContact C-N 3.32Å; I120-H122 PolarHBondContact O-N 2.91Å; H122-L125 PolarHBondContact O-N 3.47Å; H122-A126 VanDerWaalsContact O-CB 3.26Å; H122-A126 WeakPolarHBondContact O-CB 3.48Å; H122-A126 PolarHBondContact O-N 3.36Å; H122-E140 HydrophobicContact CB-CG 4.49Å; H122-E140 IonicContact CE1-OE1 2.82Å; H122-E140 PolarHBondContact CE1-OE1 3.36Å; H122-E140 IonicContact CG-OE1 3.6Å; H122-E140 IonicContact CG-OE2 3.34Å; H122-E140 IonicContact ND1-OE1 3.68Å; H122-E140 PolarHBondContact ND1-OE1 3.48Å; H122-E140 IonicContact ND1-OE2 3.69Å; H122-E140 PolarHBondContact ND1-OE2 3.5Å
123	I	89.1	Confident	84.3	Confident	74 Å²	74	66.7 Å²	66.7	38%	0.379	33%	0.328	S	S	.	.	H	α-helix	trans	-61.4	-46.6	176	-71.2	171.4	0	0	0	111	L31 F119 I120 I121 L125 A126 H127	L31-I123 HydrophobicContact CD1-CG1 3.85Å; F119-I123 HydrophobicContact CD1-CD1 3.8Å; F119-I123 HydrophobicContact CE1-CD1 3.32Å; F119-I123 HydrophobicContact CE1-CG1 4.4Å; F119-I123 HydrophobicContact CE2-CD1 4.25Å; F119-I123 HydrophobicContact CG-CD1 4.45Å; F119-I123 HydrophobicContact CZ-CD1 3.59Å; F119-I123 HydrophobicContact CZ-CG1 4.37Å; F119-I123 WeakPolarHBondContact O-CG1 3.43Å; F119-I123 PolarHBondContact O-N 3.42Å; I120-I123 PolarHBondContact O-N 3.36Å; I121-I123 PolarHBondContact O-N 3.37Å; I123-L125 VanDerWaalsContact C-N 3.31Å; I123-L125 PolarHBondContact O-N 3.33Å; I123-A126 PolarHBondContact O-N 3.41Å; I123-H127 WeakPolarHBondContact O-CB 3.49Å; I123-H127 PolarHBondContact O-N 3.48Å
124	I	88.3	Confident	83.7	Confident	80 Å²	80	67.9 Å²	67.9	41%	0.41	32%	0.324	S	S	.	.	H	α-helix	trans	-60.1	-43.6	179.6	-67.8	168	0	0	0	110.1	I120 I121 H127 F128	I120-I124 HydrophobicContact CG2-CD1 3.78Å; I120-I124 HydrophobicContact CG2-CG1 4.46Å; I120-I124 VanDerWaalsContact O-CG1 3.27Å; I120-I124 WeakPolarHBondContact O-CG1 3.37Å; I120-I124 PolarHBondContact O-N 2.94Å; I121-I124 PolarHBondContact O-N 2.9Å; I124-H127 PolarHBondContact O-N 3.46Å; I124-F128 HydrophobicContact CG2-CD2 3.9Å; I124-F128 HydrophobicContact CG2-CE2 4.4Å; I124-F128 WeakPolarHBondContact O-CD2 3.46Å; I124-F128 PolarHBondContact O-N 2.93Å
125	L	84.6	Confident	83.1	Confident	7 Å²	7	69.9 Å²	69.9	4%	0.037	34%	0.339	C	S	.	.	H	α-helix	trans	-71.4	-31.3	177.9	-66.7	174.6	0	0	0	113.5	I121 H122 I123 R132 N136	I121-L125 HydrophobicContact CG2-CD1 3.8Å; I121-L125 HydrophobicContact CG2-CG 4.31Å; I121-L125 WeakPolarHBondContact O-CG 3.38Å; I121-L125 PolarHBondContact O-N 2.97Å; H122-L125 PolarHBondContact O-N 3.47Å; I123-L125 VanDerWaalsContact C-N 3.31Å; I123-L125 PolarHBondContact O-N 3.33Å; L125-R132 PolarHBondContact O-NE 3.35Å; L125-R132 VanDerWaalsContact O-NE 3.11Å; L125-N136 HydrophobicContact CD1-CB 3.97Å; L125-N136 HydrophobicContact CD2-CB 3.57Å; L125-N136 HydrophobicContact CG-CB 4.41Å
126	A	82.4	Confident	82.8	Confident	18 Å²	18	72.7 Å²	72.7	15%	0.149	35%	0.354	C	S	.	.	H	α-helix	trans	-66.1	-43.2	173	0	0	0	0	0	111	Y27 H122 I123 R132	Y27-A126 HydrophobicContact CE1-CB 4.42Å; H122-A126 VanDerWaalsContact O-CB 3.26Å; H122-A126 WeakPolarHBondContact O-CB 3.48Å; H122-A126 PolarHBondContact O-N 3.36Å; I123-A126 PolarHBondContact O-N 3.41Å; A126-R132 PolarHBondContact O-NH2 2.93Å
127	H	84.2	Confident	82.5	Confident	141 Å²	141	69.8 Å²	69.8	65%	0.653	34%	0.339	S	S	*	.	H	α-helix	trans	-73.4	-52.9	-179.1	-167.6	80.3	0	0	0	112.5	I123 I124 R129	I123-H127 WeakPolarHBondContact O-CB 3.49Å; I123-H127 PolarHBondContact O-N 3.48Å; I124-H127 PolarHBondContact O-N 3.46Å; H127-R129 PolarHBondContact O-N 3.33Å; H127-R129 VanDerWaalsContact O-N 3.14Å
128	F	79.9	Confident	82.3	Confident	97 Å²	97	70.5 Å²	70.5	43%	0.425	34%	0.341	S	S	.	.			trans	-88.5	81.9	-178.8	-64.6	-75.2	0	0	0	111.3	I124 T130 N131	I124-F128 HydrophobicContact CG2-CD2 3.9Å; I124-F128 HydrophobicContact CG2-CE2 4.4Å; I124-F128 WeakPolarHBondContact O-CD2 3.46Å; I124-F128 PolarHBondContact O-N 2.93Å; F128-T130 PolarHBondContact O-N 2.9Å; F128-N131 HydrophobicContact CB-CB 4.19Å; F128-N131 PolarHBondContact O-N 3.2Å
129	R	69.1	Low	82.1	Confident	185 Å²	185	72.3 Å²	72.3	70%	0.698	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-52.8	-30.1	176.8	-72.6	-174.1	177.3	178.7	1.5	113.6	H127 N131 R132	H127-R129 PolarHBondContact O-N 3.33Å; H127-R129 VanDerWaalsContact O-N 3.14Å; R129-N131 VanDerWaalsContact C-N 3.28Å; R129-N131 PolarHBondContact O-N 3.45Å; R129-R132 PolarHBondContact O-N 2.92Å
130	T	60.8	Low	82	Confident	123 Å²	123	70.4 Å²	70.4	76%	0.755	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-67	-24.5	178	41.8	0	0	0	0	113.5	F128	F128-T130 PolarHBondContact O-N 2.9Å
131	N	62.3	Low	81.9	Confident	76 Å²	76	66.9 Å²	66.9	41%	0.406	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-96.5	12.3	-178.1	-71.3	-25	0	0	0	113.8	F128 R129 K133 N136	F128-N131 HydrophobicContact CB-CB 4.19Å; F128-N131 PolarHBondContact O-N 3.2Å; R129-N131 VanDerWaalsContact C-N 3.28Å; R129-N131 PolarHBondContact O-N 3.45Å; N131-K133 PolarHBondContact O-N 3.05Å; N131-N136 PolarHBondContact O-ND2 2.84Å
132	R	67.9	Low	82.1	Confident	39 Å²	39	68 Å²	68	15%	0.147	34%	0.339	C	S	.	.			trans	-76.4	57.9	177	-66.8	-172.5	-178.9	-165.5	7	112.4	L125 A126 R129 Y272	L125-R132 PolarHBondContact O-NE 3.35Å; L125-R132 VanDerWaalsContact O-NE 3.11Å; A126-R132 PolarHBondContact O-NH2 2.93Å; R129-R132 PolarHBondContact O-N 2.92Å; R132-Y272 PolarHBondContact NH1-OH 3.26Å; R132-Y272 VanDerWaalsContact NH1-OH 3.13Å
133	K	79.5	Confident	82.2	Confident	139 Å²	139	71.4 Å²	71.4	60%	0.604	35%	0.354	S	S	*	.			trans	-76.7	143.7	166.8	-65.9	-178	-179	176.3	0	108.7	N131 S135 N136 V137	N131-K133 PolarHBondContact O-N 3.05Å; K133-S135 PolarHBondContact O-N 3.2Å; K133-S135 VanDerWaalsContact O-N 3.16Å; K133-N136 PolarHBondContact O-N 2.93Å; K133-V137 PolarHBondContact O-N 3.41Å
134	W	80.6	Confident	82.3	Confident	141 Å²	141	67.9 Å²	67.9	53%	0.534	34%	0.336	S	S	.	.	H	α-helix	trans	-54.2	-34.3	177.4	65.4	-86.2	0	0	0	112.5	N136 V137 L138 F273 L276	W134-N136 VanDerWaalsContact C-N 3.32Å; W134-N136 PolarHBondContact O-N 3.5Å; W134-V137 PolarHBondContact O-N 2.86Å; W134-L138 HydrophobicContact CZ3-CD2 4.19Å; W134-L138 WeakPolarHBondContact O-CB 3.49Å; W134-L138 PolarHBondContact O-N 3.35Å; W134-F273 HydrophobicContact CB-CE2 4.45Å; W134-F273 HydrophobicContact CE3-CE2 4.41Å; W134-L276 HydrophobicContact CB-CD2 4.12Å; W134-L276 HydrophobicContact CB-CG 4.37Å
135	S	83.2	Confident	82.5	Confident	63 Å²	63	68.7 Å²	68.7	44%	0.441	34%	0.34	S	S	.	.	H	α-helix	trans	-60.5	-36.1	176.2	-171.6	0	0	0	0	113.7	K133 L138 A139	K133-S135 PolarHBondContact O-N 3.2Å; K133-S135 VanDerWaalsContact O-N 3.16Å; S135-L138 PolarHBondContact O-N 3.37Å; S135-A139 PolarHBondContact O-N 3.09Å; S135-A139 VanDerWaalsContact O-N 3.08Å
136	N	85.8	Confident	82.9	Confident	58 Å²	58	71.6 Å²	71.6	31%	0.31	36%	0.355	S	S	.	.	H	α-helix	trans	-76	-38.3	-178.6	-66.7	-7.5	0	0	0	111	L125 N131 K133 W134 L138 A139 E140	L125-N136 HydrophobicContact CD1-CB 3.97Å; L125-N136 HydrophobicContact CD2-CB 3.57Å; L125-N136 HydrophobicContact CG-CB 4.41Å; N131-N136 PolarHBondContact O-ND2 2.84Å; K133-N136 PolarHBondContact O-N 2.93Å; W134-N136 VanDerWaalsContact C-N 3.32Å; W134-N136 PolarHBondContact O-N 3.5Å; N136-L138 VanDerWaalsContact C-N 3.3Å; N136-A139 PolarHBondContact O-N 3.28Å; N136-E140 PolarHBondContact O-N 3.04Å; N136-E140 VanDerWaalsContact O-N 3.14Å
137	V	85.9	Confident	83.3	Confident	1 Å²	1	70.7 Å²	70.7	1%	0.006	35%	0.348	C	S	.	.	H	α-helix	trans	-65.9	-36.8	173.2	-175.8	0	0	0	0	110.3	K133 W134 E140 V141 V269 Y272 F273 L276	K133-V137 PolarHBondContact O-N 3.41Å; W134-V137 PolarHBondContact O-N 2.86Å; V137-E140 WeakPolarHBondContact O-CB 3.19Å; V137-E140 PolarHBondContact O-N 3.32Å; V137-V141 WeakPolarHBondContact O-CG2 3.32Å; V137-V141 PolarHBondContact O-N 3.29Å; V137-V269 HydrophobicContact CG1-CG1 4.23Å; V137-Y272 HydrophobicContact CG1-CD1 4.08Å; V137-Y272 HydrophobicContact CG2-CD1 4.47Å; V137-Y272 HydrophobicContact CG2-CE1 4.15Å; V137-F273 HydrophobicContact CB-CD2 4.15Å; V137-F273 HydrophobicContact CG1-CB 3.86Å; V137-F273 HydrophobicContact CG1-CD2 3.98Å; V137-F273 HydrophobicContact CG1-CG 4.4Å; V137-L276 HydrophobicContact CB-CD2 4.45Å; V137-L276 HydrophobicContact CG2-CD2 3.85Å
138	L	88.9	Confident	83.7	Confident	65 Å²	65	64.4 Å²	64.4	34%	0.34	32%	0.319	S	S	.	.	H	α-helix	trans	-61.2	-43.8	173.8	-179.6	63.3	0	0	0	111.7	W134 S135 N136 E140 V141 V142 F273	W134-L138 HydrophobicContact CZ3-CD2 4.19Å; W134-L138 WeakPolarHBondContact O-CB 3.49Å; W134-L138 PolarHBondContact O-N 3.35Å; S135-L138 PolarHBondContact O-N 3.37Å; N136-L138 VanDerWaalsContact C-N 3.3Å; L138-E140 VanDerWaalsContact C-N 3.29Å; L138-E140 PolarHBondContact O-N 3.44Å; L138-V141 PolarHBondContact O-N 2.97Å; L138-V142 WeakPolarHBondContact O-CG2 3.37Å; L138-V142 PolarHBondContact O-N 2.92Å; L138-F273 HydrophobicContact CB-CD2 4.49Å; L138-F273 HydrophobicContact CB-CE2 3.81Å; L138-F273 HydrophobicContact CB-CZ 4.24Å; L138-F273 HydrophobicContact CD1-CE1 4.35Å; L138-F273 HydrophobicContact CD1-CE2 4.27Å; L138-F273 HydrophobicContact CD1-CZ 3.9Å
139	A	88.1	Confident	84.3	Confident	38 Å²	38	61.8 Å²	61.8	31%	0.314	32%	0.315	S	S	.	.	H	α-helix	trans	-58.8	-43.6	175.9	0	0	0	0	0	111.3	S135 N136 V141 V142 F143	S135-A139 PolarHBondContact O-N 3.09Å; S135-A139 VanDerWaalsContact O-N 3.08Å; N136-A139 PolarHBondContact O-N 3.28Å; A139-V141 PolarHBondContact O-N 2.87Å; A139-V142 PolarHBondContact O-N 3.38Å; A139-F143 HydrophobicContact CB-CE2 4.41Å; A139-F143 WeakPolarHBondContact O-CD2 3.26Å; A139-F143 PolarHBondContact O-N 3.44Å
140	E	89.3	Confident	85.5	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-58.1	-46.5	175.3	-160.3	-161.2	122.6	0	0	112.3	Y27 I121 H122 N136 V137 L138 V142 F143 L144 V269	Y27-E140 PolarHBondContact OH-OE2 3.35Å; I121-E140 HydrophobicContact CG2-CB 4.44Å; I121-E140 HydrophobicContact CG2-CG 4.49Å; H122-E140 HydrophobicContact CB-CG 4.49Å; H122-E140 IonicContact CE1-OE1 2.82Å; H122-E140 PolarHBondContact CE1-OE1 3.36Å; H122-E140 IonicContact CG-OE1 3.6Å; H122-E140 IonicContact CG-OE2 3.34Å; H122-E140 IonicContact ND1-OE1 3.68Å; H122-E140 PolarHBondContact ND1-OE1 3.48Å; H122-E140 IonicContact ND1-OE2 3.69Å; H122-E140 PolarHBondContact ND1-OE2 3.5Å; N136-E140 PolarHBondContact O-N 3.04Å; N136-E140 VanDerWaalsContact O-N 3.14Å; V137-E140 WeakPolarHBondContact O-CB 3.19Å; V137-E140 PolarHBondContact O-N 3.32Å; L138-E140 VanDerWaalsContact C-N 3.29Å; L138-E140 PolarHBondContact O-N 3.44Å; E140-V142 VanDerWaalsContact C-N 3.3Å; E140-V142 PolarHBondContact O-N 3.3Å; E140-F143 PolarHBondContact O-N 3.27Å; E140-L144 WeakPolarHBondContact O-CG 3.34Å; E140-L144 PolarHBondContact O-N 3.47Å; E140-V269 WeakPolarHBondContact OE1-CG1 3.44Å; E140-V269 WeakPolarHBondContact OE1-CG2 3.3Å
141	V	91.3	Very high	86.8	Confident	13 Å²	13	48.1 Å²	48.1	8%	0.079	25%	0.252	C	S	.	.	H	α-helix	trans	-58.9	-41.8	176	173.4	0	0	0	0	111.4	V137 L138 A139 L145 F266 V269 L270 F273	V137-V141 WeakPolarHBondContact O-CG2 3.32Å; V137-V141 PolarHBondContact O-N 3.29Å; L138-V141 PolarHBondContact O-N 2.97Å; A139-V141 PolarHBondContact O-N 2.87Å; V141-L145 WeakPolarHBondContact O-CB 3.27Å; V141-L145 PolarHBondContact O-N 2.84Å; V141-F266 HydrophobicContact CG1-CD2 4.21Å; V141-F266 HydrophobicContact CG1-CE2 3.53Å; V141-F266 HydrophobicContact CG1-CZ 4.3Å; V141-V269 HydrophobicContact CG2-CG1 3.65Å; V141-L270 HydrophobicContact CG1-CD1 4.22Å; V141-F273 HydrophobicContact CG2-CB 4.34Å
142	V	93	Very high	88.1	Confident	70 Å²	70	48.3 Å²	48.3	42%	0.424	25%	0.253	S	S	.	.	H	α-helix	trans	-67.3	-44.2	178.4	173.2	0	0	0	0	111.2	L138 A139 E140 L144 L145 I146	L138-V142 WeakPolarHBondContact O-CG2 3.37Å; L138-V142 PolarHBondContact O-N 2.92Å; A139-V142 PolarHBondContact O-N 3.38Å; E140-V142 VanDerWaalsContact C-N 3.3Å; E140-V142 PolarHBondContact O-N 3.3Å; V142-L144 PolarHBondContact O-N 2.98Å; V142-L145 PolarHBondContact O-N 2.84Å; V142-I146 HydrophobicContact CG1-CD1 3.86Å; V142-I146 HydrophobicContact CG1-CG1 4.47Å; V142-I146 VanDerWaalsContact O-CG1 3.3Å; V142-I146 WeakPolarHBondContact O-CG1 3.28Å; V142-I146 PolarHBondContact O-N 3.2Å
143	F	92.4	Very high	89.3	Confident	72 Å²	72	50.2 Å²	50.2	32%	0.316	27%	0.265	S	S	.	.	H	α-helix	trans	-63.1	-41	177	-77.5	-65.3	0	0	0	112.3	I121 A139 E140 I146 A147	I121-F143 HydrophobicContact CD1-CD2 3.62Å; I121-F143 HydrophobicContact CD1-CE2 3.6Å; I121-F143 HydrophobicContact CD1-CZ 4.45Å; A139-F143 HydrophobicContact CB-CE2 4.41Å; A139-F143 WeakPolarHBondContact O-CD2 3.26Å; A139-F143 PolarHBondContact O-N 3.44Å; E140-F143 PolarHBondContact O-N 3.27Å; F143-I146 PolarHBondContact O-N 3.39Å; F143-A147 WeakPolarHBondContact O-CB 3.49Å; F143-A147 PolarHBondContact O-N 2.77Å
144	L	90.9	Very high	89.6	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63	-41.6	174	-71.8	177	0	0	0	112.2	L34 S118 E140 V142 A147 V148 F266 V269	L34-L144 HydrophobicContact CD1-CD2 3.42Å; L34-L144 VanDerWaalsContact CD1-CD2 3.42Å; L34-L144 HydrophobicContact CD2-CD2 3.99Å; L34-L144 HydrophobicContact CG-CD2 4.36Å; S118-L144 WeakPolarHBondContact OG-CD2 3.15Å; S118-L144 VanDerWaalsContact OG-CG 3.31Å; S118-L144 WeakPolarHBondContact OG-CG 3.27Å; E140-L144 WeakPolarHBondContact O-CG 3.34Å; E140-L144 PolarHBondContact O-N 3.47Å; V142-L144 PolarHBondContact O-N 2.98Å; L144-A147 PolarHBondContact O-N 3.01Å; L144-V148 WeakPolarHBondContact O-CG2 3.49Å; L144-V148 PolarHBondContact O-N 3.44Å; L144-F266 HydrophobicContact CB-CB 4.38Å; L144-F266 HydrophobicContact CB-CD2 4.16Å; L144-V269 HydrophobicContact CD1-CB 4.21Å; L144-V269 HydrophobicContact CD1-CG2 3.86Å
145	L	92.6	Very high	89.9	Confident	96 Å²	96	37.4 Å²	37.4	50%	0.503	21%	0.214	S	C	.	.	H	α-helix	trans	-63.3	-43	177.7	-176	66.5	0	0	0	111.6	V141 V142 A147 V148 A149 F266	V141-L145 WeakPolarHBondContact O-CB 3.27Å; V141-L145 PolarHBondContact O-N 2.84Å; V142-L145 PolarHBondContact O-N 2.84Å; L145-A147 VanDerWaalsContact C-N 3.34Å; L145-V148 PolarHBondContact O-N 3.01Å; L145-A149 WeakPolarHBondContact O-CB 3.44Å; L145-A149 PolarHBondContact O-N 3.44Å; L145-F266 HydrophobicContact CB-CD2 4.49Å; L145-F266 HydrophobicContact CB-CE2 4.09Å; L145-F266 HydrophobicContact CD1-CE2 4.26Å; L145-F266 HydrophobicContact CD1-CZ 4.36Å
146	I	93.1	Very high	90.1	Very high	68 Å²	68	37.4 Å²	37.4	35%	0.349	21%	0.214	S	C	.	.	H	α-helix	trans	-62.5	-43.7	175.5	-67.2	166.6	0	0	0	110.1	T114 V142 F143 V148 A149 C150	T114-I146 HydrophobicContact CG2-CG2 3.97Å; V142-I146 HydrophobicContact CG1-CD1 3.86Å; V142-I146 HydrophobicContact CG1-CG1 4.47Å; V142-I146 VanDerWaalsContact O-CG1 3.3Å; V142-I146 WeakPolarHBondContact O-CG1 3.28Å; V142-I146 PolarHBondContact O-N 3.2Å; F143-I146 PolarHBondContact O-N 3.39Å; I146-V148 PolarHBondContact O-N 3.44Å; I146-A149 PolarHBondContact O-N 3.22Å; I146-C150 VanDerWaalsContact O-CB 3.32Å; I146-C150 WeakPolarHBondContact O-CB 3.36Å; I146-C150 PolarHBondContact O-N 3.05Å; I146-C150 PolarHBondContact O-SG 2.99Å; I146-C150 VanDerWaalsContact O-SG 3.35Å
147	A	91.5	Very high	90.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-58.9	-49.8	178.7	0	0	0	0	0	112.1	T114 A115 F143 L144 L145 C150 I151	T114-A147 WeakPolarHBondContact OG1-CA 3.47Å; T114-A147 WeakPolarHBondContact OG1-CB 3.35Å; A115-A147 HydrophobicContact CB-CB 4.01Å; F143-A147 WeakPolarHBondContact O-CB 3.49Å; F143-A147 PolarHBondContact O-N 2.77Å; L144-A147 PolarHBondContact O-N 3.01Å; L145-A147 VanDerWaalsContact C-N 3.34Å; A147-C150 PolarHBondContact O-N 3.35Å; A147-I151 VanDerWaalsContact O-CG1 3.27Å; A147-I151 WeakPolarHBondContact O-CG1 3.32Å; A147-I151 PolarHBondContact O-N 3.34Å
148	V	92.4	Very high	89.9	Confident	9 Å²	9	36.1 Å²	36.1	6%	0.055	21%	0.207	C	C	.	.	H	α-helix	trans	-58.7	-50.3	176.1	171.3	0	0	0	0	110.7	L144 L145 I146 C150 I151 L152 L263	L144-V148 WeakPolarHBondContact O-CG2 3.49Å; L144-V148 PolarHBondContact O-N 3.44Å; L145-V148 PolarHBondContact O-N 3.01Å; I146-V148 PolarHBondContact O-N 3.44Å; V148-C150 PolarHBondContact O-N 2.97Å; V148-I151 PolarHBondContact O-N 3.32Å; V148-L152 HydrophobicContact CG1-CD1 3.79Å; V148-L152 HydrophobicContact CG1-CG 4.45Å; V148-L152 WeakPolarHBondContact O-CB 3.43Å; V148-L152 WeakPolarHBondContact O-CG 3.2Å; V148-L152 PolarHBondContact O-N 3.32Å; V148-L263 HydrophobicContact CG1-CD2 4.41Å; V148-L263 HydrophobicContact CG1-CG 4.06Å
149	A	92.6	Very high	89.6	Confident	41 Å²	41	37.9 Å²	37.9	34%	0.339	21%	0.213	S	C	.	.	H	α-helix	trans	-61	-45.1	-178.5	0	0	0	0	0	112.3	L145 I146 L152 I153	L145-A149 WeakPolarHBondContact O-CB 3.44Å; L145-A149 PolarHBondContact O-N 3.44Å; I146-A149 PolarHBondContact O-N 3.22Å; A149-L152 PolarHBondContact O-N 3.37Å; A149-I153 WeakPolarHBondContact O-CB 3.44Å; A149-I153 WeakPolarHBondContact O-CD1 3.2Å; A149-I153 WeakPolarHBondContact O-CG1 3.42Å; A149-I153 PolarHBondContact O-N 2.93Å
150	C	92.6	Very high	89.3	Confident	17 Å²	17	38.2 Å²	38.2	12%	0.115	21%	0.212	C	C	.	.	H	α-helix	trans	-64.9	-40	179.5	-75.5	0	0	0	0	112.5	M107 I146 A147 V148 G154	M107-C150 WeakPolarHBondContact O-CB 3.31Å; I146-C150 VanDerWaalsContact O-CB 3.32Å; I146-C150 WeakPolarHBondContact O-CB 3.36Å; I146-C150 PolarHBondContact O-N 3.05Å; I146-C150 PolarHBondContact O-SG 2.99Å; I146-C150 VanDerWaalsContact O-SG 3.35Å; A147-C150 PolarHBondContact O-N 3.35Å; V148-C150 PolarHBondContact O-N 2.97Å; C150-G154 PolarHBondContact O-N 3.45Å
151	I	88.4	Confident	88.8	Confident	4 Å²	4	38.4 Å²	38.4	2%	0.021	21%	0.213	C	C	.	.	H	α-helix	trans	-67.7	-46.1	177.3	-67.1	172.7	0	0	0	110.3	T41 A147 V148 I153 G154 L155 Y262	T41-I151 HydrophobicContact CG2-CD1 4.11Å; A147-I151 VanDerWaalsContact O-CG1 3.27Å; A147-I151 WeakPolarHBondContact O-CG1 3.32Å; A147-I151 PolarHBondContact O-N 3.34Å; V148-I151 PolarHBondContact O-N 3.32Å; I151-I153 PolarHBondContact O-N 3.42Å; I151-G154 PolarHBondContact O-N 2.83Å; I151-L155 HydrophobicContact CG2-CD1 3.93Å; I151-L155 HydrophobicContact CG2-CG 4.35Å; I151-L155 WeakPolarHBondContact O-CG 3.36Å; I151-L155 PolarHBondContact O-N 3.26Å; I151-Y262 HydrophobicContact CD1-CD2 3.85Å; I151-Y262 HydrophobicContact CD1-CE2 3.35Å
152	L	90.8	Very high	88	Confident	80 Å²	80	39 Å²	39	42%	0.419	22%	0.215	S	C	.	.	H	α-helix	trans	-59.3	-45.9	176.1	-78.6	173	0	0	0	112.6	V148 A149 G154 L155 S156 D259	V148-L152 HydrophobicContact CG1-CD1 3.79Å; V148-L152 HydrophobicContact CG1-CG 4.45Å; V148-L152 WeakPolarHBondContact O-CB 3.43Å; V148-L152 WeakPolarHBondContact O-CG 3.2Å; V148-L152 PolarHBondContact O-N 3.32Å; A149-L152 PolarHBondContact O-N 3.37Å; L152-G154 VanDerWaalsContact C-N 3.32Å; L152-G154 PolarHBondContact O-N 2.68Å; L152-L155 PolarHBondContact O-N 2.96Å; L152-S156 VanDerWaalsContact O-CB 3.26Å; L152-S156 WeakPolarHBondContact O-CB 3.4Å; L152-S156 PolarHBondContact O-N 2.75Å; L152-D259 WeakPolarHBondContact CD2-OD2 2.77Å; L152-D259 WeakPolarHBondContact CG-OD2 3.33Å
153	I	91.5	Very high	87.1	Confident	79 Å²	79	41 Å²	41	41%	0.405	22%	0.22	S	C	.	.	H	α-helix	trans	-62.1	-43.4	176.5	-68.7	163.7	0	0	0	110	M107 A149 I151 L155 S156 L157	M107-I153 HydrophobicContact CG-CG2 4.2Å; A149-I153 WeakPolarHBondContact O-CB 3.44Å; A149-I153 WeakPolarHBondContact O-CD1 3.2Å; A149-I153 WeakPolarHBondContact O-CG1 3.42Å; A149-I153 PolarHBondContact O-N 2.93Å; I151-I153 PolarHBondContact O-N 3.42Å; I153-L155 PolarHBondContact O-N 2.93Å; I153-S156 PolarHBondContact O-N 3.03Å; I153-L157 HydrophobicContact CG2-CD1 3.82Å; I153-L157 HydrophobicContact CG2-CG 4.32Å; I153-L157 WeakPolarHBondContact O-CB 3.3Å; I153-L157 VanDerWaalsContact O-CG 3.26Å; I153-L157 WeakPolarHBondContact O-CG 3.45Å; I153-L157 PolarHBondContact O-N 3.17Å
154	G	87.1	Confident	86.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.8	-45.3	176.9	0	0	0	0	0	112.8	A104 C150 I151 L152 A158	A104-G154 WeakPolarHBondContact CB-O 3.5Å; C150-G154 PolarHBondContact O-N 3.45Å; I151-G154 PolarHBondContact O-N 2.83Å; L152-G154 VanDerWaalsContact C-N 3.32Å; L152-G154 PolarHBondContact O-N 2.68Å; G154-A158 WeakPolarHBondContact O-CB 2.91Å; G154-A158 PolarHBondContact O-N 3.4Å
155	L	85.7	Confident	85.3	Confident	11 Å²	11	42.4 Å²	42.4	6%	0.058	22%	0.224	C	C	.	.	H	α-helix	trans	-68.1	-43.2	177.9	-68.4	173.8	0	0	0	112.4	I151 L152 I153 A158 E159 L255	I151-L155 HydrophobicContact CG2-CD1 3.93Å; I151-L155 HydrophobicContact CG2-CG 4.35Å; I151-L155 WeakPolarHBondContact O-CG 3.36Å; I151-L155 PolarHBondContact O-N 3.26Å; L152-L155 PolarHBondContact O-N 2.96Å; I153-L155 PolarHBondContact O-N 2.93Å; L155-A158 PolarHBondContact O-N 3.39Å; L155-E159 WeakPolarHBondContact O-CB 3.23Å; L155-E159 PolarHBondContact O-N 3.2Å; L155-L255 HydrophobicContact CD1-CB 4.03Å; L155-L255 HydrophobicContact CD2-CB 3.77Å; L155-L255 HydrophobicContact CD2-CD1 3.74Å; L155-L255 HydrophobicContact CD2-CG 4.21Å
156	S	87.9	Confident	84.1	Confident	63 Å²	63	42.3 Å²	42.3	44%	0.441	22%	0.221	S	C	.	.	H	α-helix	trans	-65.9	-39.9	179.3	177	0	0	0	0	111.9	L152 I153 E159 T160	L152-S156 VanDerWaalsContact O-CB 3.26Å; L152-S156 WeakPolarHBondContact O-CB 3.4Å; L152-S156 PolarHBondContact O-N 2.75Å; I153-S156 PolarHBondContact O-N 3.03Å; S156-E159 PolarHBondContact O-N 3.32Å; S156-T160 PolarHBondContact O-N 3.02Å; S156-T160 PolarHBondContact O-OG1 3.04Å
157	L	87.6	Confident	83	Confident	31 Å²	31	43.9 Å²	43.9	16%	0.162	23%	0.23	C	C	.	.	H	α-helix	trans	-64.1	-43.8	172.8	-74.3	171.7	0	0	0	111.3	L103 A104 I153 T160 E161	L103-L157 HydrophobicContact CB-CD1 4.25Å; L103-L157 HydrophobicContact CD2-CD1 3.7Å; L103-L157 HydrophobicContact CG-CD1 3.78Å; A104-L157 HydrophobicContact CB-CB 3.89Å; I153-L157 HydrophobicContact CG2-CD1 3.82Å; I153-L157 HydrophobicContact CG2-CG 4.32Å; I153-L157 WeakPolarHBondContact O-CB 3.3Å; I153-L157 VanDerWaalsContact O-CG 3.26Å; I153-L157 WeakPolarHBondContact O-CG 3.45Å; I153-L157 PolarHBondContact O-N 3.17Å; L157-T160 PolarHBondContact O-N 2.86Å; L157-E161 WeakPolarHBondContact O-CG 3.4Å; L157-E161 PolarHBondContact O-N 2.87Å
158	A	80.6	Confident	81.9	Confident	1 Å²	1	49 Å²	49	1%	0.008	25%	0.253	C	S	.	.	H	α-helix	trans	-61	-45.3	176	0	0	0	0	0	111.3	L73 W101 A104 G154 L155 T160 E161 I162	L73-A158 HydrophobicContact CD1-CB 4.07Å; W101-A158 HydrophobicContact CH2-CB 4.3Å; W101-A158 HydrophobicContact CZ3-CB 3.95Å; A104-A158 HydrophobicContact CB-CB 4.29Å; G154-A158 WeakPolarHBondContact O-CB 2.91Å; G154-A158 PolarHBondContact O-N 3.4Å; L155-A158 PolarHBondContact O-N 3.39Å; A158-T160 PolarHBondContact O-N 3.35Å; A158-E161 PolarHBondContact O-N 3.2Å; A158-I162 WeakPolarHBondContact O-CD1 3.04Å; A158-I162 WeakPolarHBondContact O-CG1 3.34Å; A158-I162 PolarHBondContact O-N 2.94Å
159	E	81.6	Confident	80.4	Confident	102 Å²	102	48.6 Å²	48.6	48%	0.477	25%	0.252	S	S	.	.	H	α-helix	trans	-59.8	-45.5	176.2	-177	176	-168.9	0	0	112.3	L155 S156 E161 I162 E163 F252	L155-E159 WeakPolarHBondContact O-CB 3.23Å; L155-E159 PolarHBondContact O-N 3.2Å; S156-E159 PolarHBondContact O-N 3.32Å; E159-E161 VanDerWaalsContact C-N 3.3Å; E159-E161 PolarHBondContact O-N 3.03Å; E159-I162 WeakPolarHBondContact O-CB 3.38Å; E159-I162 PolarHBondContact O-N 3.11Å; E159-I162 VanDerWaalsContact O-N 3.1Å; E159-E163 PolarHBondContact O-N 2.87Å; E159-F252 HydrophobicContact CB-CZ 4.39Å
160	T	81.5	Confident	79	Confident	46 Å²	46	49.7 Å²	49.7	28%	0.282	25%	0.251	S	S	.	.	H	α-helix	trans	-67.3	-33.3	-179.7	-41.2	0	0	0	0	112	S156 L157 A158 I162 Y164	S156-T160 PolarHBondContact O-N 3.02Å; S156-T160 PolarHBondContact O-OG1 3.04Å; L157-T160 PolarHBondContact O-N 2.86Å; A158-T160 PolarHBondContact O-N 3.35Å; T160-I162 VanDerWaalsContact C-N 3.35Å; T160-Y164 WeakPolarHBondContact O-CB 3.41Å; T160-Y164 PolarHBondContact O-N 3.22Å
161	E	78.7	Confident	77.7	Confident	4 Å²	4	53.2 Å²	53.2	2%	0.019	27%	0.268	C	S	.	.	H	α-helix	trans	-68.5	-35.6	172.6	-74.3	-56.7	124.6	0	0	112.1	R100 W101 L157 A158 E159 Y164 I165	R100-E161 VanDerWaalsContact CB-CD 3.43Å; R100-E161 HydrophobicContact CB-CG 3.69Å; R100-E161 WeakPolarHBondContact CB-OE1 3.4Å; R100-E161 WeakPolarHBondContact CD-OE1 3.44Å; R100-E161 WeakPolarHBondContact CG-OE1 3.49Å; R100-E161 IonicContact CZ-OE1 3.75Å; R100-E161 IonicContact NE-OE1 2.85Å; R100-E161 PolarHBondContact NE-OE1 3.42Å; R100-E161 IonicContact NH1-OE1 3.94Å; R100-E161 PolarHBondContact NH1-OE1 2.8Å; W101-E161 HydrophobicContact CE3-CB 3.73Å; W101-E161 HydrophobicContact CE3-CG 4.22Å; W101-E161 HydrophobicContact CZ3-CB 4.13Å; L157-E161 WeakPolarHBondContact O-CG 3.4Å; L157-E161 PolarHBondContact O-N 2.87Å; A158-E161 PolarHBondContact O-N 3.2Å; E159-E161 VanDerWaalsContact C-N 3.3Å; E159-E161 PolarHBondContact O-N 3.03Å; E161-Y164 PolarHBondContact O-N 3.37Å; E161-I165 WeakPolarHBondContact O-CB 3.43Å; E161-I165 VanDerWaalsContact O-CG1 3.28Å; E161-I165 WeakPolarHBondContact O-CG1 3.42Å; E161-I165 PolarHBondContact O-N 3.4Å
162	I	74.6	Confident	76.5	Confident	25 Å²	25	54.5 Å²	54.5	13%	0.128	27%	0.274	C	S	.	.	H	α-helix	trans	-63.8	-45.5	174.7	-65.8	164.3	0	0	0	110.4	F51 W101 A158 E159 T160 Y164 I165 H166 L245	F51-I162 HydrophobicContact CD1-CD1 3.29Å; F51-I162 HydrophobicContact CD1-CG1 3.65Å; F51-I162 HydrophobicContact CD1-CG2 4.35Å; F51-I162 HydrophobicContact CD2-CG2 4.05Å; F51-I162 HydrophobicContact CE1-CB 4.43Å; F51-I162 HydrophobicContact CE1-CD1 3.31Å; F51-I162 HydrophobicContact CE1-CG1 3.22Å; F51-I162 HydrophobicContact CE1-CG2 4.45Å; F51-I162 HydrophobicContact CE2-CG1 4.12Å; F51-I162 HydrophobicContact CE2-CG2 4.1Å; F51-I162 HydrophobicContact CG-CD1 4.11Å; F51-I162 HydrophobicContact CG-CG1 4.28Å; F51-I162 HydrophobicContact CG-CG2 4.16Å; F51-I162 HydrophobicContact CZ-CB 4.39Å; F51-I162 HydrophobicContact CZ-CD1 4.1Å; F51-I162 HydrophobicContact CZ-CG1 3.48Å; F51-I162 VanDerWaalsContact CZ-CG1 3.48Å; F51-I162 HydrophobicContact CZ-CG2 4.31Å; W101-I162 HydrophobicContact CZ3-CG1 4.19Å; A158-I162 WeakPolarHBondContact O-CD1 3.04Å; A158-I162 WeakPolarHBondContact O-CG1 3.34Å; A158-I162 PolarHBondContact O-N 2.94Å; E159-I162 WeakPolarHBondContact O-CB 3.38Å; E159-I162 PolarHBondContact O-N 3.11Å; E159-I162 VanDerWaalsContact O-N 3.1Å; T160-I162 VanDerWaalsContact C-N 3.35Å; I162-Y164 VanDerWaalsContact C-N 3.35Å; I162-I165 PolarHBondContact O-N 3.02Å; I162-H166 WeakPolarHBondContact O-CB 3.01Å; I162-H166 PolarHBondContact O-N 3.05Å; I162-L245 HydrophobicContact CG2-CD2 3.72Å
163	E	75.1	Confident	75.3	Confident	111 Å²	111	51.1 Å²	51.1	52%	0.519	26%	0.256	S	S	.	.	H	α-helix	trans	-63.9	-40.2	175.3	-171.3	175.5	-159.1	0	0	111.3	E159 I165 H166 D167	E159-E163 PolarHBondContact O-N 2.87Å; E163-I165 PolarHBondContact O-N 3.02Å; E163-H166 VanDerWaalsContact O-CB 3.31Å; E163-H166 WeakPolarHBondContact O-CB 3.29Å; E163-H166 PolarHBondContact O-N 3.47Å; E163-H166 VanDerWaalsContact O-N 3.12Å; E163-D167 PolarHBondContact O-N 3.03Å
164	Y	73.5	Confident	73.9	Confident	101 Å²	101	48 Å²	48	40%	0.396	24%	0.241	S	C	.	.	H	α-helix	trans	-63.4	-43.7	175.4	-176.3	-98.8	0	0	0	112.5	T160 E161 I162 H166 D167 H168	T160-Y164 WeakPolarHBondContact O-CB 3.41Å; T160-Y164 PolarHBondContact O-N 3.22Å; E161-Y164 PolarHBondContact O-N 3.37Å; I162-Y164 VanDerWaalsContact C-N 3.35Å; Y164-H166 VanDerWaalsContact C-N 3.25Å; Y164-H166 PolarHBondContact O-N 2.82Å; Y164-D167 PolarHBondContact O-N 3.4Å; Y164-H168 AromaticContact CD2-ND1 3.62Å; Y164-H168 HydrophobicContact CE1-CB 4.29Å; Y164-H168 HydrophobicContact CE2-CB 4.2Å; Y164-H168 AromaticContact CE2-CG 3.79Å; Y164-H168 AromaticContact CE2-ND1 3.61Å; Y164-H168 WeakPolarHBondContact O-CB 3.02Å; Y164-H168 PolarHBondContact O-N 3.06Å
165	I	71.3	Confident	72.9	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-67.3	-29	173.9	-66.5	165.7	0	0	0	110.9	I53 I96 E161 I162 E163 G169 L173	I53-I165 HydrophobicContact CD1-CG2 4.08Å; I96-I165 HydrophobicContact CD1-CD1 3.77Å; E161-I165 WeakPolarHBondContact O-CB 3.43Å; E161-I165 VanDerWaalsContact O-CG1 3.28Å; E161-I165 WeakPolarHBondContact O-CG1 3.42Å; E161-I165 PolarHBondContact O-N 3.4Å; I162-I165 PolarHBondContact O-N 3.02Å; E163-I165 PolarHBondContact O-N 3.02Å; I165-G169 WeakPolarHBondContact O-CA 3.48Å; I165-G169 PolarHBondContact O-N 2.84Å; I165-L173 HydrophobicContact CG2-CD1 4.24Å
166	H	68.2	Low	72	Confident	95 Å²	95	52 Å²	52	44%	0.44	26%	0.259	S	S	.	.	H	α-helix	trans	-67.5	-44.4	173.5	177.1	-91.2	0	0	0	111.4	I162 E163 Y164 L245	I162-H166 WeakPolarHBondContact O-CB 3.01Å; I162-H166 PolarHBondContact O-N 3.05Å; E163-H166 VanDerWaalsContact O-CB 3.31Å; E163-H166 WeakPolarHBondContact O-CB 3.29Å; E163-H166 PolarHBondContact O-N 3.47Å; E163-H166 VanDerWaalsContact O-N 3.12Å; Y164-H166 VanDerWaalsContact C-N 3.25Å; Y164-H166 PolarHBondContact O-N 2.82Å; H166-L245 HydrophobicContact CB-CD2 4.05Å
167	D	68.9	Low	71.1	Confident	100 Å²	100	49.3 Å²	49.3	54%	0.535	24%	0.239	S	C	.	.	H	α-helix	trans	-85.2	-32.2	-173.3	-68.2	-6	0	0	0	113.4	E163 Y164	E163-D167 PolarHBondContact O-N 3.03Å; Y164-D167 PolarHBondContact O-N 3.4Å
168	H	68.3	Low	70.3	Confident	107 Å²	107	49.8 Å²	49.8	50%	0.495	24%	0.242	S	C	.	.	H	α-helix	trans	-121.6	12.6	-174.9	-56.4	77.8	0	0	0	112.6	Y164 D170	Y164-H168 AromaticContact CD2-ND1 3.62Å; Y164-H168 HydrophobicContact CE1-CB 4.29Å; Y164-H168 HydrophobicContact CE2-CB 4.2Å; Y164-H168 AromaticContact CE2-CG 3.79Å; Y164-H168 AromaticContact CE2-ND1 3.61Å; Y164-H168 WeakPolarHBondContact O-CB 3.02Å; Y164-H168 PolarHBondContact O-N 3.06Å; H168-D170 PolarHBondContact O-N 2.74Å; H168-D170 VanDerWaalsContact O-N 3.08Å
169	G	62.4	Low	69.6	Low	2 Å²	2	52.1 Å²	52.1	2%	0.021	26%	0.258	C	S	.	.	H	α-helix	trans	-58.3	-26.3	-170.3	0	0	0	0	0	115.1	I165 M171 I172 L173	I165-G169 WeakPolarHBondContact O-CA 3.48Å; I165-G169 PolarHBondContact O-N 2.84Å; G169-M171 VanDerWaalsContact C-N 3.3Å; G169-M171 PolarHBondContact O-N 3.3Å; G169-M171 VanDerWaalsContact O-N 3.15Å; G169-I172 PolarHBondContact O-N 3.08Å; G169-L173 VanDerWaalsContact C-CD1 3.45Å; G169-L173 WeakPolarHBondContact O-CB 3.11Å; G169-L173 WeakPolarHBondContact O-CD1 3.44Å; G169-L173 PolarHBondContact O-N 3.27Å
170	D	63.4	Low	68.7	Low	63 Å²	63	49 Å²	49	34%	0.337	25%	0.245	S	C	.	.	H	α-helix	trans	-46	-52.5	-174.6	-85.3	7.5	0	0	0	111.9	H168 I172 T174 L235 G236	H168-D170 PolarHBondContact O-N 2.74Å; H168-D170 VanDerWaalsContact O-N 3.08Å; D170-I172 PolarHBondContact O-N 3.45Å; D170-T174 WeakPolarHBondContact O-CB 3.2Å; D170-T174 PolarHBondContact O-N 2.88Å; D170-T174 PolarHBondContact O-OG1 3.4Å; D170-L235 HydrophobicContact CB-CB 4.08Å; D170-G236 PolarHBondContact OD2-N 3.03Å
171	M	63.4	Low	67.8	Low	92 Å²	92	49.4 Å²	49.4	45%	0.453	26%	0.258	S	S	.	.	H	α-helix	trans	-66	-41.8	-177.4	-175.7	177.2	58.8	0	0	113.5	G169 T174 K175	G169-M171 VanDerWaalsContact C-N 3.3Å; G169-M171 PolarHBondContact O-N 3.3Å; G169-M171 VanDerWaalsContact O-N 3.15Å; M171-T174 WeakPolarHBondContact O-CB 3.35Å; M171-T174 PolarHBondContact O-N 3.23Å; M171-K175 WeakPolarHBondContact O-CG 3.48Å; M171-K175 PolarHBondContact O-N 2.56Å
172	I	63.3	Low	67.1	Low	31 Å²	31	49.5 Å²	49.5	16%	0.159	26%	0.259	C	S	.	.	H	α-helix	trans	-71.1	-41.5	-177.9	-66.2	174	0	0	0	110.1	L94 G169 D170 K175 V176	L94-I172 HydrophobicContact CD1-CG2 3.38Å; G169-I172 PolarHBondContact O-N 3.08Å; D170-I172 PolarHBondContact O-N 3.45Å; I172-K175 WeakPolarHBondContact O-CB 3.42Å; I172-K175 PolarHBondContact O-N 3.4Å; I172-V176 PolarHBondContact O-N 3.43Å
173	L	66	Low	66.6	Low	8 Å²	8	49.1 Å²	49.1	4%	0.042	26%	0.257	C	S	.	.	H	α-helix	trans	-70	-33.9	176.6	-75.4	127.3	0	0	0	111.7	I53 I55 I69 I165 G169 K175 V176 L177 L243	I53-L173 HydrophobicContact CG2-CD2 4.17Å; I55-L173 HydrophobicContact CD1-CD2 3.19Å; I55-L173 HydrophobicContact CD1-CG 4.46Å; I55-L173 HydrophobicContact CG1-CD2 3.71Å; I69-L173 HydrophobicContact CD1-CD2 3.99Å; I165-L173 HydrophobicContact CG2-CD1 4.24Å; G169-L173 VanDerWaalsContact C-CD1 3.45Å; G169-L173 WeakPolarHBondContact O-CB 3.11Å; G169-L173 WeakPolarHBondContact O-CD1 3.44Å; G169-L173 PolarHBondContact O-N 3.27Å; L173-K175 VanDerWaalsContact C-N 3.29Å; L173-K175 PolarHBondContact O-N 2.91Å; L173-V176 PolarHBondContact O-N 3.3Å; L173-L177 WeakPolarHBondContact O-CB 3.29Å; L173-L177 WeakPolarHBondContact O-CG 3.35Å; L173-L177 PolarHBondContact O-N 3.41Å; L173-L243 HydrophobicContact CD1-CD1 3.29Å; L173-L243 HydrophobicContact CD2-CD1 4.08Å; L173-L243 HydrophobicContact CG-CD1 4.25Å
174	T	63.5	Low	65.7	Low	14 Å²	14	50.3 Å²	50.3	9%	0.086	26%	0.262	C	S	.	.	H	α-helix	trans	-57.2	-45.8	170.2	-40.8	0	0	0	0	110.9	D170 M171 V176 L177 L178 I183 Y189 L235	D170-T174 WeakPolarHBondContact O-CB 3.2Å; D170-T174 PolarHBondContact O-N 2.88Å; D170-T174 PolarHBondContact O-OG1 3.4Å; M171-T174 WeakPolarHBondContact O-CB 3.35Å; M171-T174 PolarHBondContact O-N 3.23Å; T174-V176 VanDerWaalsContact C-N 3.31Å; T174-V176 PolarHBondContact O-N 3.48Å; T174-L177 PolarHBondContact O-N 2.94Å; T174-L178 HydrophobicContact CG2-CD1 3.75Å; T174-L178 HydrophobicContact CG2-CG 4.14Å; T174-L178 VanDerWaalsContact O-CB 3.3Å; T174-L178 WeakPolarHBondContact O-CB 3.36Å; T174-L178 WeakPolarHBondContact O-CG 3.29Å; T174-L178 PolarHBondContact O-N 3.07Å; T174-I183 HydrophobicContact CG2-CD1 4.23Å; T174-Y189 HydrophobicContact CG2-CD1 4.45Å; T174-Y189 HydrophobicContact CG2-CE1 4.44Å; T174-L235 HydrophobicContact CG2-CD1 3.55Å; T174-L235 WeakPolarHBondContact OG1-CD1 3.28Å
175	K	66.2	Low	64.7	Low	87 Å²	87	50.3 Å²	50.3	38%	0.378	27%	0.273	S	S	.	.	H	α-helix	trans	-60.1	-43.4	-179.4	-73.5	176.4	-178.2	178.7	0	110.6	M171 I172 L173 S179 F193	M171-K175 WeakPolarHBondContact O-CG 3.48Å; M171-K175 PolarHBondContact O-N 2.56Å; I172-K175 WeakPolarHBondContact O-CB 3.42Å; I172-K175 PolarHBondContact O-N 3.4Å; L173-K175 VanDerWaalsContact C-N 3.29Å; L173-K175 PolarHBondContact O-N 2.91Å; K175-S179 WeakPolarHBondContact O-CB 3.43Å; K175-S179 PolarHBondContact O-N 2.73Å; K175-S179 PolarHBondContact O-OG 3.26Å; K175-F193 HydrophobicContact CD-CE2 4.33Å; K175-F193 HydrophobicContact CG-CE2 4.32Å
176	V	66.5	Low	63.5	Low	9 Å²	9	55.5 Å²	55.5	6%	0.055	30%	0.301	C	S	.	.	H	α-helix	trans	-65.6	-42.5	176.6	176.7	0	0	0	0	112.1	L94 I172 L173 T174 S179 N180	L94-V176 HydrophobicContact CB-CG2 3.92Å; L94-V176 HydrophobicContact CD1-CG2 3.28Å; L94-V176 HydrophobicContact CG-CG2 4.16Å; I172-V176 PolarHBondContact O-N 3.43Å; L173-V176 PolarHBondContact O-N 3.3Å; T174-V176 VanDerWaalsContact C-N 3.31Å; T174-V176 PolarHBondContact O-N 3.48Å; V176-S179 PolarHBondContact O-N 3.32Å; V176-S179 PolarHBondContact O-OG 2.82Å; V176-S179 VanDerWaalsContact O-OG 3.06Å; V176-N180 WeakPolarHBondContact O-CB 3.25Å; V176-N180 PolarHBondContact O-N 2.92Å; V176-N180 VanDerWaalsContact O-N 3.09Å; V176-N180 PolarHBondContact O-ND2 2.88Å
177	L	68.5	Low	62.3	Low	6 Å²	6	57.1 Å²	57.1	3%	0.031	31%	0.312	C	S	.	.	H	α-helix	trans	-69.2	-38.7	179.6	-69.6	174.7	0	0	0	111.8	I55 F64 V67 L173 T174 G181 L182 I183 F241	I55-L177 HydrophobicContact CD1-CD1 4.46Å; I55-L177 HydrophobicContact CD1-CD2 4.32Å; I55-L177 HydrophobicContact CD1-CG 4.47Å; I55-L177 HydrophobicContact CG2-CD1 4.44Å; F64-L177 HydrophobicContact CE1-CD2 4.49Å; F64-L177 HydrophobicContact CZ-CD2 4.07Å; V67-L177 HydrophobicContact CG2-CD2 3.94Å; L173-L177 WeakPolarHBondContact O-CB 3.29Å; L173-L177 WeakPolarHBondContact O-CG 3.35Å; L173-L177 PolarHBondContact O-N 3.41Å; T174-L177 PolarHBondContact O-N 2.94Å; L177-G181 PolarHBondContact O-N 2.99Å; L177-L182 HydrophobicContact CB-CB 4.4Å; L177-L182 HydrophobicContact CD2-CB 4.05Å; L177-L182 HydrophobicContact CD2-CD1 3.69Å; L177-L182 WeakPolarHBondContact O-CA 3.44Å; L177-L182 WeakPolarHBondContact O-CB 3.34Å; L177-L182 PolarHBondContact O-N 3.12Å; L177-I183 HydrophobicContact CB-CD1 3.43Å; L177-I183 VanDerWaalsContact CB-CD1 3.43Å; L177-I183 HydrophobicContact CB-CG1 3.8Å; L177-I183 HydrophobicContact CD1-CD1 3.81Å; L177-I183 HydrophobicContact CD1-CG1 4.48Å; L177-I183 HydrophobicContact CG-CD1 4.28Å; L177-I183 PolarHBondContact O-N 3.49Å; L177-F241 HydrophobicContact CD1-CD1 4.3Å; L177-F241 HydrophobicContact CD1-CE1 4.1Å; L177-F241 HydrophobicContact CD1-CZ 4.27Å
178	L	69.9	Low	61.2	Low	40 Å²	40	59.9 Å²	59.9	21%	0.209	32%	0.322	C	S	.	.	H	α-helix	trans	-65.3	-45.4	172.8	-78	169.5	0	0	0	111.3	T174 N180 G181 I183 T185	T174-L178 HydrophobicContact CG2-CD1 3.75Å; T174-L178 HydrophobicContact CG2-CG 4.14Å; T174-L178 VanDerWaalsContact O-CB 3.3Å; T174-L178 WeakPolarHBondContact O-CB 3.36Å; T174-L178 WeakPolarHBondContact O-CG 3.29Å; T174-L178 PolarHBondContact O-N 3.07Å; L178-N180 VanDerWaalsContact C-N 3.26Å; L178-N180 PolarHBondContact O-N 3.4Å; L178-G181 PolarHBondContact O-N 2.89Å; L178-I183 HydrophobicContact CD2-CB 3.83Å; L178-I183 HydrophobicContact CD2-CG2 3.65Å; L178-I183 HydrophobicContact CG-CB 4.23Å; L178-I183 HydrophobicContact CG-CG2 4.32Å; L178-T185 HydrophobicContact CD2-CG2 4.37Å
179	S	65.8	Low	60.2	Low	50 Å²	50	58.7 Å²	58.7	35%	0.35	31%	0.314	S	S	.	.	H	α-helix	trans	-66.7	-30.5	-176.1	77.8	0	0	0	0	112.5	Q92 K175 V176 G181	Q92-S179 VanDerWaalsContact OE1-CB 3.23Å; Q92-S179 PolarHBondContact OE1-OG 3.45Å; K175-S179 WeakPolarHBondContact O-CB 3.43Å; K175-S179 PolarHBondContact O-N 2.73Å; K175-S179 PolarHBondContact O-OG 3.26Å; V176-S179 PolarHBondContact O-N 3.32Å; V176-S179 PolarHBondContact O-OG 2.82Å; V176-S179 VanDerWaalsContact O-OG 3.06Å; S179-G181 VanDerWaalsContact C-N 3.34Å
180	N	63.9	Low	59.3	Low	37 Å²	37	60.4 Å²	60.4	20%	0.198	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	11	174.9	-68.3	-82.5	0	0	0	113.3	L90 Q92 V176 L178 L182	L90-N180 WeakPolarHBondContact CB-OD1 3.28Å; L90-N180 HydrophobicContact CD2-CB 3.54Å; L90-N180 HydrophobicContact CG-CB 3.9Å; L90-N180 VanDerWaalsContact CG-CG 3.49Å; L90-N180 VanDerWaalsContact CG-OD1 3.22Å; L90-N180 WeakPolarHBondContact CG-OD1 3.11Å; Q92-N180 PolarHBondContact N-OD1 2.91Å; Q92-N180 PolarHBondContact O-ND2 3.35Å; V176-N180 WeakPolarHBondContact O-CB 3.25Å; V176-N180 PolarHBondContact O-N 2.92Å; V176-N180 VanDerWaalsContact O-N 3.09Å; V176-N180 PolarHBondContact O-ND2 2.88Å; L178-N180 VanDerWaalsContact C-N 3.26Å; L178-N180 PolarHBondContact O-N 3.4Å; N180-L182 HydrophobicContact CB-CD1 4.24Å; N180-L182 HydrophobicContact CB-CG 4.38Å; N180-L182 PolarHBondContact O-N 2.93Å
181	G	63.1	Low	58.2	Low	55 Å²	55	62.4 Å²	62.4	57%	0.567	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	15.1	175.7	0	0	0	0	0	115.2	L177 L178 S179 I183	L177-G181 PolarHBondContact O-N 2.99Å; L178-G181 PolarHBondContact O-N 2.89Å; S179-G181 VanDerWaalsContact C-N 3.34Å; G181-I183 VanDerWaalsContact C-N 3.32Å
182	L	63.3	Low	57.5	Low	6 Å²	6	64 Å²	64	3%	0.031	34%	0.342	C	S	.	.	S	Bend	trans	-81.5	-15.3	-179.6	-63.8	168.4	0	0	0	112.5	R59 F64 V67 V80 W82 L90 L177 N180	R59-L182 PolarHBondContact NH2-O 3.25Å; F64-L182 HydrophobicContact CD1-CB 4.46Å; F64-L182 HydrophobicContact CD1-CD2 3.83Å; F64-L182 HydrophobicContact CE1-CB 4.02Å; F64-L182 HydrophobicContact CE1-CD1 4.42Å; F64-L182 HydrophobicContact CE1-CD2 4.23Å; F64-L182 HydrophobicContact CE1-CG 4.46Å; V67-L182 HydrophobicContact CG2-CD1 4.34Å; V80-L182 HydrophobicContact CG2-CD1 3.98Å; W82-L182 HydrophobicContact CH2-CD2 3.83Å; W82-L182 HydrophobicContact CZ3-CD2 4.1Å; L90-L182 HydrophobicContact CD2-CD1 4.06Å; L177-L182 HydrophobicContact CB-CB 4.4Å; L177-L182 HydrophobicContact CD2-CB 4.05Å; L177-L182 HydrophobicContact CD2-CD1 3.69Å; L177-L182 WeakPolarHBondContact O-CA 3.44Å; L177-L182 WeakPolarHBondContact O-CB 3.34Å; L177-L182 PolarHBondContact O-N 3.12Å; N180-L182 HydrophobicContact CB-CD1 4.24Å; N180-L182 HydrophobicContact CB-CG 4.38Å; N180-L182 PolarHBondContact O-N 2.93Å
183	I	63.3	Low	56.6	Low	16 Å²	16	67.8 Å²	67.8	8%	0.082	36%	0.358	C	S	.	.	S	Bend	trans	-118.2	130.9	169.9	-66	172.1	0	0	0	108	T174 L177 L178 G181 F241	T174-I183 HydrophobicContact CG2-CD1 4.23Å; L177-I183 HydrophobicContact CB-CD1 3.43Å; L177-I183 VanDerWaalsContact CB-CD1 3.43Å; L177-I183 HydrophobicContact CB-CG1 3.8Å; L177-I183 HydrophobicContact CD1-CD1 3.81Å; L177-I183 HydrophobicContact CD1-CG1 4.48Å; L177-I183 HydrophobicContact CG-CD1 4.28Å; L177-I183 PolarHBondContact O-N 3.49Å; L178-I183 HydrophobicContact CD2-CB 3.83Å; L178-I183 HydrophobicContact CD2-CG2 3.65Å; L178-I183 HydrophobicContact CG-CB 4.23Å; L178-I183 HydrophobicContact CG-CG2 4.32Å; G181-I183 VanDerWaalsContact C-N 3.32Å; I183-F241 HydrophobicContact CD1-CE2 3.93Å; I183-F241 HydrophobicContact CD1-CZ 3.84Å; I183-F241 HydrophobicContact CG1-CE2 4.25Å; I183-F241 HydrophobicContact CG1-CZ 3.74Å
184	E	57.3	Low	55.4	Low	137 Å²	137	75.1 Å²	75.1	64%	0.64	39%	0.386	S	S	*	.			trans	-69.3	132.6	172.4	-86.6	165.1	-144.9	0	0	109.6	K63 N186	K63-E184 IonicContact NZ-OE1 2.72Å; K63-E184 PolarHBondContact NZ-OE1 3.38Å; E184-N186 PolarHBondContact O-N 3.32Å
185	T	51.2	Low	54.5	Low	100 Å²	100	79.8 Å²	79.8	61%	0.613	41%	0.41	S	S	*	.			trans	-65.5	80.4	173.8	52.5	0	0	0	0	109.7	L178 N187	L178-T185 HydrophobicContact CD2-CG2 4.37Å; T185-N187 PolarHBondContact O-N 3.02Å
186	N	47.2	Very low	53.4	Low	110 Å²	110	80.7 Å²	80.7	59%	0.588	42%	0.419	S	S	*	.			trans	-63.4	127.3	159.2	-101.4	-21.7	0	0	0	106.3	E184 Q188 Y189	E184-N186 PolarHBondContact O-N 3.32Å; N186-Q188 PolarHBondContact O-N 3.37Å; N186-Y189 HydrophobicContact CB-CD2 4.32Å; N186-Y189 PolarHBondContact O-N 3.1Å
187	N	42.8	Very low	52.3	Low	129 Å²	129	83.7 Å²	83.7	69%	0.69	44%	0.44	S	S	*	.	H	α-helix	trans	-51.6	-8	-173.8	-79.6	-23.3	0	0	0	115.4	T185 S190 N191	T185-N187 PolarHBondContact O-N 3.02Å; N187-S190 WeakPolarHBondContact CA-OG 3.49Å; N187-S190 PolarHBondContact O-OG 3.5Å; N187-N191 PolarHBondContact O-ND2 2.84Å
188	Q	46.4	Very low	51.1	Low	158 Å²	158	86 Å²	86	74%	0.738	46%	0.455	S	S	*	.	H	α-helix	trans	-76.4	-36	171.3	-71.4	179.7	-47.4	0	0	113.2	N186 Q192	N186-Q188 PolarHBondContact O-N 3.37Å; Q188-Q192 PolarHBondContact O-N 3.43Å
189	Y	47.5	Very low	49.8	Very low	83 Å²	83	88.7 Å²	88.7	33%	0.325	47%	0.473	S	S	.	.	H	α-helix	trans	-75.6	-35.8	-179.8	-71.9	-76.1	0	0	0	112.8	T174 N186 N191 F193 L235	T174-Y189 HydrophobicContact CG2-CD1 4.45Å; T174-Y189 HydrophobicContact CG2-CE1 4.44Å; N186-Y189 HydrophobicContact CB-CD2 4.32Å; N186-Y189 PolarHBondContact O-N 3.1Å; Y189-N191 VanDerWaalsContact C-N 3.34Å; Y189-N191 PolarHBondContact O-N 3.3Å; Y189-F193 WeakPolarHBondContact O-CB 3.37Å; Y189-F193 PolarHBondContact O-N 3Å; Y189-L235 HydrophobicContact CE1-CD1 4.45Å
190	S	43.6	Very low	48.4	Very low	37 Å²	37	89.8 Å²	89.8	26%	0.259	49%	0.492	S	S	.	.	H	α-helix	trans	-66.8	-34.7	178.1	47.3	0	0	0	0	112.6	N187 Y194	N187-S190 WeakPolarHBondContact CA-OG 3.49Å; N187-S190 PolarHBondContact O-OG 3.5Å; S190-Y194 PolarHBondContact O-N 3.18Å
191	N	39.9	Very low	47.2	Very low	105 Å²	105	92.4 Å²	92.4	56%	0.561	51%	0.513	S	S	*	.	H	α-helix	trans	-75.8	-35	-179.3	-75.5	-15.7	0	0	0	113.1	N187 Y189 F193 L195	N187-N191 PolarHBondContact O-ND2 2.84Å; Y189-N191 VanDerWaalsContact C-N 3.34Å; Y189-N191 PolarHBondContact O-N 3.3Å; N191-F193 VanDerWaalsContact C-N 3.34Å; N191-L195 WeakPolarHBondContact O-CB 3.41Å; N191-L195 WeakPolarHBondContact O-CG 3.27Å; N191-L195 PolarHBondContact O-N 2.88Å; N191-L195 VanDerWaalsContact O-N 3.09Å
192	Q	47.3	Very low	45.8	Very low	125 Å²	125	95.4 Å²	95.4	58%	0.584	52%	0.515	S	S	*	.	H	α-helix	trans	-68.7	-37.3	172.8	-149.2	110	5.3	0	0	111	Q188 L195 D196	Q188-Q192 PolarHBondContact O-N 3.43Å; Q192-L195 PolarHBondContact O-N 2.69Å; Q192-D196 PolarHBondContact O-N 3.38Å
193	F	44.3	Very low	44.3	Very low	111 Å²	111	102.5 Å²	102.5	49%	0.487	55%	0.553	S	S	.	*	H	α-helix	trans	-67.6	-39.1	178.9	-176.6	-100.2	0	0	0	113.1	K175 Y189 N191 S197	K175-F193 HydrophobicContact CD-CE2 4.33Å; K175-F193 HydrophobicContact CG-CE2 4.32Å; Y189-F193 WeakPolarHBondContact O-CB 3.37Å; Y189-F193 PolarHBondContact O-N 3Å; N191-F193 VanDerWaalsContact C-N 3.34Å; F193-S197 PolarHBondContact O-N 3.38Å; F193-S197 PolarHBondContact O-OG 2.97Å
194	Y	42.6	Very low	43	Very low	163 Å²	163	108.8 Å²	108.8	64%	0.639	59%	0.587	S	S	*	*	H	α-helix	trans	-70.5	-35.8	171.9	-100.1	-91	0	0	0	111.9	S190 S197 T198	S190-Y194 PolarHBondContact O-N 3.18Å; Y194-S197 PolarHBondContact O-OG 3.07Å; Y194-T198 VanDerWaalsContact O-CB 3.25Å; Y194-T198 WeakPolarHBondContact O-CB 3.35Å; Y194-T198 PolarHBondContact O-N 3.31Å; Y194-T198 PolarHBondContact O-OG1 3.18Å
195	L	43.1	Very low	41.9	Very low	111 Å²	111	111.3 Å²	111.3	58%	0.581	60%	0.598	S	S	*	*	H	α-helix	trans	-68.2	-39.8	178.1	-77.5	169.7	0	0	0	112.5	N191 Q192 T198 V199	N191-L195 WeakPolarHBondContact O-CB 3.41Å; N191-L195 WeakPolarHBondContact O-CG 3.27Å; N191-L195 PolarHBondContact O-N 2.88Å; N191-L195 VanDerWaalsContact O-N 3.09Å; Q192-L195 PolarHBondContact O-N 2.69Å; L195-T198 PolarHBondContact O-N 3.09Å; L195-V199 HydrophobicContact CD2-CG2 4.36Å; L195-V199 WeakPolarHBondContact O-CB 3.46Å; L195-V199 WeakPolarHBondContact O-CG2 3.22Å; L195-V199 PolarHBondContact O-N 3.26Å
196	D	44.1	Very low	41.1	Very low	106 Å²	106	109.5 Å²	109.5	57%	0.567	60%	0.599	S	S	*	*	H	α-helix	trans	-72.3	-33.8	-178.5	-157.6	31.4	0	0	0	112.9	Q192 G200	Q192-D196 PolarHBondContact O-N 3.38Å; D196-G200 PolarHBondContact O-N 3.46Å
197	S	43.8	Very low	40.6	Very low	72 Å²	72	110.2 Å²	110.2	50%	0.503	61%	0.608	S	S	.	*	H	α-helix	trans	-78.2	-22.3	175.6	47.5	0	0	0	0	113.9	F193 Y194	F193-S197 PolarHBondContact O-N 3.38Å; F193-S197 PolarHBondContact O-OG 2.97Å; Y194-S197 PolarHBondContact O-OG 3.07Å
198	T	41.6	Very low	40.3	Very low	56 Å²	56	111.8 Å²	111.8	34%	0.344	62%	0.617	S	S	.	*	H	α-helix	trans	-96.7	-29.6	178.4	-37.3	0	0	0	0	112.4	Y194 L195 S201 L202	Y194-T198 VanDerWaalsContact O-CB 3.25Å; Y194-T198 WeakPolarHBondContact O-CB 3.35Å; Y194-T198 PolarHBondContact O-N 3.31Å; Y194-T198 PolarHBondContact O-OG1 3.18Å; L195-T198 PolarHBondContact O-N 3.09Å; T198-S201 PolarHBondContact O-N 2.7Å; T198-L202 HydrophobicContact CG2-CD1 3.62Å; T198-L202 HydrophobicContact CG2-CG 4.38Å; T198-L202 WeakPolarHBondContact O-CB 3.33Å; T198-L202 WeakPolarHBondContact O-CG 3.45Å; T198-L202 PolarHBondContact O-N 2.78Å
199	V	43.9	Very low	39.7	Very low	96 Å²	96	108.1 Å²	108.1	58%	0.582	62%	0.621	S	S	*	*	H	α-helix	trans	-80	-21.8	177.9	178.9	0	0	0	0	111.7	L195 S201	L195-V199 HydrophobicContact CD2-CG2 4.36Å; L195-V199 WeakPolarHBondContact O-CB 3.46Å; L195-V199 WeakPolarHBondContact O-CG2 3.22Å; L195-V199 PolarHBondContact O-N 3.26Å; V199-S201 VanDerWaalsContact C-N 3.32Å; V199-S201 PolarHBondContact O-N 3.36Å
200	G	36.7	Very low	39.1	Very low	73 Å²	73	112.4 Å²	112.4	75%	0.753	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-9.3	170.8	0	0	0	0	0	115.7	D196	D196-G200 PolarHBondContact O-N 3.46Å
201	S	37.3	Very low	38.7	Very low	92 Å²	92	116 Å²	116	64%	0.643	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.9	-2.8	179.6	82.7	0	0	0	0	115.8	T198 V199	T198-S201 PolarHBondContact O-N 2.7Å; V199-S201 VanDerWaalsContact C-N 3.32Å; V199-S201 PolarHBondContact O-N 3.36Å
202	L	34.9	Very low	38.5	Very low	117 Å²	117	116.2 Å²	116.2	61%	0.613	68%	0.683	S	S	*	*			trans	-115.1	75.2	179.4	-68.4	176.7	0	0	0	111.6	T198	T198-L202 HydrophobicContact CG2-CD1 3.62Å; T198-L202 HydrophobicContact CG2-CG 4.38Å; T198-L202 WeakPolarHBondContact O-CB 3.33Å; T198-L202 WeakPolarHBondContact O-CG 3.45Å; T198-L202 PolarHBondContact O-N 2.78Å
203	N	31.8	Very low	38	Very low	155 Å²	155	121.8 Å²	121.8	83%	0.829	70%	0.699	S	S	*	*			trans	-151.4	57.6	158.5	-98.2	-25	0	0	0	109.5
204	L	36.1	Very low	37.4	Very low	149 Å²	149	121.9 Å²	121.9	78%	0.78	71%	0.713	S	S	*	*	S	Bend	trans	-150.2	125.5	163	-128.2	82.7	0	0	0	107.2
205	E	34.2	Very low	37.1	Very low	189 Å²	189	121.1 Å²	121.1	88%	0.883	73%	0.726	S	S	*	*			trans	70.1	127.2	177.2	-68.4	157.2	102.5	0	0	115.4
206	G	34.1	Very low	36.6	Very low	62 Å²	62	120.9 Å²	120.9	64%	0.639	73%	0.733	S	S	*	*			cis	134.9	105.8	24.5	0	0	0	0	0	107.9
207	T	36.5	Very low	36.3	Very low	125 Å²	125	121 Å²	121	77%	0.767	74%	0.743	S	S	*	*			trans	62.6	118.9	148.3	49.5	0	0	0	0	121.5
208	N	36.1	Very low	35.9	Very low	163 Å²	163	122 Å²	122	87%	0.872	75%	0.75	S	S	*	*			trans	70.9	113.5	134.3	-58.6	-13.7	0	0	0	120.1
209	G	34.5	Very low	35.7	Very low	80 Å²	80	127 Å²	127	83%	0.825	77%	0.773	S	S	*	*			trans	173.7	74.7	164	0	0	0	0	0	115.9
210	L	33.8	Very low	35.2	Very low	173 Å²	173	126.9 Å²	126.9	91%	0.906	78%	0.776	S	S	*	*			trans	-60	134.4	171.9	-165.3	78.9	0	0	0	112.3
211	S	36.9	Very low	35	Very low	114 Å²	114	127.9 Å²	127.9	80%	0.797	77%	0.772	S	S	*	*			trans	-177.3	105.7	148	-77.8	0	0	0	0	114.2
212	S	35.6	Very low	35.1	Very low	108 Å²	108	130.9 Å²	130.9	76%	0.755	78%	0.779	S	S	*	*			trans	5.2	138.6	145.3	57.7	0	0	0	0	120.9
213	R	35.3	Very low	35	Very low	243 Å²	243	130.2 Å²	130.2	92%	0.917	78%	0.784	S	S	*	*				170.8	130	98.8	-176.2	149.8	151.3	178.8	-9.8	113.1
214	S	31.7	Very low	35.1	Very low	112 Å²	112	128.1 Å²	128.1	78%	0.783	78%	0.781	S	S	*	*			trans	-70.6	144.4	-173.1	-28.7	0	0	0	0	114.4
215	T	36.8	Very low	35	Very low	148 Å²	148	126 Å²	126	91%	0.908	78%	0.779	S	S	*	*			trans	-148.7	138.3	141.2	-19.7	0	0	0	0	111.2
216	S	33	Very low	34.9	Very low	105 Å²	105	121.9 Å²	121.9	73%	0.734	77%	0.771	S	S	*	*			trans	-88	141.6	-163.4	46.6	0	0	0	0	115.4
217	S	37.4	Very low	34.8	Very low	110 Å²	110	124 Å²	124	77%	0.769	78%	0.776	S	S	*	*			trans	168.3	148.4	135	47.8	0	0	0	0	108
218	S	35.3	Very low	34.6	Very low	92 Å²	92	123 Å²	123	64%	0.643	77%	0.774	S	S	*	*			cis	-179.3	132.9	-13	-80.8	0	0	0	0	103
219	I	37.9	Very low	34.4	Very low	162 Å²	162	119.7 Å²	119.7	83%	0.831	76%	0.764	S	S	*	*			trans	72.1	128.1	150.4	-54	159.5	0	0	0	114.5
220	S	33.6	Very low	34.5	Very low	93 Å²	93	122 Å²	122	65%	0.65	76%	0.762	S	S	*	*			cis	-172.2	133.1	6.2	43.2	0	0	0	0	108.7
221	S	33.1	Very low	34.6	Very low	94 Å²	94	119 Å²	119	66%	0.657	75%	0.747	S	S	*	*			trans	40	115.8	133.4	74.9	0	0	0	0	119.5
222	I	38.6	Very low	34.8	Very low	155 Å²	155	118.7 Å²	118.7	80%	0.795	74%	0.736	S	S	*	*				141.1	132.4	110.7	-75.6	150	0	0	0	103.9
223	S	33.6	Very low	35.1	Very low	103 Å²	103	119.5 Å²	119.5	72%	0.72	73%	0.732	S	S	*	*			cis	-163	149.5	6.9	32.3	0	0	0	0	108.5
224	S	32	Very low	35.6	Very low	111 Å²	111	116.1 Å²	116.1	78%	0.776	72%	0.719	S	S	*	*			trans	-45.3	137.4	166	49.5	0	0	0	0	117
225	S	35.4	Very low	36.6	Very low	105 Å²	105	111.8 Å²	111.8	73%	0.734	69%	0.687	S	S	*	*			trans	173.5	96.2	133.9	52	0	0	0	0	107.6
226	S	32.5	Very low	36.9	Very low	101 Å²	101	107.4 Å²	107.4	71%	0.706	67%	0.672	S	S	*	*				70.1	122.7	91.2	67.7	0	0	0	0	114.1
227	S	30.6	Very low	37.3	Very low	106 Å²	106	109.1 Å²	109.1	74%	0.741	67%	0.672	S	S	*	*			trans	65.5	113.1	153	63.4	0	0	0	0	118.5
228	S	32	Very low	37.7	Very low	104 Å²	104	107.4 Å²	107.4	73%	0.727	66%	0.657	S	S	*	*				137.3	131.6	108.9	67.6	0	0	0	0	112.4
229	S	33.1	Very low	38.6	Very low	94 Å²	94	105.6 Å²	105.6	66%	0.657	65%	0.653	S	S	*	*			trans	59.8	115.9	161.2	49.3	0	0	0	0	117.8	D231	S229-D231 PolarHBondContact O-N 3.49Å
230	T	36	Very low	39.5	Very low	128 Å²	128	101.5 Å²	101.5	79%	0.785	63%	0.63	S	S	*	*			trans	-52.1	95.3	166.2	43.2	0	0	0	0	112.2	N232	T230-N232 PolarHBondContact O-N 3.39Å; T230-N232 VanDerWaalsContact O-N 3.12Å
231	D	35.8	Very low	40.8	Very low	112 Å²	112	98.7 Å²	98.7	60%	0.599	61%	0.606	S	S	*	*			trans	-72.3	87.1	166.3	-75.2	-22.2	0	0	0	110	S229 D233	S229-D231 PolarHBondContact O-N 3.49Å; D231-D233 VanDerWaalsContact C-N 3.31Å
232	N	42.3	Very low	42.2	Very low	107 Å²	107	95.2 Å²	95.2	57%	0.572	58%	0.583	S	S	*	*			trans	-90	10	169.2	-75.2	-19.4	0	0	0	112.8	T230	T230-N232 PolarHBondContact O-N 3.39Å; T230-N232 VanDerWaalsContact O-N 3.12Å
233	D	42.1	Very low	43.4	Very low	124 Å²	124	90.4 Å²	90.4	66%	0.663	56%	0.559	S	S	*	*			trans	-97.6	24.5	-174	-74.5	-13.2	0	0	0	115	D231 L235	D231-D233 VanDerWaalsContact C-N 3.31Å; D233-L235 PolarHBondContact O-N 3.5Å
234	R	45.6	Very low	44.9	Very low	173 Å²	173	91.9 Å²	91.9	65%	0.653	55%	0.549	S	S	*	.			trans	-85.9	-0.1	-164.4	-71.8	-172.5	76.8	130.6	-0.7	117.7
235	L	51.1	Low	46.4	Very low	21 Å²	21	88.7 Å²	88.7	11%	0.11	52%	0.523	C	S	.	.	S	Bend	trans	-92.3	-26.5	177	-91.7	151.8	0	0	0	114.5	D170 T174 Y189 D233 L237 F241	D170-L235 HydrophobicContact CB-CB 4.08Å; T174-L235 HydrophobicContact CG2-CD1 3.55Å; T174-L235 WeakPolarHBondContact OG1-CD1 3.28Å; Y189-L235 HydrophobicContact CE1-CD1 4.45Å; D233-L235 PolarHBondContact O-N 3.5Å; L235-L237 PolarHBondContact O-N 3.16Å; L235-F241 HydrophobicContact CD2-CD2 3.9Å; L235-F241 HydrophobicContact CD2-CE2 4.03Å
236	G	43.2	Very low	47.8	Very low	56 Å²	56	85.4 Å²	85.4	58%	0.577	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-18.1	165.5	0	0	0	0	0	114.4	D170	D170-G236 PolarHBondContact OD2-N 3.03Å
237	L	41.8	Very low	49.2	Very low	141 Å²	141	85.5 Å²	85.5	74%	0.738	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-11.9	-173	-78.4	164.7	0	0	0	115.5	L235	L235-L237 PolarHBondContact O-N 3.16Å
238	T	47	Very low	50.7	Low	74 Å²	74	83.5 Å²	83.5	45%	0.454	48%	0.481	S	S	.	.	S	Bend	trans	-94.4	-7.1	175.1	57.1	0	0	0	0	113.7	E240	T238-E240 PolarHBondContact O-N 2.91Å
239	G	53.4	Low	52.5	Low	54 Å²	54	80.7 Å²	80.7	56%	0.557	46%	0.458	S	S	*	.			trans	60.4	12.9	-179.3	0	0	0	0	0	114.1	F241	G239-F241 VanDerWaalsContact C-N 3.34Å
240	E	56.2	Low	54.4	Low	75 Å²	75	80.6 Å²	80.6	35%	0.35	46%	0.458	S	S	.	.	S	Bend	trans	-76.1	-25.1	-175.1	-71.1	-178.7	-176.8	0	0	112.2	H58 R59 T238	H58-E240 PolarHBondContact N-O 3.23Å; R59-E240 HydrophobicContact CG-CB 3.77Å; R59-E240 HydrophobicContact CG-CG 3.92Å; T238-E240 PolarHBondContact O-N 2.91Å
241	F	61.8	Low	56.1	Low	34 Å²	34	74.6 Å²	74.6	15%	0.149	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	141	179.1	-56.8	-76.6	0	0	0	110.4	I55 Y56 R59 F64 L177 I183 L235 G239	I55-F241 HydrophobicContact CG2-CB 4.29Å; I55-F241 HydrophobicContact CG2-CD1 4.2Å; Y56-F241 WeakPolarHBondContact O-CA 3.31Å; R59-F241 VanDerWaalsContact NH2-CE1 3.32Å; F64-F241 HydrophobicContact CE1-CE1 4.35Å; F64-F241 HydrophobicContact CZ-CD1 4.39Å; F64-F241 HydrophobicContact CZ-CE1 4.01Å; L177-F241 HydrophobicContact CD1-CD1 4.3Å; L177-F241 HydrophobicContact CD1-CE1 4.1Å; L177-F241 HydrophobicContact CD1-CZ 4.27Å; I183-F241 HydrophobicContact CD1-CE2 3.93Å; I183-F241 HydrophobicContact CD1-CZ 3.84Å; I183-F241 HydrophobicContact CG1-CE2 4.25Å; I183-F241 HydrophobicContact CG1-CZ 3.74Å; L235-F241 HydrophobicContact CD2-CD2 3.9Å; L235-F241 HydrophobicContact CD2-CE2 4.03Å; G239-F241 VanDerWaalsContact C-N 3.34Å
242	A	63	Low	58.1	Low	22 Å²	22	70.2 Å²	70.2	18%	0.182	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	125	169	0	0	0	0	0	109.4	Y56 H58 Y244	Y56-A242 PolarHBondContact N-O 3.44Å; Y56-A242 PolarHBondContact O-N 3.03Å; Y56-A242 VanDerWaalsContact O-N 3.14Å; H58-A242 WeakPolarHBondContact CD2-CB 3.37Å; H58-A242 VanDerWaalsContact NE2-CB 3.35Å; H58-A242 WeakPolarHBondContact NE2-CB 2.88Å; A242-Y244 HydrophobicContact CB-CD2 4.19Å; A242-Y244 HydrophobicContact CB-CE2 3.57Å
243	L	63.7	Low	59.9	Low	53 Å²	53	71.2 Å²	71.2	28%	0.277	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	125.9	176.8	-173	138.7	0	0	0	109.5	I53 L173 L245	I53-L243 HydrophobicContact CG2-CD1 4.1Å; I53-L243 HydrophobicContact CG2-CG 4.22Å; L173-L243 HydrophobicContact CD1-CD1 3.29Å; L173-L243 HydrophobicContact CD2-CD1 4.08Å; L173-L243 HydrophobicContact CG-CD1 4.25Å; L243-L245 HydrophobicContact CD2-CD1 3.59Å
244	Y	64.5	Low	61.9	Low	135 Å²	135	68.1 Å²	68.1	53%	0.529	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	116	174.6	-70.1	-93.2	0	0	0	108.9	Y54 Y56 A242	Y54-Y244 PolarHBondContact N-O 3.09Å; Y54-Y244 PolarHBondContact O-N 2.93Å; Y56-Y244 AromaticContact CD2-CD2 3.48Å; Y56-Y244 HydrophobicContact CD2-CD2 3.48Å; Y56-Y244 VanDerWaalsContact CD2-CD2 3.48Å; Y56-Y244 AromaticContact CD2-CE2 3.88Å; Y56-Y244 HydrophobicContact CD2-CE2 3.88Å; Y56-Y244 HydrophobicContact CD2-CG 4.47Å; Y56-Y244 AromaticContact CE2-CD2 3.66Å; Y56-Y244 HydrophobicContact CE2-CD2 3.66Å; Y56-Y244 HydrophobicContact CE2-CE2 4.24Å; Y56-Y244 HydrophobicContact CE2-CG 4.25Å; A242-Y244 HydrophobicContact CB-CD2 4.19Å; A242-Y244 HydrophobicContact CB-CE2 3.57Å
245	L	63.2	Low	63.7	Low	43 Å²	43	60 Å²	60	23%	0.225	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	132.4	165.1	-107.2	74.4	0	0	0	109.5	F51 I53 I162 H166 L243	F51-L245 HydrophobicContact CD2-CD2 4.41Å; I53-L245 HydrophobicContact CB-CD1 4.36Å; I53-L245 HydrophobicContact CG1-CD1 4.01Å; I53-L245 HydrophobicContact CG2-CD1 4.02Å; I162-L245 HydrophobicContact CG2-CD2 3.72Å; H166-L245 HydrophobicContact CB-CD2 4.05Å; L243-L245 HydrophobicContact CD2-CD1 3.59Å
246	T	65.7	Low	65.4	Low	37 Å²	37	61.6 Å²	61.6	23%	0.227	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-73.3	148	163.2	54.8	0	0	0	0	110.1	H52 Y54	H52-T246 HydrophobicContact CB-CG2 4.15Å; H52-T246 WeakPolarHBondContact CB-OG1 3.4Å; H52-T246 PolarHBondContact N-OG1 2.72Å; H52-T246 VanDerWaalsContact N-OG1 3.12Å; H52-T246 PolarHBondContact O-N 3.34Å; H52-T246 PolarHBondContact O-OG1 3.28Å; Y54-T246 HydrophobicContact CD2-CG2 3.9Å; Y54-T246 HydrophobicContact CE2-CG2 3.48Å; Y54-T246 VanDerWaalsContact CE2-CG2 3.48Å
247	P	61.4	Low	67.6	Low	102 Å²	102	60.8 Å²	60.8	66%	0.662	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-54.1	157.1	167.9	25.2	-34.8	0	0	0	111.3	L249	P247-L249 PolarHBondContact O-N 2.66Å
248	P	61.8	Low	69.8	Low	64 Å²	64	54.1 Å²	54.1	42%	0.416	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-52.1	127.7	-180	20.4	-32.3	0	0	0	110.3	F252 F253	P248-F252 HydrophobicContact CB-CB 3.88Å; P248-F252 HydrophobicContact CB-CD1 3.63Å; P248-F252 HydrophobicContact CB-CE1 4.38Å; P248-F252 HydrophobicContact CB-CG 3.92Å; P248-F252 HydrophobicContact CG-CD1 4.3Å; P248-F253 WeakPolarHBondContact O-CE2 3.45Å
249	L	70.6	Confident	71.8	Confident	45 Å²	45	51 Å²	51	24%	0.236	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-79.3	171.5	-173.6	-69	152.7	0	0	0	110.4	R49 L50 H52 P247 S251 F252	R49-L249 HydrophobicContact CB-CD1 4.16Å; R49-L249 VanDerWaalsContact O-CB 3.25Å; R49-L249 WeakPolarHBondContact O-CB 3.49Å; R49-L249 WeakPolarHBondContact O-CD1 3.44Å; L50-L249 PolarHBondContact O-N 3.17Å; L50-L249 VanDerWaalsContact O-N 3.11Å; H52-L249 HydrophobicContact CB-CD1 4.49Å; H52-L249 WeakPolarHBondContact CD2-CD1 3.34Å; H52-L249 VanDerWaalsContact NE2-CD1 3.31Å; H52-L249 WeakPolarHBondContact NE2-CD1 3.09Å; P247-L249 PolarHBondContact O-N 2.66Å; L249-S251 PolarHBondContact O-N 2.92Å; L249-F252 PolarHBondContact O-N 2.9Å
250	S	71.7	Confident	73.6	Confident	93 Å²	93	54.5 Å²	54.5	65%	0.65	29%	0.288	S	S	*	.	H	α-helix	trans	-49.7	-28.3	-179.1	57.5	0	0	0	0	114.3	F253 L254	S250-F253 WeakPolarHBondContact O-CB 3.48Å; S250-F253 PolarHBondContact O-N 2.87Å; S250-L254 WeakPolarHBondContact O-CG 3.34Å; S250-L254 PolarHBondContact O-N 2.52Å
251	S	72.4	Confident	75.4	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.007	28%	0.279	C	S	.	.	H	α-helix	trans	-72.7	-29.5	178.5	71.9	0	0	0	0	114	T47 R49 L50 L249 F253 L254 L255	T47-S251 VanDerWaalsContact CG2-CB 3.45Å; R49-S251 PolarHBondContact O-OG 2.98Å; L50-S251 WeakPolarHBondContact CA-OG 3.41Å; L50-S251 PolarHBondContact N-OG 3.08Å; L249-S251 PolarHBondContact O-N 2.92Å; S251-F253 VanDerWaalsContact C-N 3.34Å; S251-L254 WeakPolarHBondContact O-CB 3.48Å; S251-L254 PolarHBondContact O-N 2.82Å; S251-L255 PolarHBondContact O-N 2.85Å; S251-L255 VanDerWaalsContact O-N 3.07Å
252	F	77.4	Confident	76.8	Confident	20 Å²	20	50.8 Å²	50.8	9%	0.088	27%	0.272	C	S	.	.	H	α-helix	trans	-66.3	-42.2	171.7	-171.1	-106.7	0	0	0	109.9	L50 E159 P248 L249 L254 L255 I256	L50-F252 HydrophobicContact CD2-CD2 3.87Å; E159-F252 HydrophobicContact CB-CZ 4.39Å; P248-F252 HydrophobicContact CB-CB 3.88Å; P248-F252 HydrophobicContact CB-CD1 3.63Å; P248-F252 HydrophobicContact CB-CE1 4.38Å; P248-F252 HydrophobicContact CB-CG 3.92Å; P248-F252 HydrophobicContact CG-CD1 4.3Å; L249-F252 PolarHBondContact O-N 2.9Å; F252-L254 VanDerWaalsContact C-N 3.3Å; F252-L254 PolarHBondContact O-N 3.12Å; F252-L255 PolarHBondContact O-N 3.4Å; F252-I256 HydrophobicContact CD1-CD1 3.48Å; F252-I256 VanDerWaalsContact CD1-CD1 3.48Å; F252-I256 HydrophobicContact CD1-CG1 4.38Å; F252-I256 HydrophobicContact CE1-CD1 3.37Å; F252-I256 HydrophobicContact CE1-CG1 4.27Å; F252-I256 HydrophobicContact CG-CD1 4.38Å; F252-I256 HydrophobicContact CZ-CD1 4.17Å; F252-I256 WeakPolarHBondContact O-CG1 3.41Å; F252-I256 PolarHBondContact O-N 3.11Å
253	F	80.3	Confident	78.1	Confident	128 Å²	128	53.1 Å²	53.1	56%	0.561	28%	0.281	S	S	*	.	H	α-helix	trans	-62.1	-34.9	171.8	-67.7	-73.3	0	0	0	113	P248 S250 S251 S257	P248-F253 WeakPolarHBondContact O-CE2 3.45Å; S250-F253 WeakPolarHBondContact O-CB 3.48Å; S250-F253 PolarHBondContact O-N 2.87Å; S251-F253 VanDerWaalsContact C-N 3.34Å; F253-S257 VanDerWaalsContact O-CB 3.27Å; F253-S257 WeakPolarHBondContact O-CB 3.32Å; F253-S257 PolarHBondContact O-N 3.25Å; F253-S257 PolarHBondContact O-OG 3.15Å
254	L	84.2	Confident	79.5	Confident	59 Å²	59	55.1 Å²	55.1	31%	0.309	29%	0.291	S	S	.	.	H	α-helix	trans	-63.7	-42.5	173.6	-73.5	175.4	0	0	0	111.8	L40 I43 S250 S251 F252 S257 A258	L40-L254 HydrophobicContact CD2-CD2 4.36Å; I43-L254 HydrophobicContact CG2-CD1 4.26Å; S250-L254 WeakPolarHBondContact O-CG 3.34Å; S250-L254 PolarHBondContact O-N 2.52Å; S251-L254 WeakPolarHBondContact O-CB 3.48Å; S251-L254 PolarHBondContact O-N 2.82Å; F252-L254 VanDerWaalsContact C-N 3.3Å; F252-L254 PolarHBondContact O-N 3.12Å; L254-S257 WeakPolarHBondContact CA-OG 3.47Å; L254-S257 PolarHBondContact O-N 3.26Å; L254-S257 PolarHBondContact O-OG 3.47Å; L254-A258 WeakPolarHBondContact O-CB 3.17Å; L254-A258 PolarHBondContact O-N 3.06Å
255	L	84.1	Confident	80.8	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-66.3	-44	177.6	-74.7	163.4	0	0	0	111.9	L45 L50 L155 S251 F252 S257 A258 D259	L45-L255 HydrophobicContact CD2-CD2 4.24Å; L45-L255 HydrophobicContact CG-CD2 4.25Å; L50-L255 HydrophobicContact CD2-CD1 3.74Å; L50-L255 HydrophobicContact CG-CD1 4.47Å; L155-L255 HydrophobicContact CD1-CB 4.03Å; L155-L255 HydrophobicContact CD2-CB 3.77Å; L155-L255 HydrophobicContact CD2-CD1 3.74Å; L155-L255 HydrophobicContact CD2-CG 4.21Å; S251-L255 PolarHBondContact O-N 2.85Å; S251-L255 VanDerWaalsContact O-N 3.07Å; F252-L255 PolarHBondContact O-N 3.4Å; L255-S257 VanDerWaalsContact C-N 3.3Å; L255-S257 PolarHBondContact O-N 3.5Å; L255-A258 WeakPolarHBondContact O-CB 3.38Å; L255-A258 PolarHBondContact O-N 2.92Å; L255-D259 PolarHBondContact O-N 2.92Å
256	I	85.6	Confident	82.1	Confident	55 Å²	55	48.3 Å²	48.3	28%	0.282	26%	0.263	S	S	.	.	H	α-helix	trans	-58.8	-44.8	172.3	-68.5	166	0	0	0	110.4	F252 A258 D259 F260	F252-I256 HydrophobicContact CD1-CD1 3.48Å; F252-I256 VanDerWaalsContact CD1-CD1 3.48Å; F252-I256 HydrophobicContact CD1-CG1 4.38Å; F252-I256 HydrophobicContact CE1-CD1 3.37Å; F252-I256 HydrophobicContact CE1-CG1 4.27Å; F252-I256 HydrophobicContact CG-CD1 4.38Å; F252-I256 HydrophobicContact CZ-CD1 4.17Å; F252-I256 WeakPolarHBondContact O-CG1 3.41Å; F252-I256 PolarHBondContact O-N 3.11Å; I256-A258 VanDerWaalsContact C-N 3.29Å; I256-A258 PolarHBondContact O-N 3.29Å; I256-D259 WeakPolarHBondContact O-CB 3.23Å; I256-D259 PolarHBondContact O-N 2.93Å; I256-F260 HydrophobicContact CG2-CD2 3.69Å; I256-F260 HydrophobicContact CG2-CE2 3.45Å; I256-F260 VanDerWaalsContact CG2-CE2 3.45Å; I256-F260 VanDerWaalsContact O-CD2 3.23Å; I256-F260 WeakPolarHBondContact O-CD2 3.46Å; I256-F260 PolarHBondContact O-N 3.36Å
257	S	88.9	Confident	83.4	Confident	40 Å²	40	50.8 Å²	50.8	28%	0.28	27%	0.274	S	S	.	.	H	α-helix	trans	-63.7	-36.2	178.7	76.7	0	0	0	0	112.2	F253 L254 L255 D259 F260 I261	F253-S257 VanDerWaalsContact O-CB 3.27Å; F253-S257 WeakPolarHBondContact O-CB 3.32Å; F253-S257 PolarHBondContact O-N 3.25Å; F253-S257 PolarHBondContact O-OG 3.15Å; L254-S257 WeakPolarHBondContact CA-OG 3.47Å; L254-S257 PolarHBondContact O-N 3.26Å; L254-S257 PolarHBondContact O-OG 3.47Å; L255-S257 VanDerWaalsContact C-N 3.3Å; L255-S257 PolarHBondContact O-N 3.5Å; S257-D259 VanDerWaalsContact C-N 3.35Å; S257-F260 PolarHBondContact O-N 3.18Å; S257-I261 VanDerWaalsContact O-CG1 3.29Å; S257-I261 WeakPolarHBondContact O-CG1 3.33Å; S257-I261 PolarHBondContact O-N 3.41Å
258	A	88.8	Confident	84.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.6	-42.6	175.2	0	0	0	0	0	111.2	L40 T41 L254 L255 I256 I261 Y262	L40-A258 HydrophobicContact CB-CB 3.7Å; T41-A258 WeakPolarHBondContact OG1-CB 3.49Å; L254-A258 WeakPolarHBondContact O-CB 3.17Å; L254-A258 PolarHBondContact O-N 3.06Å; L255-A258 WeakPolarHBondContact O-CB 3.38Å; L255-A258 PolarHBondContact O-N 2.92Å; I256-A258 VanDerWaalsContact C-N 3.29Å; I256-A258 PolarHBondContact O-N 3.29Å; A258-I261 PolarHBondContact O-N 3.27Å; A258-I261 VanDerWaalsContact O-N 3.17Å; A258-Y262 VanDerWaalsContact O-CD2 3.27Å; A258-Y262 WeakPolarHBondContact O-CD2 3.25Å; A258-Y262 PolarHBondContact O-N 3.25Å
259	D	89.3	Confident	86	Confident	8 Å²	8	43.4 Å²	43.4	4%	0.043	23%	0.227	C	C	.	.	H	α-helix	trans	-61.5	-44.8	176	-168.6	68.3	0	0	0	112.3	L152 L255 I256 S257 I261 Y262 L263	L152-D259 WeakPolarHBondContact CD2-OD2 2.77Å; L152-D259 WeakPolarHBondContact CG-OD2 3.33Å; L255-D259 PolarHBondContact O-N 2.92Å; I256-D259 WeakPolarHBondContact O-CB 3.23Å; I256-D259 PolarHBondContact O-N 2.93Å; S257-D259 VanDerWaalsContact C-N 3.35Å; D259-I261 VanDerWaalsContact C-N 3.28Å; D259-I261 PolarHBondContact O-N 3.48Å; D259-Y262 WeakPolarHBondContact O-CB 3.31Å; D259-Y262 PolarHBondContact O-N 3.49Å; D259-Y262 VanDerWaalsContact O-N 3.11Å; D259-L263 PolarHBondContact O-N 2.73Å
260	F	91.7	Very high	87	Confident	128 Å²	128	43.9 Å²	43.9	56%	0.561	23%	0.229	S	C	*	.	H	α-helix	trans	-59.5	-38.4	173.3	-81.2	-66.4	0	0	0	112.8	I256 S257 L263 L264	I256-F260 HydrophobicContact CG2-CD2 3.69Å; I256-F260 HydrophobicContact CG2-CE2 3.45Å; I256-F260 VanDerWaalsContact CG2-CE2 3.45Å; I256-F260 VanDerWaalsContact O-CD2 3.23Å; I256-F260 WeakPolarHBondContact O-CD2 3.46Å; I256-F260 PolarHBondContact O-N 3.36Å; S257-F260 PolarHBondContact O-N 3.18Å; F260-L263 WeakPolarHBondContact O-CB 3.49Å; F260-L263 PolarHBondContact O-N 3.18Å; F260-L264 WeakPolarHBondContact O-CG 3.36Å; F260-L264 PolarHBondContact O-N 2.86Å
261	I	92.7	Very high	87.8	Confident	31 Å²	31	43.1 Å²	43.1	16%	0.159	22%	0.217	C	C	.	.	H	α-helix	trans	-67.5	-37.9	176.4	-69.3	175.5	0	0	0	111.2	L33 I36 L40 S257 A258 D259 L264 S265	L33-I261 HydrophobicContact CB-CG2 4.12Å; L33-I261 HydrophobicContact CD2-CG2 4.37Å; L33-I261 WeakPolarHBondContact O-CG2 3.31Å; I36-I261 HydrophobicContact CG2-CD1 3.82Å; L40-I261 HydrophobicContact CD1-CD1 3.5Å; S257-I261 VanDerWaalsContact O-CG1 3.29Å; S257-I261 WeakPolarHBondContact O-CG1 3.33Å; S257-I261 PolarHBondContact O-N 3.41Å; A258-I261 PolarHBondContact O-N 3.27Å; A258-I261 VanDerWaalsContact O-N 3.17Å; D259-I261 VanDerWaalsContact C-N 3.28Å; D259-I261 PolarHBondContact O-N 3.48Å; I261-L264 PolarHBondContact O-N 3.27Å; I261-S265 PolarHBondContact O-N 3.06Å
262	Y	91	Very high	88.5	Confident	1 Å²	1	44.2 Å²	44.2	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-63.2	-42.6	172	-71.3	-51.7	0	0	0	112	L34 G37 I38 T41 A115 I151 A258 D259 L264 S265 F266	L34-Y262 HydrophobicContact CD1-CD1 3.65Å; L34-Y262 HydrophobicContact CD1-CE1 3.66Å; G37-Y262 PolarHBondContact O-OH 3.02Å; I38-Y262 WeakPolarHBondContact CA-OH 3.3Å; I38-Y262 HydrophobicContact CG1-CE1 4.03Å; I38-Y262 WeakPolarHBondContact CG1-OH 3.32Å; I38-Y262 PolarHBondContact N-OH 3.29Å; T41-Y262 WeakPolarHBondContact OG1-CE2 3.34Å; T41-Y262 PolarHBondContact OG1-OH 3.47Å; A115-Y262 HydrophobicContact CB-CE1 3.87Å; I151-Y262 HydrophobicContact CD1-CD2 3.85Å; I151-Y262 HydrophobicContact CD1-CE2 3.35Å; A258-Y262 VanDerWaalsContact O-CD2 3.27Å; A258-Y262 WeakPolarHBondContact O-CD2 3.25Å; A258-Y262 PolarHBondContact O-N 3.25Å; D259-Y262 WeakPolarHBondContact O-CB 3.31Å; D259-Y262 PolarHBondContact O-N 3.49Å; D259-Y262 VanDerWaalsContact O-N 3.11Å; Y262-L264 VanDerWaalsContact C-N 3.34Å; Y262-L264 PolarHBondContact O-N 2.83Å; Y262-S265 WeakPolarHBondContact O-CB 3.22Å; Y262-S265 PolarHBondContact O-N 2.99Å; Y262-F266 WeakPolarHBondContact O-CB 3.49Å; Y262-F266 PolarHBondContact O-N 3.38Å
263	L	92	Very high	89.1	Confident	71 Å²	71	44.8 Å²	44.8	37%	0.372	22%	0.224	S	C	.	.	H	α-helix	trans	-59.8	-41.9	174	-94.1	166.6	0	0	0	112.5	V148 D259 F260 F266 L267	V148-L263 HydrophobicContact CG1-CD2 4.41Å; V148-L263 HydrophobicContact CG1-CG 4.06Å; D259-L263 PolarHBondContact O-N 2.73Å; F260-L263 WeakPolarHBondContact O-CB 3.49Å; F260-L263 PolarHBondContact O-N 3.18Å; L263-F266 PolarHBondContact O-N 3.32Å; L263-L267 WeakPolarHBondContact O-CB 3.48Å; L263-L267 PolarHBondContact O-N 2.83Å
264	L	92.9	Very high	89.5	Confident	94 Å²	94	42 Å²	42	49%	0.492	22%	0.217	S	C	.	.	H	α-helix	trans	-64.5	-41.1	174.9	-73	170.3	0	0	0	111.8	L33 F260 I261 Y262 L267 A268	L33-L264 HydrophobicContact CD1-CB 4.09Å; F260-L264 WeakPolarHBondContact O-CG 3.36Å; F260-L264 PolarHBondContact O-N 2.86Å; I261-L264 PolarHBondContact O-N 3.27Å; Y262-L264 VanDerWaalsContact C-N 3.34Å; Y262-L264 PolarHBondContact O-N 2.83Å; L264-L267 PolarHBondContact O-N 3.43Å; L264-A268 WeakPolarHBondContact O-CB 3.44Å; L264-A268 PolarHBondContact O-N 3.17Å
265	S	90.9	Very high	89.6	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.3	-47.7	174.6	-173.6	0	0	0	0	111.2	S30 I261 Y262 L267 A268 V269	S30-S265 PolarHBondContact O-OG 3.47Å; I261-S265 PolarHBondContact O-N 3.06Å; Y262-S265 WeakPolarHBondContact O-CB 3.22Å; Y262-S265 PolarHBondContact O-N 2.99Å; S265-L267 VanDerWaalsContact C-N 3.34Å; S265-L267 PolarHBondContact O-N 2.98Å; S265-A268 PolarHBondContact O-N 3.44Å; S265-A268 VanDerWaalsContact O-N 3.17Å; S265-V269 WeakPolarHBondContact O-CG2 3.48Å; S265-V269 PolarHBondContact O-N 3.45Å
266	F	91.4	Very high	89.6	Confident	36 Å²	36	45.7 Å²	45.7	16%	0.158	23%	0.229	C	C	.	.	H	α-helix	trans	-54.2	-48.6	174.3	167	-94.9	0	0	0	111.6	V141 L144 L145 Y262 L263 A268 V269 L270	V141-F266 HydrophobicContact CG1-CD2 4.21Å; V141-F266 HydrophobicContact CG1-CE2 3.53Å; V141-F266 HydrophobicContact CG1-CZ 4.3Å; L144-F266 HydrophobicContact CB-CB 4.38Å; L144-F266 HydrophobicContact CB-CD2 4.16Å; L145-F266 HydrophobicContact CB-CD2 4.49Å; L145-F266 HydrophobicContact CB-CE2 4.09Å; L145-F266 HydrophobicContact CD1-CE2 4.26Å; L145-F266 HydrophobicContact CD1-CZ 4.36Å; Y262-F266 WeakPolarHBondContact O-CB 3.49Å; Y262-F266 PolarHBondContact O-N 3.38Å; L263-F266 PolarHBondContact O-N 3.32Å; F266-A268 VanDerWaalsContact C-N 3.32Å; F266-A268 PolarHBondContact O-N 3.13Å; F266-V269 PolarHBondContact O-N 3.21Å; F266-L270 HydrophobicContact CE1-CD2 4.05Å; F266-L270 HydrophobicContact CZ-CD2 4.21Å; F266-L270 VanDerWaalsContact O-CB 3.27Å; F266-L270 WeakPolarHBondContact O-CB 3.06Å; F266-L270 PolarHBondContact O-N 3.02Å
267	L	92.3	Very high	89.6	Confident	88 Å²	88	44.9 Å²	44.9	46%	0.461	23%	0.228	S	C	.	.	H	α-helix	trans	-61.1	-42.1	179.4	-176.7	64.7	0	0	0	111.5	L263 L264 S265 L270 I271	L263-L267 WeakPolarHBondContact O-CB 3.48Å; L263-L267 PolarHBondContact O-N 2.83Å; L264-L267 PolarHBondContact O-N 3.43Å; S265-L267 VanDerWaalsContact C-N 3.34Å; S265-L267 PolarHBondContact O-N 2.98Å; L267-L270 PolarHBondContact O-N 3.21Å; L267-I271 HydrophobicContact CG-CD1 4.14Å; L267-I271 WeakPolarHBondContact O-CD1 3.22Å; L267-I271 VanDerWaalsContact O-CG1 3.22Å; L267-I271 WeakPolarHBondContact O-CG1 3.18Å; L267-I271 PolarHBondContact O-N 2.72Å
268	A	90.1	Very high	89.6	Confident	11 Å²	11	47.8 Å²	47.8	9%	0.091	24%	0.237	C	C	.	.	H	α-helix	trans	-65.6	-41.5	178.2	0	0	0	0	0	112.5	V26 L264 S265 F266 I271 Y272	V26-A268 HydrophobicContact CG1-CB 3.75Å; L264-A268 WeakPolarHBondContact O-CB 3.44Å; L264-A268 PolarHBondContact O-N 3.17Å; S265-A268 PolarHBondContact O-N 3.44Å; S265-A268 VanDerWaalsContact O-N 3.17Å; F266-A268 VanDerWaalsContact C-N 3.32Å; F266-A268 PolarHBondContact O-N 3.13Å; A268-I271 PolarHBondContact O-N 3.32Å; A268-Y272 PolarHBondContact O-N 3.42Å; A268-Y272 VanDerWaalsContact O-N 3.11Å
269	V	88.9	Confident	89.4	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-66.6	-40.4	174.1	178.7	0	0	0	0	110.9	S30 V137 E140 V141 L144 S265 F266 I271 Y272 F273	S30-V269 WeakPolarHBondContact OG-CG2 3.47Å; V137-V269 HydrophobicContact CG1-CG1 4.23Å; E140-V269 WeakPolarHBondContact OE1-CG1 3.44Å; E140-V269 WeakPolarHBondContact OE1-CG2 3.3Å; V141-V269 HydrophobicContact CG2-CG1 3.65Å; L144-V269 HydrophobicContact CD1-CB 4.21Å; L144-V269 HydrophobicContact CD1-CG2 3.86Å; S265-V269 WeakPolarHBondContact O-CG2 3.48Å; S265-V269 PolarHBondContact O-N 3.45Å; F266-V269 PolarHBondContact O-N 3.21Å; V269-I271 PolarHBondContact O-N 2.8Å; V269-Y272 CarbonylContact O-C 3.57Å; V269-Y272 WeakPolarHBondContact O-CA 3.42Å; V269-Y272 WeakPolarHBondContact O-CB 3.38Å; V269-Y272 PolarHBondContact O-N 2.92Å; V269-Y272 VanDerWaalsContact O-N 3.13Å; V269-F273 WeakPolarHBondContact O-CB 3.3Å; V269-F273 PolarHBondContact O-N 2.84Å
270	L	90.9	Very high	89.1	Confident	55 Å²	55	55.2 Å²	55.2	29%	0.288	28%	0.278	S	S	.	.	H	α-helix	trans	-62.1	-43.6	177	-175.7	67.7	0	0	0	111.4	V141 F266 L267 Y272 F273 V274	V141-L270 HydrophobicContact CG1-CD1 4.22Å; F266-L270 HydrophobicContact CE1-CD2 4.05Å; F266-L270 HydrophobicContact CZ-CD2 4.21Å; F266-L270 VanDerWaalsContact O-CB 3.27Å; F266-L270 WeakPolarHBondContact O-CB 3.06Å; F266-L270 PolarHBondContact O-N 3.02Å; L267-L270 PolarHBondContact O-N 3.21Å; L270-Y272 VanDerWaalsContact C-N 3.28Å; L270-Y272 PolarHBondContact O-N 3.12Å; L270-F273 HydrophobicContact CD1-CD1 4.45Å; L270-F273 WeakPolarHBondContact O-CB 3.31Å; L270-F273 PolarHBondContact O-N 2.86Å; L270-V274 WeakPolarHBondContact O-CG2 3.32Å; L270-V274 PolarHBondContact O-N 2.76Å
271	I	89.2	Confident	88.9	Confident	77 Å²	77	52.9 Å²	52.9	40%	0.395	27%	0.274	S	S	.	.	H	α-helix	trans	-58.7	-43.6	173.6	-70.1	163.4	0	0	0	110.2	L267 A268 V269 R275	L267-I271 HydrophobicContact CG-CD1 4.14Å; L267-I271 WeakPolarHBondContact O-CD1 3.22Å; L267-I271 VanDerWaalsContact O-CG1 3.22Å; L267-I271 WeakPolarHBondContact O-CG1 3.18Å; L267-I271 PolarHBondContact O-N 2.72Å; A268-I271 PolarHBondContact O-N 3.32Å; V269-I271 PolarHBondContact O-N 2.8Å; I271-R275 WeakPolarHBondContact O-CG 3.15Å; I271-R275 PolarHBondContact O-N 3.24Å
272	Y	87.1	Confident	88.6	Confident	25 Å²	25	53.4 Å²	53.4	10%	0.098	28%	0.283	C	S	.	.	H	α-helix	trans	-62.6	-42.7	175.7	-178.1	-105.2	0	0	0	112.3	Y27 R132 V137 A268 V269 L270 R275 L276	Y27-Y272 AromaticContact CD2-CD1 3.44Å; Y27-Y272 HydrophobicContact CD2-CD1 3.44Å; Y27-Y272 VanDerWaalsContact CD2-CD1 3.44Å; Y27-Y272 HydrophobicContact CD2-CD2 4.34Å; Y27-Y272 AromaticContact CD2-CE1 3.97Å; Y27-Y272 HydrophobicContact CD2-CE1 3.97Å; Y27-Y272 AromaticContact CD2-CG 3.66Å; Y27-Y272 HydrophobicContact CD2-CG 3.66Å; Y27-Y272 AromaticContact CE2-CD1 3.8Å; Y27-Y272 HydrophobicContact CE2-CD1 3.8Å; Y27-Y272 HydrophobicContact CE2-CE1 4.13Å; Y27-Y272 HydrophobicContact CE2-CG 4.46Å; Y27-Y272 HydrophobicContact CG-CD1 4.07Å; Y27-Y272 HydrophobicContact CG-CD2 4.3Å; Y27-Y272 HydrophobicContact CG-CE1 4.3Å; Y27-Y272 HydrophobicContact CG-CG 4.07Å; R132-Y272 PolarHBondContact NH1-OH 3.26Å; R132-Y272 VanDerWaalsContact NH1-OH 3.13Å; V137-Y272 HydrophobicContact CG1-CD1 4.08Å; V137-Y272 HydrophobicContact CG2-CD1 4.47Å; V137-Y272 HydrophobicContact CG2-CE1 4.15Å; A268-Y272 PolarHBondContact O-N 3.42Å; A268-Y272 VanDerWaalsContact O-N 3.11Å; V269-Y272 CarbonylContact O-C 3.57Å; V269-Y272 WeakPolarHBondContact O-CA 3.42Å; V269-Y272 WeakPolarHBondContact O-CB 3.38Å; V269-Y272 PolarHBondContact O-N 2.92Å; V269-Y272 VanDerWaalsContact O-N 3.13Å; L270-Y272 VanDerWaalsContact C-N 3.28Å; L270-Y272 PolarHBondContact O-N 3.12Å; Y272-R275 PolarHBondContact O-N 3.33Å; Y272-L276 PolarHBondContact O-N 2.84Å
273	F	88.3	Confident	88.2	Confident	32 Å²	32	56.4 Å²	56.4	14%	0.14	30%	0.299	C	S	.	.	H	α-helix	trans	-60.4	-50	177.1	175.9	-106.4	0	0	0	112.2	W134 V137 L138 V141 V269 L270 R275 L276 C277	W134-F273 HydrophobicContact CB-CE2 4.45Å; W134-F273 HydrophobicContact CE3-CE2 4.41Å; V137-F273 HydrophobicContact CB-CD2 4.15Å; V137-F273 HydrophobicContact CG1-CB 3.86Å; V137-F273 HydrophobicContact CG1-CD2 3.98Å; V137-F273 HydrophobicContact CG1-CG 4.4Å; L138-F273 HydrophobicContact CB-CD2 4.49Å; L138-F273 HydrophobicContact CB-CE2 3.81Å; L138-F273 HydrophobicContact CB-CZ 4.24Å; L138-F273 HydrophobicContact CD1-CE1 4.35Å; L138-F273 HydrophobicContact CD1-CE2 4.27Å; L138-F273 HydrophobicContact CD1-CZ 3.9Å; V141-F273 HydrophobicContact CG2-CB 4.34Å; V269-F273 WeakPolarHBondContact O-CB 3.3Å; V269-F273 PolarHBondContact O-N 2.84Å; L270-F273 HydrophobicContact CD1-CD1 4.45Å; L270-F273 WeakPolarHBondContact O-CB 3.31Å; L270-F273 PolarHBondContact O-N 2.86Å; F273-R275 VanDerWaalsContact C-N 3.25Å; F273-R275 PolarHBondContact O-N 2.83Å; F273-L276 WeakPolarHBondContact O-CA 3.48Å; F273-L276 WeakPolarHBondContact O-CB 3.45Å; F273-L276 PolarHBondContact O-N 3.03Å; F273-C277 WeakPolarHBondContact CZ-SG 3.44Å; F273-C277 PolarHBondContact O-N 3.03Å; F273-C277 PolarHBondContact O-SG 2.9Å
274	V	88.8	Confident	87.9	Confident	69 Å²	69	61 Å²	61	42%	0.418	31%	0.312	S	S	.	.	H	α-helix	trans	-56.1	-43.4	177.8	171.6	0	0	0	0	110.6	L270 L276 C277 E278	L270-V274 WeakPolarHBondContact O-CG2 3.32Å; L270-V274 PolarHBondContact O-N 2.76Å; V274-L276 VanDerWaalsContact C-N 3.33Å; V274-L276 PolarHBondContact O-N 3.47Å; V274-C277 WeakPolarHBondContact O-CB 3.35Å; V274-C277 PolarHBondContact O-N 3.03Å; V274-E278 WeakPolarHBondContact O-CG 3.1Å; V274-E278 PolarHBondContact O-N 3.35Å
275	R	86	Confident	87.6	Confident	107 Å²	107	63.2 Å²	63.2	40%	0.404	32%	0.317	S	S	.	.	H	α-helix	trans	-65.2	-35.4	177.1	-67	-66.3	-171.1	-171.1	-1.3	113.1	T23 I271 Y272 F273 E278 K279	T23-R275 HydrophobicContact CG2-CB 4.34Å; T23-R275 HydrophobicContact CG2-CG 3.83Å; I271-R275 WeakPolarHBondContact O-CG 3.15Å; I271-R275 PolarHBondContact O-N 3.24Å; Y272-R275 PolarHBondContact O-N 3.33Å; F273-R275 VanDerWaalsContact C-N 3.25Å; F273-R275 PolarHBondContact O-N 2.83Å; R275-E278 VanDerWaalsContact CD-OE2 3.31Å; R275-E278 WeakPolarHBondContact CD-OE2 3.28Å; R275-E278 IonicContact CZ-OE2 2.96Å; R275-E278 IonicContact NE-OE2 3.89Å; R275-E278 IonicContact NH1-OE1 2.68Å; R275-E278 IonicContact NH1-OE2 3.88Å; R275-E278 PolarHBondContact NH1-OE2 3.34Å; R275-K279 WeakPolarHBondContact O-CB 3.41Å; R275-K279 PolarHBondContact O-N 3.04Å; R275-K279 VanDerWaalsContact O-N 3.09Å
276	L	84.9	Confident	87.3	Confident	31 Å²	31	69.6 Å²	69.6	16%	0.162	35%	0.347	C	S	.	.	H	α-helix	trans	-68.1	-39.6	175.6	-170.2	61.4	0	0	0	111.2	W134 V137 Y272 F273 V274 K279 A280	W134-L276 HydrophobicContact CB-CD2 4.12Å; W134-L276 HydrophobicContact CB-CG 4.37Å; V137-L276 HydrophobicContact CB-CD2 4.45Å; V137-L276 HydrophobicContact CG2-CD2 3.85Å; Y272-L276 PolarHBondContact O-N 2.84Å; F273-L276 WeakPolarHBondContact O-CA 3.48Å; F273-L276 WeakPolarHBondContact O-CB 3.45Å; F273-L276 PolarHBondContact O-N 3.03Å; V274-L276 VanDerWaalsContact C-N 3.33Å; V274-L276 PolarHBondContact O-N 3.47Å; L276-K279 PolarHBondContact O-N 3.39Å; L276-A280 PolarHBondContact O-N 3.39Å
277	C	86.3	Confident	86.7	Confident	39 Å²	39	74 Å²	74	26%	0.264	37%	0.369	S	S	.	.	H	α-helix	trans	-64.9	-46.1	173.3	-68.7	0	0	0	0	112.3	F273 V274 K279 A280 V281	F273-C277 WeakPolarHBondContact CZ-SG 3.44Å; F273-C277 PolarHBondContact O-N 3.03Å; F273-C277 PolarHBondContact O-SG 2.9Å; V274-C277 WeakPolarHBondContact O-CB 3.35Å; V274-C277 PolarHBondContact O-N 3.03Å; C277-K279 VanDerWaalsContact C-N 3.26Å; C277-K279 PolarHBondContact O-N 3.09Å; C277-A280 PolarHBondContact O-N 2.83Å; C277-V281 WeakPolarHBondContact O-CG2 3.26Å; C277-V281 PolarHBondContact O-N 3.14Å
278	E	87.5	Confident	86.3	Confident	101 Å²	101	75.2 Å²	75.2	47%	0.472	37%	0.371	S	S	.	.	H	α-helix	trans	-54.4	-44.6	174.4	-75.8	-178.1	162.8	0	0	111.2	V274 R275 V281 A282	V274-E278 WeakPolarHBondContact O-CG 3.1Å; V274-E278 PolarHBondContact O-N 3.35Å; R275-E278 VanDerWaalsContact CD-OE2 3.31Å; R275-E278 WeakPolarHBondContact CD-OE2 3.28Å; R275-E278 IonicContact CZ-OE2 2.96Å; R275-E278 IonicContact NE-OE2 3.89Å; R275-E278 IonicContact NH1-OE1 2.68Å; R275-E278 IonicContact NH1-OE2 3.88Å; R275-E278 PolarHBondContact NH1-OE2 3.34Å; E278-V281 PolarHBondContact O-N 2.83Å; E278-A282 WeakPolarHBondContact O-CB 3.38Å; E278-A282 PolarHBondContact O-N 2.82Å
279	K	85	Confident	85.8	Confident	115 Å²	115	78.4 Å²	78.4	50%	0.5	39%	0.392	S	S	.	.	H	α-helix	trans	-64.3	-47.1	177.1	-172.6	-174.1	173.3	-163.4	0	111.9	R275 L276 C277 V281 A282 D283	R275-K279 WeakPolarHBondContact O-CB 3.41Å; R275-K279 PolarHBondContact O-N 3.04Å; R275-K279 VanDerWaalsContact O-N 3.09Å; L276-K279 PolarHBondContact O-N 3.39Å; C277-K279 VanDerWaalsContact C-N 3.26Å; C277-K279 PolarHBondContact O-N 3.09Å; K279-V281 VanDerWaalsContact C-N 3.28Å; K279-V281 PolarHBondContact O-N 2.92Å; K279-A282 PolarHBondContact O-N 2.9Å; K279-A282 VanDerWaalsContact O-N 3.16Å; K279-D283 VanDerWaalsContact O-CG 3.26Å; K279-D283 PolarHBondContact O-N 2.79Å
280	A	83.6	Confident	85.3	Confident	48 Å²	48	81 Å²	81	40%	0.397	41%	0.413	S	S	.	.	H	α-helix	trans	-61.1	-37.6	178.6	0	0	0	0	0	112.3	L276 C277 R284	L276-A280 PolarHBondContact O-N 3.39Å; C277-A280 PolarHBondContact O-N 2.83Å; A280-R284 WeakPolarHBondContact O-CB 3.48Å; A280-R284 PolarHBondContact O-N 3.46Å
281	V	86.7	Confident	84.7	Confident	79 Å²	79	84.1 Å²	84.1	48%	0.479	43%	0.426	S	S	.	.	H	α-helix	trans	-67.6	-42.1	174.4	172.2	0	0	0	0	111.2	C277 E278 K279 R284 K285	C277-V281 WeakPolarHBondContact O-CG2 3.26Å; C277-V281 PolarHBondContact O-N 3.14Å; E278-V281 PolarHBondContact O-N 2.83Å; K279-V281 VanDerWaalsContact C-N 3.28Å; K279-V281 PolarHBondContact O-N 2.92Å; V281-R284 PolarHBondContact O-N 2.76Å; V281-K285 HydrophobicContact CG1-CD 4.38Å; V281-K285 WeakPolarHBondContact O-CG 3.44Å; V281-K285 PolarHBondContact O-N 3.23Å
282	A	86.4	Confident	84.1	Confident	42 Å²	42	84.9 Å²	84.9	35%	0.347	43%	0.434	S	S	.	.	H	α-helix	trans	-62.9	-43.9	176.3	0	0	0	0	0	111.9	E278 K279 K285 Q286	E278-A282 WeakPolarHBondContact O-CB 3.38Å; E278-A282 PolarHBondContact O-N 2.82Å; K279-A282 PolarHBondContact O-N 2.9Å; K279-A282 VanDerWaalsContact O-N 3.16Å; A282-K285 PolarHBondContact O-N 2.96Å; A282-Q286 WeakPolarHBondContact O-CG 3.28Å; A282-Q286 PolarHBondContact O-N 3.03Å
283	D	83.2	Confident	83.4	Confident	64 Å²	64	88.3 Å²	88.3	34%	0.342	46%	0.458	S	S	.	.	H	α-helix	trans	-64	-42.1	177.5	-66.6	-13.4	0	0	0	110.5	K279 K285 Q286 M287	K279-D283 VanDerWaalsContact O-CG 3.26Å; K279-D283 PolarHBondContact O-N 2.79Å; D283-K285 VanDerWaalsContact C-N 3.35Å; D283-K285 PolarHBondContact O-N 2.84Å; D283-Q286 PolarHBondContact O-N 2.89Å; D283-M287 WeakPolarHBondContact O-CG 3.47Å; D283-M287 PolarHBondContact O-N 2.88Å
284	R	84.7	Confident	82.5	Confident	169 Å²	169	93.8 Å²	93.8	64%	0.638	49%	0.489	S	S	*	.	H	α-helix	trans	-62.4	-39	174.4	-170.9	178.9	-173.8	-167	2.5	112.5	A280 V281 K288	A280-R284 WeakPolarHBondContact O-CB 3.48Å; A280-R284 PolarHBondContact O-N 3.46Å; V281-R284 PolarHBondContact O-N 2.76Å; R284-K288 WeakPolarHBondContact O-CG 3.21Å; R284-K288 PolarHBondContact O-N 3.31Å; R284-K288 VanDerWaalsContact O-N 3.11Å
285	K	87.4	Confident	81.2	Confident	140 Å²	140	101 Å²	101	61%	0.609	51%	0.509	S	S	*	.	H	α-helix	trans	-64.8	-42.8	174.8	-74.3	177.1	-179.2	-176.7	0	111	V281 A282 D283 K288 C289	V281-K285 HydrophobicContact CG1-CD 4.38Å; V281-K285 WeakPolarHBondContact O-CG 3.44Å; V281-K285 PolarHBondContact O-N 3.23Å; A282-K285 PolarHBondContact O-N 2.96Å; D283-K285 VanDerWaalsContact C-N 3.35Å; D283-K285 PolarHBondContact O-N 2.84Å; K285-K288 PolarHBondContact O-N 3.49Å; K285-C289 PolarHBondContact O-N 2.88Å; K285-C289 PolarHBondContact O-SG 3.41Å
286	Q	83.7	Confident	79.6	Confident	134 Å²	134	104.7 Å²	104.7	63%	0.626	54%	0.542	S	S	*	.	H	α-helix	trans	-65.1	-41.5	177.5	-71.7	178.6	9.6	0	0	112.7	A282 D283 C289 A290	A282-Q286 WeakPolarHBondContact O-CG 3.28Å; A282-Q286 PolarHBondContact O-N 3.03Å; D283-Q286 PolarHBondContact O-N 2.89Å; Q286-C289 PolarHBondContact O-N 3.31Å; Q286-A290 PolarHBondContact O-N 3.24Å
287	M	79.3	Confident	79.3	Confident	127 Å²	127	108.4 Å²	108.4	63%	0.626	56%	0.561	S	S	*	*	H	α-helix	trans	-61.1	-45.9	175.1	-72.1	176.8	179.3	0	0	111.6	D283 C289 A290 E291	D283-M287 WeakPolarHBondContact O-CG 3.47Å; D283-M287 PolarHBondContact O-N 2.88Å; M287-C289 VanDerWaalsContact C-N 3.33Å; M287-C289 PolarHBondContact O-N 3.48Å; M287-A290 PolarHBondContact O-N 3.34Å; M287-A290 VanDerWaalsContact O-N 3.17Å; M287-E291 WeakPolarHBondContact O-CG 3.49Å; M287-E291 PolarHBondContact O-N 2.72Å
288	K	83.4	Confident	78.9	Confident	115 Å²	115	112 Å²	112	50%	0.5	58%	0.577	S	S	.	*	H	α-helix	trans	-59.4	-41.9	175.3	-74.9	-175.8	175.4	-166.2	0	112.5	R284 K285 E291 T292	R284-K288 WeakPolarHBondContact O-CG 3.21Å; R284-K288 PolarHBondContact O-N 3.31Å; R284-K288 VanDerWaalsContact O-N 3.11Å; K285-K288 PolarHBondContact O-N 3.49Å; K288-E291 PolarHBondContact O-N 2.82Å; K288-T292 WeakPolarHBondContact O-CG2 3.09Å; K288-T292 PolarHBondContact O-N 2.99Å; K288-T292 VanDerWaalsContact O-N 3.12Å; K288-T292 PolarHBondContact O-OG1 2.95Å
289	C	80.3	Confident	78.5	Confident	78 Å²	78	112.6 Å²	112.6	53%	0.527	58%	0.583	S	S	.	*	H	α-helix	trans	-65.2	-39.1	175.9	-65.7	0	0	0	0	112.3	K285 Q286 M287 T292 T293	K285-C289 PolarHBondContact O-N 2.88Å; K285-C289 PolarHBondContact O-SG 3.41Å; Q286-C289 PolarHBondContact O-N 3.31Å; M287-C289 VanDerWaalsContact C-N 3.33Å; M287-C289 PolarHBondContact O-N 3.48Å; C289-T292 WeakPolarHBondContact CA-OG1 3.45Å; C289-T292 PolarHBondContact O-N 2.87Å; C289-T292 PolarHBondContact O-OG1 2.85Å; C289-T293 PolarHBondContact O-N 3.24Å; C289-T293 VanDerWaalsContact O-N 3.08Å; C289-T293 PolarHBondContact O-OG1 3.37Å
290	A	78.7	Confident	78.1	Confident	53 Å²	53	112.5 Å²	112.5	44%	0.438	59%	0.588	S	S	.	*	H	α-helix	trans	-67.5	-38.5	177.6	0	0	0	0	0	112.3	Q286 M287 T292 T293 N294	Q286-A290 PolarHBondContact O-N 3.24Å; M287-A290 PolarHBondContact O-N 3.34Å; M287-A290 VanDerWaalsContact O-N 3.17Å; A290-T292 VanDerWaalsContact C-N 3.34Å; A290-T293 PolarHBondContact O-N 3.17Å; A290-N294 PolarHBondContact O-N 3.17Å; A290-N294 VanDerWaalsContact O-N 3.11Å
291	E	78.9	Confident	77.7	Confident	122 Å²	122	116.5 Å²	116.5	57%	0.57	60%	0.6	S	S	*	*	H	α-helix	trans	-63.5	-38	174	-73.9	173.2	-175.9	0	0	112.2	M287 K288 R295	M287-E291 WeakPolarHBondContact O-CG 3.49Å; M287-E291 PolarHBondContact O-N 2.72Å; K288-E291 PolarHBondContact O-N 2.82Å; E291-R295 WeakPolarHBondContact O-CG 3.28Å
292	T	75.6	Confident	77.1	Confident	92 Å²	92	119 Å²	119	56%	0.564	61%	0.608	S	S	*	*	H	α-helix	trans	-70.8	-36.2	176.4	50	0	0	0	0	112.8	K288 C289 A290 R295	K288-T292 WeakPolarHBondContact O-CG2 3.09Å; K288-T292 PolarHBondContact O-N 2.99Å; K288-T292 VanDerWaalsContact O-N 3.12Å; K288-T292 PolarHBondContact O-OG1 2.95Å; C289-T292 WeakPolarHBondContact CA-OG1 3.45Å; C289-T292 PolarHBondContact O-N 2.87Å; C289-T292 PolarHBondContact O-OG1 2.85Å; A290-T292 VanDerWaalsContact C-N 3.34Å; T292-R295 PolarHBondContact O-N 2.89Å
293	T	73.2	Confident	76.5	Confident	98 Å²	98	124.5 Å²	124.5	60%	0.601	63%	0.626	S	S	*	*	H	α-helix	trans	-73	-33	179.8	-52.7	0	0	0	0	112.6	C289 A290 R295	C289-T293 PolarHBondContact O-N 3.24Å; C289-T293 VanDerWaalsContact O-N 3.08Å; C289-T293 PolarHBondContact O-OG1 3.37Å; A290-T293 PolarHBondContact O-N 3.17Å; T293-R295 VanDerWaalsContact C-N 3.26Å; T293-R295 PolarHBondContact O-N 2.91Å
294	N	67.9	Low	75.9	Confident	146 Å²	146	129.2 Å²	129.2	78%	0.781	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-8.9	176.8	-85.3	-14.7	0	0	0	114	A290	A290-N294 PolarHBondContact O-N 3.17Å; A290-N294 VanDerWaalsContact O-N 3.11Å
295	R	61.7	Low	75.2	Confident	222 Å²	222	125.8 Å²	125.8	84%	0.838	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	0.5	178.6	-75.8	-176.5	176.4	-176.1	0.9	113.8	E291 T292 T293	E291-R295 WeakPolarHBondContact O-CG 3.28Å; T292-R295 PolarHBondContact O-N 2.89Å; T293-R295 VanDerWaalsContact C-N 3.26Å; T293-R295 PolarHBondContact O-N 2.91Å
296	V	52.6	Low	74.1	Confident	183 Å²	183	124.5 Å²	124.5	100%	1.109	65%	0.653	S	S	*	*			trans	-111.5	0	175.2	-178	0	0	0	0	108.9

Retrieved 296 of 296 residues in 123.3 ms (Link to these results)

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