A0A087XZ42_POEFO Loading...

Endoplasmic reticulum protein SC65

Part of a complex composed of PLOD1, P3H3 and P3H4 that catalyzes hydroxylation of lysine residues in collagen alpha chains and is required for normal assembly and cross-linking of collagen fibrils. Required for normal bone density and normal skin stability via its role in hydroxylation of lysine residues in collagen alpha chains and in collagen fibril assembly.

AlphaFold DB , UniProt , Accession A0A087XZ42, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 426 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	40.8	Very low	34.5	Very low	256 Å²	256	162.2 Å²	162.2	100%	1.261	87%	0.867	S	S	*	*				0	114.5	0	-155.4	154	169.9	0	0	106.6
2	G	36.1	Very low	34.4	Very low	77 Å²	77	156.3 Å²	156.3	79%	0.794	86%	0.858	S	S	*	*			trans	134.4	72.4	-174.3	0	0	0	0	0	112.4
3	M	32.1	Very low	34.2	Very low	176 Å²	176	155.1 Å²	155.1	87%	0.867	85%	0.849	S	S	*	*			trans	-71.7	130.5	167.7	-69.9	162.9	59.1	0	0	109
4	M	32.5	Very low	34	Very low	192 Å²	192	155.9 Å²	155.9	95%	0.946	85%	0.85	S	S	*	*			trans	-104.9	118	164.4	-77.3	-164.6	165	0	0	109.1
5	L	33.8	Very low	33.7	Very low	153 Å²	153	154.9 Å²	154.9	80%	0.801	84%	0.84	S	S	*	*			trans	-66.4	149.1	170.8	-96.2	82.9	0	0	0	111.2
6	P	35.6	Very low	33.6	Very low	116 Å²	116	151.5 Å²	151.5	75%	0.753	83%	0.828	S	S	*	*			trans	-82.3	150.4	163.7	34	-29.2	0	0	0	111.4	N8	P6-N8 PolarHBondContact O-N 3.33Å
7	R	35.9	Very low	33.2	Very low	239 Å²	239	154.8 Å²	154.8	90%	0.902	83%	0.833	S	S	*	*			trans	-75.5	110.2	-173.7	-169.6	172.6	167.7	178.5	-4	110	L9	R7-L9 PolarHBondContact O-N 3.22Å
8	N	32.7	Very low	33.2	Very low	155 Å²	155	154 Å²	154	83%	0.829	83%	0.828	S	S	*	*			trans	-68.3	117.1	172.9	-87.4	-16.4	0	0	0	110.6	P6 C10	P6-N8 PolarHBondContact O-N 3.33Å; N8-C10 PolarHBondContact O-N 3.42Å
9	L	36.3	Very low	33.4	Very low	151 Å²	151	152.7 Å²	152.7	79%	0.791	83%	0.825	S	S	*	*			trans	-72.3	106.7	162.4	-119.7	81.8	0	0	0	107.8	R7 L11	R7-L9 PolarHBondContact O-N 3.22Å; L9-L11 PolarHBondContact O-N 3.48Å
10	C	31.7	Very low	33.5	Very low	123 Å²	123	153.9 Å²	153.9	83%	0.831	83%	0.825	S	S	*	*			trans	-77.4	98.8	164.4	-76.8	0	0	0	0	108.4	N8 A12	N8-C10 PolarHBondContact O-N 3.42Å; C10-A12 PolarHBondContact O-N 3.03Å; C10-A12 VanDerWaalsContact O-N 3.13Å
11	L	32.4	Very low	33.8	Very low	146 Å²	146	149 Å²	149	76%	0.764	81%	0.806	S	S	*	*			trans	-67.4	99.7	158.2	-98.4	124.4	0	0	0	107.4	L9 L13	L9-L11 PolarHBondContact O-N 3.48Å; L11-L13 VanDerWaalsContact C-N 3.34Å; L11-L13 PolarHBondContact O-N 3.41Å
12	A	33.1	Very low	34.2	Very low	92 Å²	92	138.8 Å²	138.8	76%	0.76	76%	0.755	S	S	*	*			trans	-68.3	96.3	165.4	0	0	0	0	0	108	C10 L14	C10-A12 PolarHBondContact O-N 3.03Å; C10-A12 VanDerWaalsContact O-N 3.13Å; A12-L14 PolarHBondContact O-N 3.04Å
13	L	31.9	Very low	35	Very low	140 Å²	140	136.8 Å²	136.8	73%	0.733	72%	0.724	S	S	*	*			trans	-64.4	99.5	164	-96.1	143.3	0	0	0	107.7	L11 M15	L11-L13 VanDerWaalsContact C-N 3.34Å; L11-L13 PolarHBondContact O-N 3.41Å; L13-M15 HydrophobicContact CD2-SD 4.34Å; L13-M15 PolarHBondContact O-N 2.82Å
14	L	31.8	Very low	36.2	Very low	166 Å²	166	136.8 Å²	136.8	87%	0.869	72%	0.722	S	S	*	*			trans	-67.5	87.7	160.4	-78.7	162	0	0	0	107.2	A12 P16	A12-L14 PolarHBondContact O-N 3.04Å; L14-P16 WeakPolarHBondContact O-CD 3.27Å
15	M	28.6	Very low	37.6	Very low	142 Å²	142	134.8 Å²	134.8	70%	0.7	71%	0.708	S	S	*	*			trans	-70.5	118.7	164.3	-67.9	-67.3	-97.2	0	0	106.7	L13 F17	L13-M15 HydrophobicContact CD2-SD 4.34Å; L13-M15 PolarHBondContact O-N 2.82Å; M15-F17 PolarHBondContact O-N 3.14Å
16	P	32.1	Very low	39.9	Very low	100 Å²	100	129.3 Å²	129.3	65%	0.649	68%	0.677	S	S	*	*			trans	-64.1	123.2	166.8	27.3	-28.9	0	0	0	106.6	L14 L18	L14-P16 WeakPolarHBondContact O-CD 3.27Å; P16-L18 PolarHBondContact O-N 3.42Å
17	F	27.9	Very low	42.2	Very low	208 Å²	208	125.7 Å²	125.7	91%	0.912	65%	0.654	S	S	*	*			trans	-62.1	94.7	162	-75.9	-85.4	0	0	0	106.5	M15 V19	M15-F17 PolarHBondContact O-N 3.14Å; F17-V19 PolarHBondContact O-N 3.29Å
18	L	32.7	Very low	44.5	Very low	140 Å²	140	117 Å²	117	73%	0.733	62%	0.623	S	S	*	*			trans	-66.9	119.5	162.5	-74.2	163.9	0	0	0	105.3	P16 E20	P16-L18 PolarHBondContact O-N 3.42Å; L18-E20 PolarHBondContact O-N 2.82Å
19	V	36.9	Very low	47	Very low	130 Å²	130	119.2 Å²	119.2	79%	0.788	63%	0.625	S	S	*	*			trans	-63.4	106	165.7	176.5	0	0	0	0	105.8	F17 A21	F17-V19 PolarHBondContact O-N 3.29Å; V19-A21 PolarHBondContact O-N 3.37Å; V19-A21 VanDerWaalsContact O-N 3.09Å
20	E	35.3	Very low	49.4	Very low	175 Å²	175	115.9 Å²	115.9	82%	0.818	62%	0.615	S	S	*	*			trans	-75.8	91.7	179.2	-91.5	161	158.9	0	0	109.7	L18	L18-E20 PolarHBondContact O-N 2.82Å
21	A	40.4	Very low	52.1	Low	51 Å²	51	111.4 Å²	111.4	42%	0.421	58%	0.581	S	S	.	*			trans	-83	128	166.9	0	0	0	0	0	110.8	V19 Y23 I192	V19-A21 PolarHBondContact O-N 3.37Å; V19-A21 VanDerWaalsContact O-N 3.09Å; A21-Y23 PolarHBondContact O-N 3.28Å; A21-I192 HydrophobicContact CB-CG2 3.64Å
22	Q	49.3	Very low	54.9	Low	43 Å²	43	106 Å²	106	20%	0.201	56%	0.555	C	S	.	*	S	Bend	trans	-81.8	93.9	-155.8	-164.4	-169.8	-51.9	0	0	115.9	E24 H194	Q22-E24 HydrophobicContact CG-CG 4.42Å; Q22-H194 VanDerWaalsContact CB-CE1 3.47Å; Q22-H194 WeakPolarHBondContact CB-CE1 3.37Å; Q22-H194 PolarHBondContact N-ND1 2.95Å
23	Y	52.2	Low	57.5	Low	35 Å²	35	109.7 Å²	109.7	14%	0.137	56%	0.556	C	S	.	*			trans	-138	72.5	137.7	-69.1	-66.6	0	0	0	107.5	A21 K25 Y26 E63 L66 R67 Y141 H194	A21-Y23 PolarHBondContact O-N 3.28Å; Y23-K25 PolarHBondContact O-N 3.45Å; Y23-Y26 PolarHBondContact O-N 3.27Å; Y23-E63 HydrophobicContact CE1-CB 4.37Å; Y23-E63 HydrophobicContact CE1-CG 4.24Å; Y23-L66 HydrophobicContact CE1-CB 4.42Å; Y23-L66 HydrophobicContact CE1-CD1 4.38Å; Y23-L66 WeakPolarHBondContact OH-CD1 3.48Å; Y23-R67 HydrophobicContact CD1-CG 4.31Å; Y23-R67 HydrophobicContact CG-CG 4.44Å; Y23-Y141 WeakPolarHBondContact CE2-OH 3.49Å; Y23-Y141 WeakPolarHBondContact OH-CE1 3.31Å; Y23-Y141 PolarHBondContact OH-OH 2.86Å; Y23-H194 HydrophobicContact CE2-CB 3.78Å
24	E	58	Low	60.3	Low	176 Å²	176	112 Å²	112	82%	0.822	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.2	-3.1	-164.8	-65.2	177.2	164.4	0	0	117.2	Q22	Q22-E24 HydrophobicContact CG-CG 4.42Å
25	K	61.8	Low	63.2	Low	149 Å²	149	105.7 Å²	105.7	65%	0.648	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.6	5.2	-178.8	-59.9	179.4	-173.2	168.4	0	114	Y23 S27	Y23-K25 PolarHBondContact O-N 3.45Å; K25-S27 PolarHBondContact O-N 3.09Å
26	Y	82.1	Confident	66.3	Low	39 Å²	39	100.3 Å²	100.3	15%	0.153	50%	0.501	C	S	.	.			trans	-74.6	119.5	173.8	-179.5	-104.4	0	0	0	110.1	Y23 F31 R70 L71 D74	Y23-Y26 PolarHBondContact O-N 3.27Å; Y26-F31 HydrophobicContact CD2-CD2 4.2Å; Y26-F31 HydrophobicContact CD2-CE2 4.4Å; Y26-F31 HydrophobicContact CE2-CD2 4.28Å; Y26-R70 HydrophobicContact CD1-CG 4.43Å; Y26-R70 HydrophobicContact CE1-CG 3.86Å; Y26-R70 VanDerWaalsContact CE1-NE 3.29Å; Y26-R70 HydrophobicContact CE2-CB 4.28Å; Y26-R70 HydrophobicContact CE2-CG 4.14Å; Y26-L71 HydrophobicContact CE2-CB 4.11Å; Y26-D74 WeakPolarHBondContact CE1-OD2 3.27Å; Y26-D74 WeakPolarHBondContact OH-CB 2.99Å; Y26-D74 VanDerWaalsContact OH-CG 3.31Å; Y26-D74 PolarHBondContact OH-OD2 2.96Å
27	S	83.5	Confident	69.3	Low	39 Å²	39	97.8 Å²	97.8	27%	0.273	48%	0.481	S	S	.	.			trans	-140.1	119.1	168.8	167.3	0	0	0	0	107.2	K25 K29 S30 F31	K25-S27 PolarHBondContact O-N 3.09Å; S27-K29 PolarHBondContact O-N 3.26Å; S27-K29 PolarHBondContact OG-N 3.39Å; S27-S30 WeakPolarHBondContact CB-OG 3.37Å; S27-S30 CarbonylContact O-C 3.38Å; S27-S30 PolarHBondContact O-N 2.77Å; S27-S30 VanDerWaalsContact O-N 3.11Å; S27-S30 PolarHBondContact OG-N 3.49Å; S27-S30 VanDerWaalsContact OG-N 3.12Å; S27-S30 PolarHBondContact OG-OG 3.41Å; S27-F31 PolarHBondContact O-N 3.21Å
28	F	84.8	Confident	72.5	Confident	58 Å²	58	89.8 Å²	89.8	25%	0.254	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-37.3	175.6	177.7	-113.6	0	0	0	112	L71 D74 F78 F119	F28-L71 HydrophobicContact CD2-CD1 4.19Å; F28-D74 HydrophobicContact CD2-CB 3.64Å; F28-D74 HydrophobicContact CE2-CB 3.87Å; F28-D74 HydrophobicContact CG-CB 4.47Å; F28-F78 HydrophobicContact CE1-CB 4.35Å; F28-F78 HydrophobicContact CE1-CD2 4.05Å; F28-F78 HydrophobicContact CE1-CG 4.17Å; F28-F78 HydrophobicContact CZ-CB 3.8Å; F28-F78 HydrophobicContact CZ-CD1 4.48Å; F28-F78 HydrophobicContact CZ-CD2 4.3Å; F28-F78 AromaticContact CZ-CG 3.95Å; F28-F78 HydrophobicContact CZ-CG 3.95Å; F28-F119 HydrophobicContact CE1-CE1 4.23Å; F28-F119 AromaticContact CE2-CE1 3.98Å; F28-F119 HydrophobicContact CE2-CE1 3.98Å; F28-F119 HydrophobicContact CZ-CD1 4.44Å; F28-F119 AromaticContact CZ-CE1 3.5Å; F28-F119 HydrophobicContact CZ-CE1 3.5Å; F28-F119 VanDerWaalsContact CZ-CE1 3.5Å; F28-F119 AromaticContact CZ-CZ 3.91Å; F28-F119 HydrophobicContact CZ-CZ 3.91Å
29	K	84.6	Confident	75.5	Confident	201 Å²	201	83.7 Å²	83.7	87%	0.874	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-23.1	-179.1	-67.3	-177.7	178.7	178.2	0	113.9	S27	S27-K29 PolarHBondContact O-N 3.26Å; S27-K29 PolarHBondContact OG-N 3.39Å
30	S	86.7	Confident	78.3	Confident	81 Å²	81	80 Å²	80	57%	0.566	39%	0.392	S	S	*	.	S	Bend	trans	-139.9	51.4	-170.6	67.1	0	0	0	0	111.6	S27	S27-S30 WeakPolarHBondContact CB-OG 3.37Å; S27-S30 CarbonylContact O-C 3.38Å; S27-S30 PolarHBondContact O-N 2.77Å; S27-S30 VanDerWaalsContact O-N 3.11Å; S27-S30 PolarHBondContact OG-N 3.49Å; S27-S30 VanDerWaalsContact OG-N 3.12Å; S27-S30 PolarHBondContact OG-OG 3.41Å
31	F	89.1	Confident	81.2	Confident	29 Å²	29	74.4 Å²	74.4	13%	0.127	37%	0.372	C	S	.	.			trans	-65.9	132	174.4	-167.1	-83.1	0	0	0	110.1	Y26 S27 Q33 D35 M36 L64 R67 L68 L71	Y26-F31 HydrophobicContact CD2-CD2 4.2Å; Y26-F31 HydrophobicContact CD2-CE2 4.4Å; Y26-F31 HydrophobicContact CE2-CD2 4.28Å; S27-F31 PolarHBondContact O-N 3.21Å; F31-Q33 PolarHBondContact O-N 2.78Å; F31-D35 HydrophobicContact CE1-CB 3.86Å; F31-D35 HydrophobicContact CZ-CB 4.37Å; F31-M36 HydrophobicContact CD1-CG 4.11Å; F31-M36 HydrophobicContact CD1-SD 3.28Å; F31-M36 WeakPolarHBondContact CD1-SD 3.5Å; F31-M36 HydrophobicContact CE1-CG 4.25Å; F31-M36 HydrophobicContact CE1-SD 3.47Å; F31-M36 WeakPolarHBondContact CE1-SD 3.41Å; F31-M36 HydrophobicContact CG-SD 4.21Å; F31-M36 HydrophobicContact CZ-SD 4.49Å; F31-L64 HydrophobicContact CZ-CD1 4.45Å; F31-R67 HydrophobicContact CE2-CB 3.95Å; F31-R67 HydrophobicContact CZ-CB 4.42Å; F31-L68 HydrophobicContact CE1-CD2 3.97Å; F31-L68 HydrophobicContact CZ-CD2 3.65Å; F31-L68 HydrophobicContact CZ-CG 4.12Å; F31-L71 HydrophobicContact CB-CD1 4.26Å; F31-L71 HydrophobicContact CB-CD2 4.1Å; F31-L71 HydrophobicContact CD1-CD2 4.05Å; F31-L71 HydrophobicContact CD2-CB 4.16Å; F31-L71 HydrophobicContact CD2-CD1 4.27Å; F31-L71 HydrophobicContact CD2-CD2 3.74Å; F31-L71 HydrophobicContact CD2-CG 4.28Å; F31-L71 HydrophobicContact CE1-CD2 4.41Å; F31-L71 HydrophobicContact CE2-CB 4.22Å; F31-L71 HydrophobicContact CE2-CD2 4.1Å; F31-L71 HydrophobicContact CG-CD1 4.48Å; F31-L71 HydrophobicContact CG-CD2 3.7Å; F31-L71 HydrophobicContact CZ-CD2 4.44Å
32	P	90.4	Very high	83.9	Confident	33 Å²	33	72 Å²	72	21%	0.214	35%	0.352	C	S	.	.			trans	-62.4	119.8	-177.4	-21.7	32.4	0	0	0	112.4	K34 D35	P32-K34 HydrophobicContact CB-CG 4.25Å; P32-K34 PolarHBondContact O-N 3.43Å; P32-D35 HydrophobicContact CB-CB 4.14Å; P32-D35 WeakPolarHBondContact O-CB 3.37Å; P32-D35 PolarHBondContact O-N 2.98Å
33	Q	88.1	Confident	86.2	Confident	169 Å²	169	70.6 Å²	70.6	79%	0.79	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-62.5	-29.8	-176.1	-165.7	173.4	3.6	0	0	113.5	F31 D35 M36	F31-Q33 PolarHBondContact O-N 2.78Å; Q33-D35 PolarHBondContact O-N 3.32Å; Q33-M36 WeakPolarHBondContact O-CB 3.41Å; Q33-M36 PolarHBondContact O-N 2.86Å
34	K	90.8	Very high	88.4	Confident	188 Å²	188	71.9 Å²	71.9	82%	0.817	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-67.6	-21.1	175.2	63	170.5	-169.1	176.2	0	114	P32	P32-K34 HydrophobicContact CB-CG 4.25Å; P32-K34 PolarHBondContact O-N 3.43Å
35	D	91.8	Very high	90.3	Very high	33 Å²	33	67.2 Å²	67.2	18%	0.176	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-92.7	-2.9	179.9	-71.5	11.2	0	0	0	110.5	F31 P32 Q33 M37 L64 R67	F31-D35 HydrophobicContact CE1-CB 3.86Å; F31-D35 HydrophobicContact CZ-CB 4.37Å; P32-D35 HydrophobicContact CB-CB 4.14Å; P32-D35 WeakPolarHBondContact O-CB 3.37Å; P32-D35 PolarHBondContact O-N 2.98Å; Q33-D35 PolarHBondContact O-N 3.32Å; D35-M37 PolarHBondContact O-N 3.43Å; D35-L64 HydrophobicContact CB-CD1 3.71Å; D35-L64 WeakPolarHBondContact O-CD1 3.5Å; D35-R67 IonicContact OD2-CZ 3.08Å; D35-R67 IonicContact OD2-NH1 2.67Å; D35-R67 PolarHBondContact OD2-NH1 3.48Å; D35-R67 IonicContact OD2-NH2 2.84Å; D35-R67 PolarHBondContact OD2-NH2 3.47Å
36	M	93.3	Very high	92.1	Very high	30 Å²	30	60.1 Å²	60.1	15%	0.148	30%	0.299	C	S	.	.			trans	-74.2	119.5	-179.7	-68.6	-61.9	-48.1	0	0	111.3	F31 Q33 L68 L71 P120 V121 F124	F31-M36 HydrophobicContact CD1-CG 4.11Å; F31-M36 HydrophobicContact CD1-SD 3.28Å; F31-M36 WeakPolarHBondContact CD1-SD 3.5Å; F31-M36 HydrophobicContact CE1-CG 4.25Å; F31-M36 HydrophobicContact CE1-SD 3.47Å; F31-M36 WeakPolarHBondContact CE1-SD 3.41Å; F31-M36 HydrophobicContact CG-SD 4.21Å; F31-M36 HydrophobicContact CZ-SD 4.49Å; Q33-M36 WeakPolarHBondContact O-CB 3.41Å; Q33-M36 PolarHBondContact O-N 2.86Å; M36-L68 HydrophobicContact CE-CD2 4.48Å; M36-L68 HydrophobicContact SD-CD2 4.49Å; M36-L71 HydrophobicContact CE-CD2 4.04Å; M36-L71 HydrophobicContact SD-CD2 3.78Å; M36-P120 HydrophobicContact CE-CB 3.89Å; M36-P120 HydrophobicContact SD-CB 4.4Å; M36-V121 HydrophobicContact CE-CB 4.1Å; M36-F124 HydrophobicContact CB-CE2 4.14Å; M36-F124 HydrophobicContact CB-CZ 4.23Å; M36-F124 HydrophobicContact CE-CD2 4.35Å; M36-F124 HydrophobicContact CE-CE2 3.71Å
37	M	94.9	Very high	92.8	Very high	47 Å²	47	60.4 Å²	60.4	23%	0.232	30%	0.303	C	S	.	.			trans	-157.2	168.2	173.9	61.5	-175	-63.8	0	0	109.7	D35 L39 A42 Y61 L64 L68	D35-M37 PolarHBondContact O-N 3.43Å; M37-L39 PolarHBondContact O-N 3.33Å; M37-A42 HydrophobicContact CE-CB 3.97Å; M37-A42 HydrophobicContact CG-CB 4.06Å; M37-A42 HydrophobicContact SD-CB 3.82Å; M37-Y61 HydrophobicContact CE-CE1 4.14Å; M37-Y61 HydrophobicContact SD-CD1 4.33Å; M37-Y61 HydrophobicContact SD-CE1 3.81Å; M37-L64 HydrophobicContact CG-CD2 4.37Å; M37-L64 HydrophobicContact SD-CD2 3.68Å; M37-L68 HydrophobicContact CG-CD1 3.75Å
38	P	95.7	Very high	93.5	Very high	39 Å²	39	64.4 Å²	64.4	25%	0.253	32%	0.318	S	S	.	.			trans	-59.3	135.5	173.7	-20.8	32.3	0	0	0	111.2	E40 S41 A42 F124	P38-E40 VanDerWaalsContact C-N 3.3Å; P38-E40 PolarHBondContact O-N 3.35Å; P38-S41 PolarHBondContact O-N 2.92Å; P38-A42 PolarHBondContact O-N 3.01Å; P38-A42 VanDerWaalsContact O-N 3.1Å; P38-F124 HydrophobicContact CB-CB 4.41Å; P38-F124 HydrophobicContact CG-CB 4.25Å; P38-F124 HydrophobicContact CG-CD1 3.82Å; P38-F124 HydrophobicContact CG-CE1 4.48Å; P38-F124 HydrophobicContact CG-CG 4.16Å
39	L	95.5	Very high	94.2	Very high	12 Å²	12	63.3 Å²	63.3	6%	0.063	31%	0.313	C	S	.	.	H	α-helix	trans	-55.1	-46.6	-179.5	175.3	60.2	0	0	0	111.7	M37 S41 A42 Y43 S65 L68 H69 P127 L131 L132 F135	M37-L39 PolarHBondContact O-N 3.33Å; L39-S41 PolarHBondContact O-N 3.29Å; L39-A42 PolarHBondContact O-N 3.47Å; L39-Y43 PolarHBondContact O-N 3.22Å; L39-S65 WeakPolarHBondContact CD1-O 3.42Å; L39-L68 HydrophobicContact CD1-CB 3.97Å; L39-H69 HydrophobicContact CD1-CB 3.99Å; L39-H69 HydrophobicContact CD2-CB 4.01Å; L39-P127 HydrophobicContact CB-CG 4.05Å; L39-P127 HydrophobicContact CD2-CB 4.14Å; L39-P127 HydrophobicContact CD2-CG 3.8Å; L39-P127 HydrophobicContact CG-CG 4.48Å; L39-L131 HydrophobicContact CD2-CD2 4.45Å; L39-L131 HydrophobicContact CG-CD2 4.23Å; L39-L132 HydrophobicContact CD2-CD2 4.32Å; L39-F135 HydrophobicContact CD1-CE1 4.26Å; L39-F135 HydrophobicContact CD1-CE2 3.97Å; L39-F135 HydrophobicContact CD1-CZ 3.71Å; L39-F135 HydrophobicContact CD2-CD2 4.31Å; L39-F135 HydrophobicContact CD2-CE2 4.12Å; L39-F135 HydrophobicContact CG-CE2 4.12Å; L39-F135 HydrophobicContact CG-CZ 4.36Å
40	E	95.6	Very high	94.8	Very high	52 Å²	52	55.6 Å²	55.6	24%	0.243	28%	0.279	C	S	.	.	H	α-helix	trans	-61.8	-43.5	-179.7	-176	164.5	-158.3	0	0	112.3	P38 A42 Y43 N44 R128 L131	P38-E40 VanDerWaalsContact C-N 3.3Å; P38-E40 PolarHBondContact O-N 3.35Å; E40-A42 VanDerWaalsContact C-N 3.32Å; E40-A42 PolarHBondContact O-N 2.94Å; E40-Y43 PolarHBondContact O-N 3.13Å; E40-N44 WeakPolarHBondContact CG-ND2 3.43Å; E40-N44 WeakPolarHBondContact O-CB 3.41Å; E40-N44 PolarHBondContact O-N 3.01Å; E40-R128 IonicContact OE1-CZ 2.9Å; E40-R128 IonicContact OE1-NE 3.66Å; E40-R128 PolarHBondContact OE1-NE 3.5Å; E40-R128 IonicContact OE1-NH2 2.87Å; E40-R128 PolarHBondContact OE1-NH2 3.22Å; E40-R128 IonicContact OE2-NE 3.97Å; E40-L131 VanDerWaalsContact CA-CD2 3.5Å; E40-L131 HydrophobicContact CB-CD2 3.55Å; E40-L131 HydrophobicContact CG-CD2 3.97Å
41	S	96.9	Very high	95.3	Very high	58 Å²	58	55 Å²	55	41%	0.406	28%	0.279	S	S	.	.	H	α-helix	trans	-62.3	-40.2	176.4	-54.2	0	0	0	0	112	P38 L39 Y45	P38-S41 PolarHBondContact O-N 2.92Å; L39-S41 PolarHBondContact O-N 3.29Å; S41-Y45 VanDerWaalsContact O-CB 3.28Å; S41-Y45 WeakPolarHBondContact O-CB 3.45Å; S41-Y45 PolarHBondContact O-N 2.94Å; S41-Y45 VanDerWaalsContact O-N 3.13Å
42	A	97.3	Very high	95.8	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-65.3	-45.4	178	0	0	0	0	0	111.2	M37 P38 L39 E40 A46 Y61 L68	M37-A42 HydrophobicContact CE-CB 3.97Å; M37-A42 HydrophobicContact CG-CB 4.06Å; M37-A42 HydrophobicContact SD-CB 3.82Å; P38-A42 PolarHBondContact O-N 3.01Å; P38-A42 VanDerWaalsContact O-N 3.1Å; L39-A42 PolarHBondContact O-N 3.47Å; E40-A42 VanDerWaalsContact C-N 3.32Å; E40-A42 PolarHBondContact O-N 2.94Å; A42-A46 WeakPolarHBondContact O-CB 3.27Å; A42-A46 PolarHBondContact O-N 3.32Å; A42-A46 VanDerWaalsContact O-N 3.11Å; A42-Y61 HydrophobicContact CB-CD1 4.41Å; A42-L68 HydrophobicContact CB-CD1 3.85Å
43	Y	98.1	Very high	96.1	Very high	14 Å²	14	60.1 Å²	60.1	6%	0.055	31%	0.311	C	S	.	.	H	α-helix	trans	-67.2	-48.3	-179.1	-175.1	-116	0	0	0	112.1	L39 E40 Y45 A46 L47 L62 L131 T134 F135 P140 Y143	L39-Y43 PolarHBondContact O-N 3.22Å; E40-Y43 PolarHBondContact O-N 3.13Å; Y43-Y45 PolarHBondContact O-N 3Å; Y43-A46 WeakPolarHBondContact O-CA 3.34Å; Y43-A46 VanDerWaalsContact O-CB 3.29Å; Y43-A46 WeakPolarHBondContact O-CB 3.42Å; Y43-A46 PolarHBondContact O-N 3.49Å; Y43-L47 HydrophobicContact CD1-CD1 4.09Å; Y43-L47 HydrophobicContact CE1-CD1 3.59Å; Y43-L47 HydrophobicContact CE1-CG 4.29Å; Y43-L47 HydrophobicContact CE2-CD1 4.5Å; Y43-L47 HydrophobicContact CE2-CD2 4.3Å; Y43-L47 HydrophobicContact CE2-CG 4.4Å; Y43-L47 PolarHBondContact O-N 2.6Å; Y43-L62 HydrophobicContact CD2-CD2 4.04Å; Y43-L62 HydrophobicContact CE2-CD2 3.87Å; Y43-L131 HydrophobicContact CD1-CD1 3.42Å; Y43-L131 VanDerWaalsContact CD1-CD1 3.42Å; Y43-L131 HydrophobicContact CE1-CD1 3.89Å; Y43-L131 HydrophobicContact CG-CD1 4.08Å; Y43-T134 HydrophobicContact CE1-CG2 4.24Å; Y43-T134 WeakPolarHBondContact OH-CG2 3.33Å; Y43-F135 HydrophobicContact CD2-CE2 4.37Å; Y43-F135 AromaticContact CD2-CZ 3.95Å; Y43-F135 HydrophobicContact CD2-CZ 3.95Å; Y43-F135 HydrophobicContact CG-CE2 4.3Å; Y43-F135 HydrophobicContact CG-CZ 4.2Å; Y43-P140 HydrophobicContact CE2-CB 4.4Å; Y43-P140 HydrophobicContact CE2-CG 4.01Å; Y43-Y143 WeakPolarHBondContact OH-CE2 3.38Å
44	N	97.9	Very high	96.5	Very high	63 Å²	63	54.5 Å²	54.5	34%	0.337	29%	0.29	S	S	.	.	H	α-helix	trans	-61.6	-44.7	-179.9	-68.4	-7.4	0	0	0	111.6	E40 A46 L47 E48	E40-N44 WeakPolarHBondContact CG-ND2 3.43Å; E40-N44 WeakPolarHBondContact O-CB 3.41Å; E40-N44 PolarHBondContact O-N 3.01Å; N44-A46 VanDerWaalsContact C-N 3.26Å; N44-A46 PolarHBondContact O-N 3.12Å; N44-L47 PolarHBondContact O-N 3.24Å; N44-L47 VanDerWaalsContact O-N 3.13Å; N44-E48 WeakPolarHBondContact O-CG 3.49Å; N44-E48 PolarHBondContact O-N 3.1Å
45	Y	98.4	Very high	96.8	Very high	77 Å²	77	47 Å²	47	30%	0.302	26%	0.257	S	S	.	.	H	α-helix	trans	-59.4	-39.8	174.3	-179.5	-95	0	0	0	111.5	S41 Y43 L47 E48 Q49 E57 Y61	S41-Y45 VanDerWaalsContact O-CB 3.28Å; S41-Y45 WeakPolarHBondContact O-CB 3.45Å; S41-Y45 PolarHBondContact O-N 2.94Å; S41-Y45 VanDerWaalsContact O-N 3.13Å; Y43-Y45 PolarHBondContact O-N 3Å; Y45-L47 VanDerWaalsContact C-N 3.3Å; Y45-L47 PolarHBondContact O-N 3.09Å; Y45-E48 PolarHBondContact O-N 2.92Å; Y45-Q49 HydrophobicContact CD1-CG 4.08Å; Y45-Q49 HydrophobicContact CE1-CG 3.61Å; Y45-Q49 HydrophobicContact CE2-CG 4.38Å; Y45-Q49 WeakPolarHBondContact O-CG 3.48Å; Y45-Q49 PolarHBondContact O-N 2.88Å; Y45-E57 HydrophobicContact CE1-CG 4.02Å; Y45-Y61 AromaticContact CD1-CD1 3.69Å; Y45-Y61 HydrophobicContact CD1-CD1 3.69Å; Y45-Y61 AromaticContact CD1-CD2 3.46Å; Y45-Y61 HydrophobicContact CD1-CD2 3.46Å; Y45-Y61 VanDerWaalsContact CD1-CD2 3.46Å; Y45-Y61 AromaticContact CD1-CE1 3.82Å; Y45-Y61 HydrophobicContact CD1-CE1 3.82Å; Y45-Y61 AromaticContact CD1-CE2 3.57Å; Y45-Y61 HydrophobicContact CD1-CE2 3.57Å; Y45-Y61 AromaticContact CD1-CG 3.49Å; Y45-Y61 HydrophobicContact CD1-CG 3.49Å; Y45-Y61 VanDerWaalsContact CD1-CG 3.49Å; Y45-Y61 AromaticContact CD1-CZ 3.74Å; Y45-Y61 HydrophobicContact CE1-CD1 4.35Å; Y45-Y61 AromaticContact CE1-CD2 3.37Å; Y45-Y61 HydrophobicContact CE1-CD2 3.37Å; Y45-Y61 HydrophobicContact CE1-CE1 4.23Å; Y45-Y61 AromaticContact CE1-CE2 3.2Å; Y45-Y61 HydrophobicContact CE1-CE2 3.2Å; Y45-Y61 AromaticContact CE1-CG 3.94Å; Y45-Y61 HydrophobicContact CE1-CG 3.94Å; Y45-Y61 AromaticContact CE1-CZ 3.66Å
46	A	98.2	Very high	97.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.5	-37.6	177.3	0	0	0	0	0	112.8	A42 Y43 N44 Y50 S58 L62	A42-A46 WeakPolarHBondContact O-CB 3.27Å; A42-A46 PolarHBondContact O-N 3.32Å; A42-A46 VanDerWaalsContact O-N 3.11Å; Y43-A46 WeakPolarHBondContact O-CA 3.34Å; Y43-A46 VanDerWaalsContact O-CB 3.29Å; Y43-A46 WeakPolarHBondContact O-CB 3.42Å; Y43-A46 PolarHBondContact O-N 3.49Å; N44-A46 VanDerWaalsContact C-N 3.26Å; N44-A46 PolarHBondContact O-N 3.12Å; A46-Y50 WeakPolarHBondContact O-CB 3.46Å; A46-Y50 PolarHBondContact O-N 2.93Å; A46-S58 WeakPolarHBondContact O-CB 3.18Å; A46-S58 PolarHBondContact O-OG 3.4Å; A46-L62 HydrophobicContact CB-CB 4.46Å; A46-L62 HydrophobicContact CB-CD2 3.92Å; A46-L62 HydrophobicContact CB-CG 3.7Å
47	L	98.3	Very high	97.3	Very high	45 Å²	45	49.7 Å²	49.7	24%	0.236	28%	0.279	C	S	.	.	H	α-helix	trans	-72.2	-38.1	176.2	-64.3	-176.2	0	0	0	112.4	Y43 N44 Y45 Q49 Y50 A51 Y143	Y43-L47 HydrophobicContact CD1-CD1 4.09Å; Y43-L47 HydrophobicContact CE1-CD1 3.59Å; Y43-L47 HydrophobicContact CE1-CG 4.29Å; Y43-L47 HydrophobicContact CE2-CD1 4.5Å; Y43-L47 HydrophobicContact CE2-CD2 4.3Å; Y43-L47 HydrophobicContact CE2-CG 4.4Å; Y43-L47 PolarHBondContact O-N 2.6Å; N44-L47 PolarHBondContact O-N 3.24Å; N44-L47 VanDerWaalsContact O-N 3.13Å; Y45-L47 VanDerWaalsContact C-N 3.3Å; Y45-L47 PolarHBondContact O-N 3.09Å; L47-Q49 VanDerWaalsContact C-N 3.33Å; L47-Q49 PolarHBondContact O-N 3.01Å; L47-Y50 WeakPolarHBondContact O-CB 3.1Å; L47-Y50 PolarHBondContact O-N 2.97Å; L47-Y50 VanDerWaalsContact O-N 3.16Å; L47-A51 PolarHBondContact O-N 3.27Å; L47-Y143 HydrophobicContact CD2-CD1 4.08Å; L47-Y143 HydrophobicContact CD2-CD2 3.94Å; L47-Y143 HydrophobicContact CD2-CE1 4Å; L47-Y143 HydrophobicContact CD2-CE2 3.84Å; L47-Y143 HydrophobicContact CD2-CG 4.06Å
48	E	98.3	Very high	97.5	Very high	123 Å²	123	47.4 Å²	47.4	58%	0.575	27%	0.268	S	S	*	.	H	α-helix	trans	-59.6	-45	171.9	-71.5	173	-173.7	0	0	111.1	N44 Y45 Y50 A51 A52	N44-E48 WeakPolarHBondContact O-CG 3.49Å; N44-E48 PolarHBondContact O-N 3.1Å; Y45-E48 PolarHBondContact O-N 2.92Å; E48-Y50 VanDerWaalsContact C-N 3.3Å; E48-Y50 PolarHBondContact O-N 3.03Å; E48-A51 PolarHBondContact O-N 3.31Å; E48-A52 WeakPolarHBondContact O-CB 3.34Å; E48-A52 PolarHBondContact O-N 3.48Å
49	Q	98.3	Very high	97.5	Very high	36 Å²	36	45.9 Å²	45.9	17%	0.168	26%	0.258	C	S	.	.	H	α-helix	trans	-66.7	-32.7	175.4	-63.8	-45	-56.4	0	0	112.4	Y45 L47 A52 Q53 S54 E57	Y45-Q49 HydrophobicContact CD1-CG 4.08Å; Y45-Q49 HydrophobicContact CE1-CG 3.61Å; Y45-Q49 HydrophobicContact CE2-CG 4.38Å; Y45-Q49 WeakPolarHBondContact O-CG 3.48Å; Y45-Q49 PolarHBondContact O-N 2.88Å; L47-Q49 VanDerWaalsContact C-N 3.33Å; L47-Q49 PolarHBondContact O-N 3.01Å; Q49-A52 PolarHBondContact O-N 3.49Å; Q49-Q53 PolarHBondContact O-N 3.23Å; Q49-S54 PolarHBondContact O-N 3.47Å; Q49-E57 HydrophobicContact CG-CB 4.26Å; Q49-E57 HydrophobicContact CG-CG 4.11Å
50	Y	97.6	Very high	97.5	Very high	39 Å²	39	50.5 Å²	50.5	15%	0.153	28%	0.277	C	S	.	.	H	α-helix	trans	-63.6	-48.9	174.2	-171	-86.3	0	0	0	110.9	A46 L47 E48 A52 Q53 W55 S58 Y143 Y146 A147	A46-Y50 WeakPolarHBondContact O-CB 3.46Å; A46-Y50 PolarHBondContact O-N 2.93Å; L47-Y50 WeakPolarHBondContact O-CB 3.1Å; L47-Y50 PolarHBondContact O-N 2.97Å; L47-Y50 VanDerWaalsContact O-N 3.16Å; E48-Y50 VanDerWaalsContact C-N 3.3Å; E48-Y50 PolarHBondContact O-N 3.03Å; Y50-A52 VanDerWaalsContact C-N 3.26Å; Y50-A52 PolarHBondContact O-N 3.42Å; Y50-Q53 PolarHBondContact O-N 2.97Å; Y50-W55 HydrophobicContact CD1-CZ3 4.33Å; Y50-W55 HydrophobicContact CD2-CE3 4.24Å; Y50-W55 AromaticContact CD2-CZ3 3.83Å; Y50-W55 HydrophobicContact CD2-CZ3 3.83Å; Y50-W55 HydrophobicContact CE1-CZ3 4.25Å; Y50-W55 HydrophobicContact CE2-CE3 4.31Å; Y50-W55 AromaticContact CE2-CZ3 3.74Å; Y50-W55 HydrophobicContact CE2-CZ3 3.74Å; Y50-W55 HydrophobicContact CG-CZ3 4.14Å; Y50-W55 AromaticContact CZ-CZ3 3.97Å; Y50-S58 WeakPolarHBondContact CB-OG 3.45Å; Y50-Y143 HydrophobicContact CD1-CD1 4.18Å; Y50-Y143 HydrophobicContact CD2-CD1 4.17Å; Y50-Y143 AromaticContact CE1-CD1 3.97Å; Y50-Y143 HydrophobicContact CE1-CD1 3.97Å; Y50-Y143 HydrophobicContact CE1-CE1 4.45Å; Y50-Y143 AromaticContact CE2-CD1 3.95Å; Y50-Y143 HydrophobicContact CE2-CD1 3.95Å; Y50-Y143 HydrophobicContact CE2-CG 4.48Å; Y50-Y143 WeakPolarHBondContact CE2-O 3.37Å; Y50-Y143 HydrophobicContact CG-CD1 4.26Å; Y50-Y143 AromaticContact CZ-CD1 3.83Å; Y50-Y146 AromaticContact CE2-CD1 4Å; Y50-Y146 HydrophobicContact CE2-CD1 4Å; Y50-Y146 AromaticContact CZ-CD1 3.63Å; Y50-Y146 WeakPolarHBondContact OH-CB 3.42Å; Y50-Y146 WeakPolarHBondContact OH-CD1 3.41Å; Y50-A147 HydrophobicContact CD2-CB 4.42Å; Y50-A147 HydrophobicContact CE2-CB 4.31Å
51	A	97.8	Very high	97.6	Very high	69 Å²	69	50.4 Å²	50.4	57%	0.57	28%	0.275	S	S	*	.	H	α-helix	trans	-62.4	-34.8	177.3	0	0	0	0	0	112.2	L47 E48 Q53	L47-A51 PolarHBondContact O-N 3.27Å; E48-A51 PolarHBondContact O-N 3.31Å; A51-Q53 PolarHBondContact O-N 3.33Å
52	A	97.8	Very high	97.7	Very high	62 Å²	62	47.7 Å²	47.7	51%	0.512	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	2.3	174.4	0	0	0	0	0	114.4	E48 Q49 Y50 S54	E48-A52 WeakPolarHBondContact O-CB 3.34Å; E48-A52 PolarHBondContact O-N 3.48Å; Q49-A52 PolarHBondContact O-N 3.49Å; Y50-A52 VanDerWaalsContact C-N 3.26Å; Y50-A52 PolarHBondContact O-N 3.42Å; A52-S54 PolarHBondContact O-N 2.7Å
53	Q	96.8	Very high	97.6	Very high	106 Å²	106	49.8 Å²	49.8	50%	0.495	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.1	19.8	-176	-55.5	-179.1	11.4	0	0	114.4	Q49 Y50 A51 W55 F407	Q49-Q53 PolarHBondContact O-N 3.23Å; Y50-Q53 PolarHBondContact O-N 2.97Å; A51-Q53 PolarHBondContact O-N 3.33Å; Q53-W55 HydrophobicContact CB-CH2 4.38Å; Q53-W55 HydrophobicContact CB-CZ2 3.77Å; Q53-W55 HydrophobicContact CG-CH2 4.15Å; Q53-W55 HydrophobicContact CG-CZ2 3.77Å; Q53-W55 PolarHBondContact O-N 3.36Å; Q53-W55 PolarHBondContact O-NE1 3.28Å; Q53-F407 HydrophobicContact CG-CE2 4.49Å; Q53-F407 HydrophobicContact CG-CZ 3.78Å
54	S	97.9	Very high	97.5	Very high	51 Å²	51	49.8 Å²	49.8	36%	0.357	27%	0.266	S	S	.	.			trans	-81.3	64.7	173.1	-70.4	0	0	0	0	110.2	Q49 A52 A56 E57 S58	Q49-S54 PolarHBondContact O-N 3.47Å; A52-S54 PolarHBondContact O-N 2.7Å; S54-A56 PolarHBondContact O-N 3.45Å; S54-E57 PolarHBondContact O-N 3.38Å; S54-E57 VanDerWaalsContact O-N 3.14Å; S54-S58 PolarHBondContact O-N 3.1Å
55	W	97.5	Very high	97.4	Very high	32 Å²	32	46.8 Å²	46.8	12%	0.121	25%	0.25	C	S	.	.	H	α-helix	trans	-52.8	-45.7	-168.4	-52.8	119.4	0	0	0	114.1	Y50 Q53 E57 S58 V59 Y146 A147 Q150 L151 F407	Y50-W55 HydrophobicContact CD1-CZ3 4.33Å; Y50-W55 HydrophobicContact CD2-CE3 4.24Å; Y50-W55 AromaticContact CD2-CZ3 3.83Å; Y50-W55 HydrophobicContact CD2-CZ3 3.83Å; Y50-W55 HydrophobicContact CE1-CZ3 4.25Å; Y50-W55 HydrophobicContact CE2-CE3 4.31Å; Y50-W55 AromaticContact CE2-CZ3 3.74Å; Y50-W55 HydrophobicContact CE2-CZ3 3.74Å; Y50-W55 HydrophobicContact CG-CZ3 4.14Å; Y50-W55 AromaticContact CZ-CZ3 3.97Å; Q53-W55 HydrophobicContact CB-CH2 4.38Å; Q53-W55 HydrophobicContact CB-CZ2 3.77Å; Q53-W55 HydrophobicContact CG-CH2 4.15Å; Q53-W55 HydrophobicContact CG-CZ2 3.77Å; Q53-W55 PolarHBondContact O-N 3.36Å; Q53-W55 PolarHBondContact O-NE1 3.28Å; W55-E57 PolarHBondContact O-N 3.07Å; W55-S58 PolarHBondContact O-N 2.91Å; W55-V59 WeakPolarHBondContact O-CG2 3.29Å; W55-V59 PolarHBondContact O-N 3.21Å; W55-Y146 HydrophobicContact CH2-CD1 4.01Å; W55-Y146 AromaticContact CH2-CE1 3.54Å; W55-Y146 HydrophobicContact CH2-CE1 3.54Å; W55-Y146 HydrophobicContact CZ2-CE1 4.15Å; W55-Y146 AromaticContact CZ3-CD1 3.85Å; W55-Y146 HydrophobicContact CZ3-CD1 3.85Å; W55-Y146 AromaticContact CZ3-CE1 3.89Å; W55-Y146 HydrophobicContact CZ3-CE1 3.89Å; W55-A147 HydrophobicContact CB-CB 4.39Å; W55-A147 HydrophobicContact CE3-CB 3.91Å; W55-Q150 HydrophobicContact CD2-CB 3.72Å; W55-Q150 HydrophobicContact CD2-CG 3.97Å; W55-Q150 HydrophobicContact CE3-CB 4.46Å; W55-Q150 HydrophobicContact CE3-CG 4.41Å; W55-Q150 HydrophobicContact CG-CB 3.72Å; W55-Q150 HydrophobicContact CG-CG 4.48Å; W55-Q150 HydrophobicContact CH2-CG 4.33Å; W55-Q150 HydrophobicContact CZ2-CB 4.38Å; W55-Q150 HydrophobicContact CZ2-CG 3.83Å; W55-L151 HydrophobicContact CB-CD1 4.11Å; W55-L151 HydrophobicContact CB-CD2 3.88Å; W55-L151 HydrophobicContact CB-CG 3.76Å; W55-F407 HydrophobicContact CH2-CE1 4.09Å; W55-F407 HydrophobicContact CH2-CZ 4.39Å
56	A	97.4	Very high	97.3	Very high	62 Å²	62	43.4 Å²	43.4	51%	0.512	24%	0.238	S	C	.	.	H	α-helix	trans	-63.7	-41	-178	0	0	0	0	0	112.8	S54 K60 L151	S54-A56 PolarHBondContact O-N 3.45Å; A56-K60 WeakPolarHBondContact O-CB 3.38Å; A56-K60 PolarHBondContact O-N 2.9Å; A56-L151 HydrophobicContact CB-CD1 4.41Å; A56-L151 HydrophobicContact CB-CD2 4.27Å
57	E	97.4	Very high	97.2	Very high	56 Å²	56	45 Å²	45	26%	0.262	24%	0.243	S	C	.	.	H	α-helix	trans	-75.3	-36.2	179.2	-162.2	67.2	-170.5	0	0	111	Y45 Q49 S54 W55 K60 Y61	Y45-E57 HydrophobicContact CE1-CG 4.02Å; Q49-E57 HydrophobicContact CG-CB 4.26Å; Q49-E57 HydrophobicContact CG-CG 4.11Å; S54-E57 PolarHBondContact O-N 3.38Å; S54-E57 VanDerWaalsContact O-N 3.14Å; W55-E57 PolarHBondContact O-N 3.07Å; E57-K60 PolarHBondContact O-N 3.21Å; E57-K60 IonicContact OE1-NZ 3.66Å; E57-K60 PolarHBondContact OE1-NZ 2.95Å; E57-K60 IonicContact OE2-NZ 2.7Å; E57-K60 PolarHBondContact OE2-NZ 3.2Å; E57-Y61 HydrophobicContact CG-CD2 4.24Å; E57-Y61 HydrophobicContact CG-CE2 4.32Å; E57-Y61 PolarHBondContact O-N 3.43Å; E57-Y61 VanDerWaalsContact O-N 3.13Å; E57-Y61 WeakPolarHBondContact OE1-CE2 3.4Å
58	S	98	Very high	97	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-58.5	-52.3	173.1	-178.4	0	0	0	0	111.6	A46 Y50 S54 W55 K60 Y61 L62	A46-S58 WeakPolarHBondContact O-CB 3.18Å; A46-S58 PolarHBondContact O-OG 3.4Å; Y50-S58 WeakPolarHBondContact CB-OG 3.45Å; S54-S58 PolarHBondContact O-N 3.1Å; W55-S58 PolarHBondContact O-N 2.91Å; S58-K60 VanDerWaalsContact C-N 3.32Å; S58-K60 PolarHBondContact O-N 3.43Å; S58-Y61 PolarHBondContact O-N 2.98Å; S58-L62 WeakPolarHBondContact O-CB 3.06Å; S58-L62 WeakPolarHBondContact O-CG 3.2Å; S58-L62 PolarHBondContact O-N 2.78Å
59	V	97.1	Very high	96.9	Very high	7 Å²	7	38.1 Å²	38.1	4%	0.042	21%	0.21	C	C	.	.	H	α-helix	trans	-55.2	-48.1	177	168.1	0	0	0	0	111.2	W55 Y61 L62 E63 A147 Y148 L151	W55-V59 WeakPolarHBondContact O-CG2 3.29Å; W55-V59 PolarHBondContact O-N 3.21Å; V59-Y61 VanDerWaalsContact C-N 3.29Å; V59-Y61 PolarHBondContact O-N 3Å; V59-L62 PolarHBondContact O-N 3.27Å; V59-E63 HydrophobicContact CG1-CG 4.29Å; V59-E63 WeakPolarHBondContact O-CB 3.47Å; V59-E63 WeakPolarHBondContact O-CG 2.97Å; V59-E63 PolarHBondContact O-N 3.22Å; V59-A147 HydrophobicContact CG2-CB 3.43Å; V59-A147 VanDerWaalsContact CG2-CB 3.43Å; V59-Y148 HydrophobicContact CG1-CD1 4.47Å; V59-Y148 HydrophobicContact CG1-CE1 3.7Å; V59-Y148 HydrophobicContact CG1-CE2 3.91Å; V59-Y148 WeakPolarHBondContact CG1-OH 3.34Å; V59-Y148 HydrophobicContact CG2-CD1 4.42Å; V59-Y148 HydrophobicContact CG2-CE1 4.41Å; V59-L151 HydrophobicContact CG2-CD1 4.27Å
60	K	95.9	Very high	96.7	Very high	108 Å²	108	40.8 Å²	40.8	47%	0.47	22%	0.219	S	C	.	.	H	α-helix	trans	-56.3	-42.1	-179.2	173.4	-172.8	166.8	-158.9	0	112.4	A56 E57 S58 L64	A56-K60 WeakPolarHBondContact O-CB 3.38Å; A56-K60 PolarHBondContact O-N 2.9Å; E57-K60 PolarHBondContact O-N 3.21Å; E57-K60 IonicContact OE1-NZ 3.66Å; E57-K60 PolarHBondContact OE1-NZ 2.95Å; E57-K60 IonicContact OE2-NZ 2.7Å; E57-K60 PolarHBondContact OE2-NZ 3.2Å; S58-K60 VanDerWaalsContact C-N 3.32Å; S58-K60 PolarHBondContact O-N 3.43Å; K60-L64 WeakPolarHBondContact O-CB 3.44Å; K60-L64 PolarHBondContact O-N 3.38Å; K60-L64 VanDerWaalsContact O-N 3.1Å
61	Y	97.6	Very high	96.5	Very high	51 Å²	51	39.4 Å²	39.4	20%	0.2	21%	0.214	C	C	.	.	H	α-helix	trans	-81.4	-30.5	179.1	-85.7	-92.5	0	0	0	113.6	M37 A42 Y45 E57 S58 V59 L64 S65	M37-Y61 HydrophobicContact CE-CE1 4.14Å; M37-Y61 HydrophobicContact SD-CD1 4.33Å; M37-Y61 HydrophobicContact SD-CE1 3.81Å; A42-Y61 HydrophobicContact CB-CD1 4.41Å; Y45-Y61 AromaticContact CD1-CD1 3.69Å; Y45-Y61 HydrophobicContact CD1-CD1 3.69Å; Y45-Y61 AromaticContact CD1-CD2 3.46Å; Y45-Y61 HydrophobicContact CD1-CD2 3.46Å; Y45-Y61 VanDerWaalsContact CD1-CD2 3.46Å; Y45-Y61 AromaticContact CD1-CE1 3.82Å; Y45-Y61 HydrophobicContact CD1-CE1 3.82Å; Y45-Y61 AromaticContact CD1-CE2 3.57Å; Y45-Y61 HydrophobicContact CD1-CE2 3.57Å; Y45-Y61 AromaticContact CD1-CG 3.49Å; Y45-Y61 HydrophobicContact CD1-CG 3.49Å; Y45-Y61 VanDerWaalsContact CD1-CG 3.49Å; Y45-Y61 AromaticContact CD1-CZ 3.74Å; Y45-Y61 HydrophobicContact CE1-CD1 4.35Å; Y45-Y61 AromaticContact CE1-CD2 3.37Å; Y45-Y61 HydrophobicContact CE1-CD2 3.37Å; Y45-Y61 HydrophobicContact CE1-CE1 4.23Å; Y45-Y61 AromaticContact CE1-CE2 3.2Å; Y45-Y61 HydrophobicContact CE1-CE2 3.2Å; Y45-Y61 AromaticContact CE1-CG 3.94Å; Y45-Y61 HydrophobicContact CE1-CG 3.94Å; Y45-Y61 AromaticContact CE1-CZ 3.66Å; E57-Y61 HydrophobicContact CG-CD2 4.24Å; E57-Y61 HydrophobicContact CG-CE2 4.32Å; E57-Y61 PolarHBondContact O-N 3.43Å; E57-Y61 VanDerWaalsContact O-N 3.13Å; E57-Y61 WeakPolarHBondContact OE1-CE2 3.4Å; S58-Y61 PolarHBondContact O-N 2.98Å; V59-Y61 VanDerWaalsContact C-N 3.29Å; V59-Y61 PolarHBondContact O-N 3Å; Y61-L64 HydrophobicContact CD1-CD2 4.02Å; Y61-L64 HydrophobicContact CE1-CD2 4.12Å; Y61-L64 WeakPolarHBondContact O-CB 3.25Å; Y61-L64 PolarHBondContact O-N 3.26Å; Y61-S65 WeakPolarHBondContact O-CB 3.1Å; Y61-S65 PolarHBondContact O-N 3.43Å; Y61-S65 PolarHBondContact O-OG 2.88Å
62	L	97.6	Very high	96.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63	-44.7	170.9	-73.5	165.8	0	0	0	111.2	Y43 A46 S58 V59 L64 S65 L66 P140 I144	Y43-L62 HydrophobicContact CD2-CD2 4.04Å; Y43-L62 HydrophobicContact CE2-CD2 3.87Å; A46-L62 HydrophobicContact CB-CB 4.46Å; A46-L62 HydrophobicContact CB-CD2 3.92Å; A46-L62 HydrophobicContact CB-CG 3.7Å; S58-L62 WeakPolarHBondContact O-CB 3.06Å; S58-L62 WeakPolarHBondContact O-CG 3.2Å; S58-L62 PolarHBondContact O-N 2.78Å; V59-L62 PolarHBondContact O-N 3.27Å; L62-L64 VanDerWaalsContact C-N 3.33Å; L62-L64 PolarHBondContact O-N 2.87Å; L62-S65 WeakPolarHBondContact CA-OG 3.31Å; L62-S65 PolarHBondContact O-N 2.67Å; L62-S65 PolarHBondContact O-OG 3.16Å; L62-L66 WeakPolarHBondContact O-CG 3.1Å; L62-L66 PolarHBondContact O-N 3.23Å; L62-P140 HydrophobicContact CD2-CB 4.39Å; L62-I144 HydrophobicContact CB-CD1 3.84Å; L62-I144 HydrophobicContact CB-CG1 3.57Å; L62-I144 HydrophobicContact CD1-CG1 3.72Å; L62-I144 HydrophobicContact CG-CG1 4.19Å
63	E	95.9	Very high	96.1	Very high	45 Å²	45	38 Å²	38	21%	0.21	18%	0.181	C	C	.	.	H	α-helix	trans	-66.3	-35.7	174.5	-69.5	-174.5	160.2	0	0	111.9	Y23 V59 R67 I144 Y148	Y23-E63 HydrophobicContact CE1-CB 4.37Å; Y23-E63 HydrophobicContact CE1-CG 4.24Å; V59-E63 HydrophobicContact CG1-CG 4.29Å; V59-E63 WeakPolarHBondContact O-CB 3.47Å; V59-E63 WeakPolarHBondContact O-CG 2.97Å; V59-E63 PolarHBondContact O-N 3.22Å; E63-R67 WeakPolarHBondContact O-CG 3.47Å; E63-R67 PolarHBondContact O-N 2.76Å; E63-R67 VanDerWaalsContact O-N 3.12Å; E63-R67 PolarHBondContact O-NE 3.02Å; E63-I144 HydrophobicContact CG-CD1 4.37Å; E63-Y148 PolarHBondContact OE1-OH 3.17Å
64	L	95.6	Very high	95.9	Very high	14 Å²	14	34.9 Å²	34.9	7%	0.073	17%	0.168	C	C	.	.	H	α-helix	trans	-63.5	-46.3	172.5	175.7	58	0	0	0	111.3	F31 D35 M37 K60 Y61 L62 L66 R67 L68	F31-L64 HydrophobicContact CZ-CD1 4.45Å; D35-L64 HydrophobicContact CB-CD1 3.71Å; D35-L64 WeakPolarHBondContact O-CD1 3.5Å; M37-L64 HydrophobicContact CG-CD2 4.37Å; M37-L64 HydrophobicContact SD-CD2 3.68Å; K60-L64 WeakPolarHBondContact O-CB 3.44Å; K60-L64 PolarHBondContact O-N 3.38Å; K60-L64 VanDerWaalsContact O-N 3.1Å; Y61-L64 HydrophobicContact CD1-CD2 4.02Å; Y61-L64 HydrophobicContact CE1-CD2 4.12Å; Y61-L64 WeakPolarHBondContact O-CB 3.25Å; Y61-L64 PolarHBondContact O-N 3.26Å; L62-L64 VanDerWaalsContact C-N 3.33Å; L62-L64 PolarHBondContact O-N 2.87Å; L64-L66 VanDerWaalsContact C-N 3.31Å; L64-L66 PolarHBondContact O-N 3.37Å; L64-R67 PolarHBondContact O-N 3.39Å; L64-L68 HydrophobicContact CD1-CD1 4.09Å; L64-L68 HydrophobicContact CD1-CG 4.1Å; L64-L68 HydrophobicContact CG-CD1 3.92Å; L64-L68 HydrophobicContact CG-CG 4.4Å; L64-L68 WeakPolarHBondContact O-CG 3.07Å; L64-L68 PolarHBondContact O-N 3.23Å
65	S	96.8	Very high	95.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.3	-38.3	179.6	65.5	0	0	0	0	111.6	L39 Y61 L62 R67 L68 H69	L39-S65 WeakPolarHBondContact CD1-O 3.42Å; Y61-S65 WeakPolarHBondContact O-CB 3.1Å; Y61-S65 PolarHBondContact O-N 3.43Å; Y61-S65 PolarHBondContact O-OG 2.88Å; L62-S65 WeakPolarHBondContact CA-OG 3.31Å; L62-S65 PolarHBondContact O-N 2.67Å; L62-S65 PolarHBondContact O-OG 3.16Å; S65-R67 PolarHBondContact O-N 3.27Å; S65-L68 PolarHBondContact O-N 2.99Å; S65-H69 WeakPolarHBondContact O-CB 3.49Å; S65-H69 PolarHBondContact O-N 3.34Å
66	L	96.2	Very high	95.6	Very high	6 Å²	6	31.8 Å²	31.8	3%	0.031	15%	0.149	C	C	.	.	H	α-helix	trans	-61.6	-43.2	173.5	-74.6	162.2	0	0	0	112.2	Y23 L62 L64 H69 R70 F135 P140 Y141 I144	Y23-L66 HydrophobicContact CE1-CB 4.42Å; Y23-L66 HydrophobicContact CE1-CD1 4.38Å; Y23-L66 WeakPolarHBondContact OH-CD1 3.48Å; L62-L66 WeakPolarHBondContact O-CG 3.1Å; L62-L66 PolarHBondContact O-N 3.23Å; L64-L66 VanDerWaalsContact C-N 3.31Å; L64-L66 PolarHBondContact O-N 3.37Å; L66-H69 PolarHBondContact O-N 3.47Å; L66-R70 WeakPolarHBondContact O-CB 3.42Å; L66-R70 PolarHBondContact O-N 2.87Å; L66-F135 HydrophobicContact CD2-CD1 3.83Å; L66-F135 HydrophobicContact CD2-CE1 3.95Å; L66-F135 HydrophobicContact CG-CE1 4.17Å; L66-P140 HydrophobicContact CD1-CB 4.02Å; L66-P140 HydrophobicContact CD2-CB 3.98Å; L66-P140 HydrophobicContact CD2-CG 4.07Å; L66-P140 HydrophobicContact CG-CB 4.05Å; L66-P140 HydrophobicContact CG-CG 4.49Å; L66-Y141 HydrophobicContact CD1-CE1 4.28Å; L66-Y141 HydrophobicContact CD1-CE2 4.15Å; L66-Y141 HydrophobicContact CD2-CE2 3.83Å; L66-I144 HydrophobicContact CD1-CD1 3.35Å
67	R	95	Very high	95.4	Very high	33 Å²	33	29.2 Å²	29.2	13%	0.125	13%	0.128	C	C	.	.	H	α-helix	trans	-65.4	-39.5	175.5	-70.6	-176.7	-65.9	137.7	-4.4	112.5	Y23 F31 D35 E63 L64 S65 L71	Y23-R67 HydrophobicContact CD1-CG 4.31Å; Y23-R67 HydrophobicContact CG-CG 4.44Å; F31-R67 HydrophobicContact CE2-CB 3.95Å; F31-R67 HydrophobicContact CZ-CB 4.42Å; D35-R67 IonicContact OD2-CZ 3.08Å; D35-R67 IonicContact OD2-NH1 2.67Å; D35-R67 PolarHBondContact OD2-NH1 3.48Å; D35-R67 IonicContact OD2-NH2 2.84Å; D35-R67 PolarHBondContact OD2-NH2 3.47Å; E63-R67 WeakPolarHBondContact O-CG 3.47Å; E63-R67 PolarHBondContact O-N 2.76Å; E63-R67 VanDerWaalsContact O-N 3.12Å; E63-R67 PolarHBondContact O-NE 3.02Å; L64-R67 PolarHBondContact O-N 3.39Å; S65-R67 PolarHBondContact O-N 3.27Å; R67-L71 WeakPolarHBondContact O-CB 3.43Å; R67-L71 PolarHBondContact O-N 3.27Å
68	L	95.2	Very high	95.2	Very high	4 Å²	4	30.2 Å²	30.2	2%	0.021	13%	0.131	C	C	.	.	H	α-helix	trans	-65.9	-43.1	176.2	-73.5	167.9	0	0	0	111.6	F31 M36 M37 L39 A42 L64 S65 L71 L72	F31-L68 HydrophobicContact CE1-CD2 3.97Å; F31-L68 HydrophobicContact CZ-CD2 3.65Å; F31-L68 HydrophobicContact CZ-CG 4.12Å; M36-L68 HydrophobicContact CE-CD2 4.48Å; M36-L68 HydrophobicContact SD-CD2 4.49Å; M37-L68 HydrophobicContact CG-CD1 3.75Å; L39-L68 HydrophobicContact CD1-CB 3.97Å; A42-L68 HydrophobicContact CB-CD1 3.85Å; L64-L68 HydrophobicContact CD1-CD1 4.09Å; L64-L68 HydrophobicContact CD1-CG 4.1Å; L64-L68 HydrophobicContact CG-CD1 3.92Å; L64-L68 HydrophobicContact CG-CG 4.4Å; L64-L68 WeakPolarHBondContact O-CG 3.07Å; L64-L68 PolarHBondContact O-N 3.23Å; S65-L68 PolarHBondContact O-N 2.99Å; L68-L71 PolarHBondContact O-N 3.09Å; L68-L72 PolarHBondContact O-N 2.87Å
69	H	95.1	Very high	95	Very high	19 Å²	19	30.2 Å²	30.2	9%	0.088	13%	0.131	C	C	.	.	H	α-helix	trans	-60.6	-46.5	175.1	175.2	-112.3	0	0	0	111.3	L39 S65 L66 L71 L72 R73 F135	L39-H69 HydrophobicContact CD1-CB 3.99Å; L39-H69 HydrophobicContact CD2-CB 4.01Å; S65-H69 WeakPolarHBondContact O-CB 3.49Å; S65-H69 PolarHBondContact O-N 3.34Å; L66-H69 PolarHBondContact O-N 3.47Å; H69-L71 PolarHBondContact O-N 3.17Å; H69-L72 WeakPolarHBondContact O-CB 3.28Å; H69-L72 PolarHBondContact O-N 3.18Å; H69-R73 PolarHBondContact O-N 2.95Å; H69-F135 HydrophobicContact CB-CD1 3.65Å; H69-F135 HydrophobicContact CB-CE1 3.97Å; H69-F135 HydrophobicContact CB-CG 4.03Å; H69-F135 AromaticContact CD2-CG 3.95Å; H69-F135 VanDerWaalsContact CE1-CB 3.43Å; H69-F135 WeakPolarHBondContact CE1-CB 3.34Å; H69-F135 AromaticContact CG-CD1 3.68Å; H69-F135 AromaticContact CG-CG 3.67Å; H69-F135 AromaticContact ND1-CD1 3.82Å; H69-F135 AromaticContact ND1-CG 3.89Å
70	R	93.7	Very high	94.8	Very high	93 Å²	93	30 Å²	30	35%	0.351	13%	0.13	S	C	.	.	H	α-helix	trans	-61.4	-42.8	175.7	-172.1	175.8	180	161.7	0.1	112.3	Y26 L66 L72 R73 D74	Y26-R70 HydrophobicContact CD1-CG 4.43Å; Y26-R70 HydrophobicContact CE1-CG 3.86Å; Y26-R70 VanDerWaalsContact CE1-NE 3.29Å; Y26-R70 HydrophobicContact CE2-CB 4.28Å; Y26-R70 HydrophobicContact CE2-CG 4.14Å; L66-R70 WeakPolarHBondContact O-CB 3.42Å; L66-R70 PolarHBondContact O-N 2.87Å; R70-L72 VanDerWaalsContact C-N 3.34Å; R70-L72 PolarHBondContact O-N 3.41Å; R70-R73 PolarHBondContact O-N 3.02Å; R70-D74 IonicContact NE-OD2 3.97Å; R70-D74 WeakPolarHBondContact O-CB 3.37Å; R70-D74 VanDerWaalsContact O-CG 3.23Å; R70-D74 PolarHBondContact O-N 2.81Å
71	L	94.1	Very high	94.7	Very high	9 Å²	9	29.7 Å²	29.7	5%	0.047	13%	0.126	C	C	.	.	H	α-helix	trans	-58.9	-46.4	175.8	-179.7	66.1	0	0	0	111.2	Y26 F28 F31 M36 R67 L68 H69 D74 S75 V121	Y26-L71 HydrophobicContact CE2-CB 4.11Å; F28-L71 HydrophobicContact CD2-CD1 4.19Å; F31-L71 HydrophobicContact CB-CD1 4.26Å; F31-L71 HydrophobicContact CB-CD2 4.1Å; F31-L71 HydrophobicContact CD1-CD2 4.05Å; F31-L71 HydrophobicContact CD2-CB 4.16Å; F31-L71 HydrophobicContact CD2-CD1 4.27Å; F31-L71 HydrophobicContact CD2-CD2 3.74Å; F31-L71 HydrophobicContact CD2-CG 4.28Å; F31-L71 HydrophobicContact CE1-CD2 4.41Å; F31-L71 HydrophobicContact CE2-CB 4.22Å; F31-L71 HydrophobicContact CE2-CD2 4.1Å; F31-L71 HydrophobicContact CG-CD1 4.48Å; F31-L71 HydrophobicContact CG-CD2 3.7Å; F31-L71 HydrophobicContact CZ-CD2 4.44Å; M36-L71 HydrophobicContact CE-CD2 4.04Å; M36-L71 HydrophobicContact SD-CD2 3.78Å; R67-L71 WeakPolarHBondContact O-CB 3.43Å; R67-L71 PolarHBondContact O-N 3.27Å; L68-L71 PolarHBondContact O-N 3.09Å; H69-L71 PolarHBondContact O-N 3.17Å; L71-D74 PolarHBondContact O-N 3.15Å; L71-S75 VanDerWaalsContact O-CB 3.26Å; L71-S75 WeakPolarHBondContact O-CB 3.46Å; L71-S75 PolarHBondContact O-N 3.39Å; L71-S75 PolarHBondContact O-OG 2.95Å; L71-S75 VanDerWaalsContact O-OG 3.11Å; L71-V121 HydrophobicContact CD2-CB 3.98Å; L71-V121 HydrophobicContact CD2-CG2 4.24Å; L71-V121 HydrophobicContact CG-CB 4.22Å; L71-V121 HydrophobicContact CG-CG2 4.39Å
72	L	94.1	Very high	94.4	Very high	7 Å²	7	31.5 Å²	31.5	4%	0.037	14%	0.139	C	C	.	.	H	α-helix	trans	-57.5	-54	177.9	178.6	62.9	0	0	0	110.8	L68 H69 R70 D74 S75 E76 V121 F122 Y126 P127 L132	L68-L72 PolarHBondContact O-N 2.87Å; H69-L72 WeakPolarHBondContact O-CB 3.28Å; H69-L72 PolarHBondContact O-N 3.18Å; R70-L72 VanDerWaalsContact C-N 3.34Å; R70-L72 PolarHBondContact O-N 3.41Å; L72-D74 PolarHBondContact O-N 2.88Å; L72-S75 PolarHBondContact O-N 3.22Å; L72-E76 HydrophobicContact CD1-CG 4.41Å; L72-E76 WeakPolarHBondContact O-CG 3.21Å; L72-E76 PolarHBondContact O-N 3.5Å; L72-V121 HydrophobicContact CB-CG2 3.95Å; L72-V121 HydrophobicContact CD1-CG1 4.28Å; L72-V121 HydrophobicContact CD1-CG2 4.07Å; L72-F122 HydrophobicContact CD1-CD1 4.01Å; L72-F122 HydrophobicContact CD1-CE1 3.56Å; L72-F122 HydrophobicContact CD1-CZ 4.39Å; L72-Y126 HydrophobicContact CD1-CE2 4.02Å; L72-Y126 HydrophobicContact CD2-CE2 4.12Å; L72-Y126 HydrophobicContact CG-CE2 4.47Å; L72-P127 HydrophobicContact CD2-CG 3.64Å; L72-L132 HydrophobicContact CD2-CD2 4.28Å
73	R	93.3	Very high	94.2	Very high	95 Å²	95	31.5 Å²	31.5	36%	0.358	14%	0.14	S	C	.	.	H	α-helix	trans	-58.3	-47.2	-179.7	-172.7	-171.5	69	-171	0.4	112.3	H69 R70 S75 E76 A77	H69-R73 PolarHBondContact O-N 2.95Å; R70-R73 PolarHBondContact O-N 3.02Å; R73-S75 VanDerWaalsContact C-N 3.33Å; R73-S75 PolarHBondContact O-N 3.16Å; R73-E76 PolarHBondContact O-N 3.43Å; R73-A77 WeakPolarHBondContact O-CB 2.99Å; R73-A77 PolarHBondContact O-N 2.94Å
74	D	93.2	Very high	93.7	Very high	41 Å²	41	32.2 Å²	32.2	22%	0.219	15%	0.15	C	C	.	.	H	α-helix	trans	-67.1	-36.5	-178.8	-69.1	-0.9	0	0	0	110.9	Y26 F28 R70 L71 L72 F78	Y26-D74 WeakPolarHBondContact CE1-OD2 3.27Å; Y26-D74 WeakPolarHBondContact OH-CB 2.99Å; Y26-D74 VanDerWaalsContact OH-CG 3.31Å; Y26-D74 PolarHBondContact OH-OD2 2.96Å; F28-D74 HydrophobicContact CD2-CB 3.64Å; F28-D74 HydrophobicContact CE2-CB 3.87Å; F28-D74 HydrophobicContact CG-CB 4.47Å; R70-D74 IonicContact NE-OD2 3.97Å; R70-D74 WeakPolarHBondContact O-CB 3.37Å; R70-D74 VanDerWaalsContact O-CG 3.23Å; R70-D74 PolarHBondContact O-N 2.81Å; L71-D74 PolarHBondContact O-N 3.15Å; L72-D74 PolarHBondContact O-N 2.88Å; D74-F78 VanDerWaalsContact O-CB 3.25Å; D74-F78 WeakPolarHBondContact O-CB 3.42Å; D74-F78 PolarHBondContact O-N 2.72Å
75	S	93.8	Very high	92.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-66.3	-40	174.5	-75	0	0	0	0	112.4	L71 L72 R73 C79 F119	L71-S75 VanDerWaalsContact O-CB 3.26Å; L71-S75 WeakPolarHBondContact O-CB 3.46Å; L71-S75 PolarHBondContact O-N 3.39Å; L71-S75 PolarHBondContact O-OG 2.95Å; L71-S75 VanDerWaalsContact O-OG 3.11Å; L72-S75 PolarHBondContact O-N 3.22Å; R73-S75 VanDerWaalsContact C-N 3.33Å; R73-S75 PolarHBondContact O-N 3.16Å; S75-C79 PolarHBondContact O-N 3.12Å; S75-C79 VanDerWaalsContact O-N 3.07Å; S75-F119 VanDerWaalsContact OG-CD1 3.27Å; S75-F119 WeakPolarHBondContact OG-CD1 3.33Å
76	E	93.7	Very high	91.3	Very high	17 Å²	17	36 Å²	36	8%	0.079	18%	0.179	C	C	.	.	H	α-helix	trans	-66.8	-47.1	176.1	-71.2	-173.8	135.4	0	0	111.7	L72 R73 F78 C79 G80 K116 F122 Y126 G242 S243	L72-E76 HydrophobicContact CD1-CG 4.41Å; L72-E76 WeakPolarHBondContact O-CG 3.21Å; L72-E76 PolarHBondContact O-N 3.5Å; R73-E76 PolarHBondContact O-N 3.43Å; E76-F78 VanDerWaalsContact C-N 3.32Å; E76-F78 PolarHBondContact O-N 3.45Å; E76-C79 PolarHBondContact O-N 3.26Å; E76-G80 PolarHBondContact O-N 3.06Å; E76-K116 IonicContact OE1-NZ 2.78Å; E76-F122 HydrophobicContact CG-CE1 3.59Å; E76-F122 HydrophobicContact CG-CZ 3.56Å; E76-Y126 WeakPolarHBondContact OE1-CE2 3.19Å; E76-Y126 PolarHBondContact OE1-OH 3.13Å; E76-Y126 PolarHBondContact OE2-OH 3.09Å; E76-Y126 VanDerWaalsContact OE2-OH 3.13Å; E76-G242 WeakPolarHBondContact OE1-CA 3.28Å; E76-S243 PolarHBondContact OE1-N 3.18Å; E76-S243 VanDerWaalsContact OE1-N 3.14Å
77	A	93.8	Very high	89.5	Confident	8 Å²	8	37 Å²	37	7%	0.066	19%	0.187	C	C	.	.	H	α-helix	trans	-59.8	-42.2	175.8	0	0	0	0	0	112	R73 R81 L235	R73-A77 WeakPolarHBondContact O-CB 2.99Å; R73-A77 PolarHBondContact O-N 2.94Å; A77-R81 VanDerWaalsContact O-CB 3.26Å; A77-R81 WeakPolarHBondContact O-CB 3.44Å; A77-R81 PolarHBondContact O-N 3.28Å; A77-L235 HydrophobicContact CB-CB 4.25Å; A77-L235 HydrophobicContact CB-CD2 4.34Å; A77-L235 WeakPolarHBondContact CB-O 3.39Å
78	F	94.1	Very high	87.7	Confident	77 Å²	77	44.8 Å²	44.8	34%	0.338	22%	0.216	S	C	.	.	H	α-helix	trans	-60.6	-50.3	177	178.7	-94.1	0	0	0	112	F28 D74 E76 R81 N82 F119	F28-F78 HydrophobicContact CE1-CB 4.35Å; F28-F78 HydrophobicContact CE1-CD2 4.05Å; F28-F78 HydrophobicContact CE1-CG 4.17Å; F28-F78 HydrophobicContact CZ-CB 3.8Å; F28-F78 HydrophobicContact CZ-CD1 4.48Å; F28-F78 HydrophobicContact CZ-CD2 4.3Å; F28-F78 AromaticContact CZ-CG 3.95Å; F28-F78 HydrophobicContact CZ-CG 3.95Å; D74-F78 VanDerWaalsContact O-CB 3.25Å; D74-F78 WeakPolarHBondContact O-CB 3.42Å; D74-F78 PolarHBondContact O-N 2.72Å; E76-F78 VanDerWaalsContact C-N 3.32Å; E76-F78 PolarHBondContact O-N 3.45Å; F78-R81 PolarHBondContact O-N 3.47Å; F78-N82 WeakPolarHBondContact CE1-ND2 3.35Å; F78-N82 WeakPolarHBondContact CE2-ND2 3.43Å; F78-N82 WeakPolarHBondContact CZ-ND2 3.41Å; F78-N82 WeakPolarHBondContact O-CB 3.4Å; F78-N82 PolarHBondContact O-N 3.18Å; F78-F119 AromaticContact CD1-CE2 3.84Å; F78-F119 HydrophobicContact CD1-CE2 3.84Å; F78-F119 AromaticContact CD1-CZ 3.51Å; F78-F119 HydrophobicContact CD1-CZ 3.51Å; F78-F119 HydrophobicContact CE1-CE2 4.09Å; F78-F119 AromaticContact CE1-CZ 3.72Å; F78-F119 HydrophobicContact CE1-CZ 3.72Å; F78-F119 HydrophobicContact CG-CZ 4.32Å
79	C	93.6	Very high	85.7	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-68.1	-42.5	179.6	-72.8	0	0	0	0	112.5	S75 E76 R81 N82 C83 L112 C115 K116	S75-C79 PolarHBondContact O-N 3.12Å; S75-C79 VanDerWaalsContact O-N 3.07Å; E76-C79 PolarHBondContact O-N 3.26Å; C79-R81 VanDerWaalsContact C-N 3.31Å; C79-R81 PolarHBondContact O-N 3.03Å; C79-N82 PolarHBondContact O-N 2.99Å; C79-C83 VanDerWaalsContact O-CB 3.3Å; C79-C83 WeakPolarHBondContact O-CB 3.38Å; C79-C83 PolarHBondContact O-N 3.11Å; C79-C83 PolarHBondContact O-SG 3.31Å; C79-L112 HydrophobicContact CB-CD2 4.09Å; C79-C115 WeakPolarHBondContact CA-SG 3.36Å; C79-C115 HydrophobicContact CB-CB 3.78Å; C79-C115 WeakPolarHBondContact CB-SG 3.39Å; C79-C115 WeakPolarHBondContact SG-CB 3.36Å; C79-C115 CovalentContact SG-SG 2.05Å; C79-C115 PolarHBondContact SG-SG 3.24Å; C79-K116 HydrophobicContact CB-CG 4.48Å
80	G	93.4	Very high	83.7	Confident	2 Å²	2	53.2 Å²	53.2	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-58.5	-42.5	176	0	0	0	0	0	112.3	E76 S84	E76-G80 PolarHBondContact O-N 3.06Å; G80-S84 PolarHBondContact O-N 2.89Å; G80-S84 VanDerWaalsContact O-N 3.13Å
81	R	92.8	Very high	81.9	Confident	103 Å²	103	53.8 Å²	53.8	39%	0.389	28%	0.275	S	S	.	.	H	α-helix	trans	-67.1	-49.9	177.7	-175.4	-177.7	-175.9	169.8	11.6	111.9	A77 F78 C79 C83 S84 E231 A238	A77-R81 VanDerWaalsContact O-CB 3.26Å; A77-R81 WeakPolarHBondContact O-CB 3.44Å; A77-R81 PolarHBondContact O-N 3.28Å; F78-R81 PolarHBondContact O-N 3.47Å; C79-R81 VanDerWaalsContact C-N 3.31Å; C79-R81 PolarHBondContact O-N 3.03Å; R81-C83 VanDerWaalsContact C-N 3.27Å; R81-C83 PolarHBondContact O-N 3.25Å; R81-S84 WeakPolarHBondContact O-CB 3.37Å; R81-S84 PolarHBondContact O-N 3.33Å; R81-S84 VanDerWaalsContact O-N 3.11Å; R81-S84 PolarHBondContact O-OG 3.27Å; R81-E231 IonicContact CZ-OE1 3.47Å; R81-E231 IonicContact CZ-OE2 3.89Å; R81-E231 IonicContact NH1-OE1 3.25Å; R81-E231 PolarHBondContact NH1-OE1 2.97Å; R81-E231 IonicContact NH2-OE1 2.78Å; R81-E231 PolarHBondContact NH2-OE1 2.91Å; R81-E231 IonicContact NH2-OE2 3.19Å; R81-E231 PolarHBondContact NH2-OE2 3.28Å; R81-A238 HydrophobicContact CB-CB 4.21Å
82	N	92.3	Very high	80.1	Confident	88 Å²	88	57.7 Å²	57.7	47%	0.471	30%	0.304	S	S	.	.	H	α-helix	trans	-66.1	-29.7	-178	-73.8	-12.5	0	0	0	112.8	F78 C79	F78-N82 WeakPolarHBondContact CE1-ND2 3.35Å; F78-N82 WeakPolarHBondContact CE2-ND2 3.43Å; F78-N82 WeakPolarHBondContact CZ-ND2 3.41Å; F78-N82 WeakPolarHBondContact O-CB 3.4Å; F78-N82 PolarHBondContact O-N 3.18Å; C79-N82 PolarHBondContact O-N 2.99Å
83	C	91.9	Very high	78.5	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.007	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	0.1	176	-65.4	0	0	0	0	113.7	C79 R81 S85 A86 C111 L112	C79-C83 VanDerWaalsContact O-CB 3.3Å; C79-C83 WeakPolarHBondContact O-CB 3.38Å; C79-C83 PolarHBondContact O-N 3.11Å; C79-C83 PolarHBondContact O-SG 3.31Å; R81-C83 VanDerWaalsContact C-N 3.27Å; R81-C83 PolarHBondContact O-N 3.25Å; C83-S85 PolarHBondContact O-N 3.03Å; C83-A86 WeakPolarHBondContact O-CB 3.42Å; C83-A86 PolarHBondContact O-N 3.37Å; C83-C111 WeakPolarHBondContact CA-SG 3.23Å; C83-C111 HydrophobicContact CB-CB 3.75Å; C83-C111 WeakPolarHBondContact CB-SG 3.28Å; C83-C111 WeakPolarHBondContact SG-CB 3.3Å; C83-C111 CovalentContact SG-SG 2.04Å; C83-C111 PolarHBondContact SG-SG 3.37Å; C83-L112 HydrophobicContact CB-CD2 3.94Å; C83-L112 HydrophobicContact CB-CG 4.11Å; C83-L112 PolarHBondContact SG-N 3.28Å; C83-L112 VanDerWaalsContact SG-N 3.43Å
84	S	85.1	Confident	76.9	Confident	60 Å²	60	63.3 Å²	63.3	42%	0.42	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-30.8	-176.7	68.6	0	0	0	0	113.9	G80 R81 R108	G80-S84 PolarHBondContact O-N 2.89Å; G80-S84 VanDerWaalsContact O-N 3.13Å; R81-S84 WeakPolarHBondContact O-CB 3.37Å; R81-S84 PolarHBondContact O-N 3.33Å; R81-S84 VanDerWaalsContact O-N 3.11Å; R81-S84 PolarHBondContact O-OG 3.27Å; S84-R108 PolarHBondContact O-NH1 2.84Å
85	S	76	Confident	75.5	Confident	53 Å²	53	67.6 Å²	67.6	37%	0.371	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	3.9	-177.6	62.8	0	0	0	0	114.7	C83 S87 R88	C83-S85 PolarHBondContact O-N 3.03Å; S85-S87 PolarHBondContact O-N 2.91Å; S85-R88 PolarHBondContact O-N 3.48Å
86	A	67.8	Low	74.7	Confident	39 Å²	39	70.9 Å²	70.9	32%	0.322	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-8.7	-171.8	0	0	0	0	0	115.2	C83 C111	C83-A86 WeakPolarHBondContact O-CB 3.42Å; C83-A86 PolarHBondContact O-N 3.37Å; A86-C111 HydrophobicContact CB-CB 4.1Å
87	S	57.1	Low	73.9	Confident	28 Å²	28	74.5 Å²	74.5	20%	0.196	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	-1.4	178.6	-173.4	0	0	0	0	114.7	S85 H104	S85-S87 PolarHBondContact O-N 2.91Å; S87-H104 WeakPolarHBondContact CB-CD2 3.2Å; S87-H104 PolarHBondContact OG-CD2 2.88Å
88	R	57.4	Low	73.3	Confident	196 Å²	196	77 Å²	77	74%	0.74	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-17	-173.7	-72.8	-175.7	166.6	169.3	-2.9	114.4	S85	S85-R88 PolarHBondContact O-N 3.48Å
89	D	52.8	Low	72.8	Confident	159 Å²	159	77.8 Å²	77.8	85%	0.85	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	1.1	-168.4	-69.8	-22.1	0	0	0	115.3
90	S	54.8	Low	72.3	Confident	41 Å²	41	82.6 Å²	82.6	29%	0.287	46%	0.457	S	S	.	.			trans	-148.5	50	-176.9	70.1	0	0	0	0	114.5	S92 R103	S90-S92 PolarHBondContact O-N 3.15Å; S90-R103 PolarHBondContact O-NH1 2.88Å; S90-R103 PolarHBondContact OG-NH1 3.08Å; S90-R103 PolarHBondContact OG-NH2 3.39Å
91	D	55.2	Low	71.9	Confident	105 Å²	105	86.6 Å²	86.6	56%	0.561	48%	0.481	S	S	*	.			trans	-82.9	8.9	-175.4	-139.1	1	0	0	0	114.1	R100	D91-R100 IonicContact OD1-CZ 3.82Å; D91-R100 IonicContact OD1-NE 3.14Å; D91-R100 IonicContact OD1-NH1 3.53Å; D91-R100 PolarHBondContact OD1-NH1 3.02Å; D91-R100 IonicContact OD2-NH1 3.75Å
92	S	56.6	Low	71.7	Confident	92 Å²	92	85.3 Å²	85.3	64%	0.643	48%	0.484	S	S	*	.	S	Bend	trans	-96	122.3	173.7	44.2	0	0	0	0	110.3	S90	S90-S92 PolarHBondContact O-N 3.15Å
93	L	59.3	Low	71.4	Confident	157 Å²	157	86 Å²	86	82%	0.822	48%	0.48	S	S	*	.	S	Bend	trans	116.9	2	153.3	-57.2	161.2	0	0	0	119.6	P95	L93-P95 VanDerWaalsContact O-CD 3.29Å; L93-P95 WeakPolarHBondContact O-CD 3.33Å
94	L	60.6	Low	71.2	Confident	62 Å²	62	89.2 Å²	89.2	33%	0.325	50%	0.495	S	S	.	.			trans	-101	109.3	171.2	-67.4	177.3	0	0	0	111.7	D96 R100	L94-D96 VanDerWaalsContact C-N 3.28Å; L94-R100 PolarHBondContact O-NH2 3.31Å
95	P	63.6	Low	71.4	Confident	132 Å²	132	89.4 Å²	89.4	86%	0.857	49%	0.49	S	S	*	.			trans	-71.7	-23.1	174.3	26.5	-31.2	0	0	0	112.6	L93	L93-P95 VanDerWaalsContact O-CD 3.29Å; L93-P95 WeakPolarHBondContact O-CD 3.33Å
96	D	76.5	Confident	72.1	Confident	69 Å²	69	92.3 Å²	92.3	37%	0.369	50%	0.501	S	S	.	.			trans	-84.5	116.6	177.7	-172.2	-8.8	0	0	0	111.5	L94 S98 L99 R100	L94-D96 VanDerWaalsContact C-N 3.28Å; D96-S98 VanDerWaalsContact C-N 3.3Å; D96-S98 PolarHBondContact O-N 3.47Å; D96-S98 WeakPolarHBondContact OD1-CB 3.46Å; D96-S98 PolarHBondContact OD1-N 3.25Å; D96-S98 PolarHBondContact OD1-OG 3.47Å; D96-S98 PolarHBondContact OD2-OG 3.02Å; D96-S98 VanDerWaalsContact OD2-OG 3.11Å; D96-L99 HydrophobicContact CB-CB 4.3Å; D96-L99 HydrophobicContact CB-CD1 4.11Å; D96-L99 HydrophobicContact CB-CG 4.24Å; D96-L99 WeakPolarHBondContact OD2-CG 3.18Å; D96-R100 PolarHBondContact O-N 3.27Å
97	S	77.1	Confident	73.1	Confident	92 Å²	92	93.6 Å²	93.6	64%	0.643	50%	0.502	S	S	*	.	H	α-helix	trans	-63.2	-32.5	178.1	65.1	0	0	0	0	113.1	R100 V101	S97-R100 WeakPolarHBondContact O-CB 3.27Å; S97-R100 PolarHBondContact O-N 3.06Å; S97-V101 PolarHBondContact O-N 2.84Å
98	S	81.8	Confident	74.8	Confident	62 Å²	62	94 Å²	94	43%	0.434	50%	0.5	S	S	.	.	H	α-helix	trans	-71.4	-47.4	-177.3	69.2	0	0	0	0	111.6	D96 R100 V101 V102	D96-S98 VanDerWaalsContact C-N 3.3Å; D96-S98 PolarHBondContact O-N 3.47Å; D96-S98 WeakPolarHBondContact OD1-CB 3.46Å; D96-S98 PolarHBondContact OD1-N 3.25Å; D96-S98 PolarHBondContact OD1-OG 3.47Å; D96-S98 PolarHBondContact OD2-OG 3.02Å; D96-S98 VanDerWaalsContact OD2-OG 3.11Å; S98-R100 PolarHBondContact O-N 2.87Å; S98-V101 PolarHBondContact O-N 3.34Å; S98-V101 VanDerWaalsContact O-N 3.13Å; S98-V102 WeakPolarHBondContact O-CG2 3.4Å; S98-V102 PolarHBondContact O-N 3.34Å
99	L	84	Confident	76.4	Confident	93 Å²	93	87.2 Å²	87.2	49%	0.487	49%	0.486	S	S	.	.	H	α-helix	trans	-63.2	-29.2	175.7	-66	178.5	0	0	0	112.2	D96 R103	D96-L99 HydrophobicContact CB-CB 4.3Å; D96-L99 HydrophobicContact CB-CD1 4.11Å; D96-L99 HydrophobicContact CB-CG 4.24Å; D96-L99 WeakPolarHBondContact OD2-CG 3.18Å; L99-R103 VanDerWaalsContact O-CB 3.25Å; L99-R103 WeakPolarHBondContact O-CB 3.47Å; L99-R103 PolarHBondContact O-N 3.04Å
100	R	83.4	Confident	78.3	Confident	101 Å²	101	82.6 Å²	82.6	38%	0.381	47%	0.47	S	S	.	.	H	α-helix	trans	-64.8	-45.1	173.4	-168.4	-176.4	-59.6	-152	7.6	111.7	D91 L94 D96 S97 S98 R103 H104	D91-R100 IonicContact OD1-CZ 3.82Å; D91-R100 IonicContact OD1-NE 3.14Å; D91-R100 IonicContact OD1-NH1 3.53Å; D91-R100 PolarHBondContact OD1-NH1 3.02Å; D91-R100 IonicContact OD2-NH1 3.75Å; L94-R100 PolarHBondContact O-NH2 3.31Å; D96-R100 PolarHBondContact O-N 3.27Å; S97-R100 WeakPolarHBondContact O-CB 3.27Å; S97-R100 PolarHBondContact O-N 3.06Å; S98-R100 PolarHBondContact O-N 2.87Å; R100-R103 PolarHBondContact O-N 3.45Å; R100-H104 WeakPolarHBondContact O-CB 3.2Å; R100-H104 PolarHBondContact O-N 3.26Å
101	V	85.1	Confident	80.1	Confident	86 Å²	86	82.6 Å²	82.6	52%	0.521	47%	0.469	S	S	.	.	H	α-helix	trans	-63.8	-46	176.9	175.2	0	0	0	0	110.7	S97 S98 R103 H104 I105	S97-V101 PolarHBondContact O-N 2.84Å; S98-V101 PolarHBondContact O-N 3.34Å; S98-V101 VanDerWaalsContact O-N 3.13Å; V101-R103 PolarHBondContact O-N 3.43Å; V101-H104 WeakPolarHBondContact O-CB 3.21Å; V101-H104 PolarHBondContact O-N 3.26Å; V101-I105 HydrophobicContact CG1-CD1 3.94Å; V101-I105 WeakPolarHBondContact O-CG1 3.28Å; V101-I105 PolarHBondContact O-N 2.91Å
102	V	87.6	Confident	81.9	Confident	76 Å²	76	78.8 Å²	78.8	46%	0.461	45%	0.449	S	S	.	.	H	α-helix	trans	-60.4	-45.8	177.5	175.4	0	0	0	0	111	S98 H104 I105 L106	S98-V102 WeakPolarHBondContact O-CG2 3.4Å; S98-V102 PolarHBondContact O-N 3.34Å; V102-H104 VanDerWaalsContact C-N 3.32Å; V102-H104 PolarHBondContact O-N 3.2Å; V102-I105 PolarHBondContact O-N 3.1Å; V102-L106 HydrophobicContact CG1-CD1 4Å; V102-L106 HydrophobicContact CG1-CG 4.36Å; V102-L106 WeakPolarHBondContact O-CG 3.37Å; V102-L106 PolarHBondContact O-N 3.27Å
103	R	86.6	Confident	83.6	Confident	101 Å²	101	82.5 Å²	82.5	38%	0.381	45%	0.453	S	S	.	.	H	α-helix	trans	-58.3	-44.4	175.6	-176.4	-179.8	-175.6	-149.6	-2.8	111.8	S90 L99 R100 V101 L106 L107	S90-R103 PolarHBondContact O-NH1 2.88Å; S90-R103 PolarHBondContact OG-NH1 3.08Å; S90-R103 PolarHBondContact OG-NH2 3.39Å; L99-R103 VanDerWaalsContact O-CB 3.25Å; L99-R103 WeakPolarHBondContact O-CB 3.47Å; L99-R103 PolarHBondContact O-N 3.04Å; R100-R103 PolarHBondContact O-N 3.45Å; V101-R103 PolarHBondContact O-N 3.43Å; R103-L106 PolarHBondContact O-N 3.14Å; R103-L107 HydrophobicContact CG-CD1 4.02Å; R103-L107 HydrophobicContact CG-CG 4.41Å; R103-L107 WeakPolarHBondContact O-CB 3.29Å; R103-L107 WeakPolarHBondContact O-CG 3.45Å; R103-L107 PolarHBondContact O-N 3.28Å
104	H	87.1	Confident	85.2	Confident	69 Å²	69	82.5 Å²	82.5	32%	0.319	45%	0.446	S	S	.	.	H	α-helix	trans	-58.3	-47.9	176.4	172.8	-78.8	0	0	0	111.3	S87 R100 V101 V102 L106 L107 R108	S87-H104 WeakPolarHBondContact CB-CD2 3.2Å; S87-H104 PolarHBondContact OG-CD2 2.88Å; R100-H104 WeakPolarHBondContact O-CB 3.2Å; R100-H104 PolarHBondContact O-N 3.26Å; V101-H104 WeakPolarHBondContact O-CB 3.21Å; V101-H104 PolarHBondContact O-N 3.26Å; V102-H104 VanDerWaalsContact C-N 3.32Å; V102-H104 PolarHBondContact O-N 3.2Å; H104-L106 PolarHBondContact O-N 3.16Å; H104-L107 PolarHBondContact O-N 3.28Å; H104-R108 VanDerWaalsContact O-CB 3.3Å; H104-R108 WeakPolarHBondContact O-CB 3.1Å; H104-R108 PolarHBondContact O-N 3.13Å
105	I	89.1	Confident	86.8	Confident	64 Å²	64	80.3 Å²	80.3	33%	0.328	44%	0.436	S	S	.	.	H	α-helix	trans	-59.6	-47.8	178.5	-66.9	166.8	0	0	0	110.6	V101 V102 R108 A109 F260	V101-I105 HydrophobicContact CG1-CD1 3.94Å; V101-I105 WeakPolarHBondContact O-CG1 3.28Å; V101-I105 PolarHBondContact O-N 2.91Å; V102-I105 PolarHBondContact O-N 3.1Å; I105-R108 PolarHBondContact O-N 2.9Å; I105-A109 VanDerWaalsContact O-CB 3.27Å; I105-A109 WeakPolarHBondContact O-CB 3.41Å; I105-A109 PolarHBondContact O-N 3.11Å; I105-F260 HydrophobicContact CD1-CZ 4.09Å
106	L	90.1	Very high	88.2	Confident	114 Å²	114	75.4 Å²	75.4	60%	0.597	40%	0.401	S	S	*	.	H	α-helix	trans	-63	-44.6	-179.1	-68.6	174.1	0	0	0	112.6	V102 R103 H104 A109 A110	V102-L106 HydrophobicContact CG1-CD1 4Å; V102-L106 HydrophobicContact CG1-CG 4.36Å; V102-L106 WeakPolarHBondContact O-CG 3.37Å; V102-L106 PolarHBondContact O-N 3.27Å; R103-L106 PolarHBondContact O-N 3.14Å; H104-L106 PolarHBondContact O-N 3.16Å; L106-A109 PolarHBondContact O-N 3.02Å; L106-A110 WeakPolarHBondContact O-CB 3.31Å; L106-A110 PolarHBondContact O-N 3.28Å
107	L	90.7	Very high	88.9	Confident	66 Å²	66	75.7 Å²	75.7	35%	0.346	41%	0.413	S	S	.	.	H	α-helix	trans	-64.4	-43	177.4	-71.1	175.1	0	0	0	111.6	R103 H104 A110 C111	R103-L107 HydrophobicContact CG-CD1 4.02Å; R103-L107 HydrophobicContact CG-CG 4.41Å; R103-L107 WeakPolarHBondContact O-CB 3.29Å; R103-L107 WeakPolarHBondContact O-CG 3.45Å; R103-L107 PolarHBondContact O-N 3.28Å; H104-L107 PolarHBondContact O-N 3.28Å; L107-A110 PolarHBondContact O-N 2.93Å; L107-C111 PolarHBondContact O-N 3.3Å
108	R	91.2	Very high	89.6	Confident	37 Å²	37	77.9 Å²	77.9	14%	0.14	41%	0.413	C	S	.	.	H	α-helix	trans	-64.7	-44.7	177.6	-167	176.3	-168.1	103.6	-2.6	111.5	S84 H104 I105 A110 C111 L112 E241	S84-R108 PolarHBondContact O-NH1 2.84Å; H104-R108 VanDerWaalsContact O-CB 3.3Å; H104-R108 WeakPolarHBondContact O-CB 3.1Å; H104-R108 PolarHBondContact O-N 3.13Å; I105-R108 PolarHBondContact O-N 2.9Å; R108-A110 PolarHBondContact O-N 3.44Å; R108-C111 PolarHBondContact O-N 2.94Å; R108-L112 HydrophobicContact CG-CD1 4.18Å; R108-L112 WeakPolarHBondContact O-CG 3.23Å; R108-L112 PolarHBondContact O-N 3.25Å; R108-E241 IonicContact CZ-OE1 2.76Å; R108-E241 IonicContact CZ-OE2 3.41Å; R108-E241 IonicContact NE-OE1 3.74Å; R108-E241 IonicContact NE-OE2 3.48Å; R108-E241 PolarHBondContact NE-OE2 3.41Å; R108-E241 IonicContact NH2-OE1 2.74Å; R108-E241 PolarHBondContact NH2-OE1 3.24Å; R108-E241 IonicContact NH2-OE2 3.76Å; R108-E241 PolarHBondContact NH2-OE2 3.25Å
109	A	91.3	Very high	90	Very high	54 Å²	54	76.3 Å²	76.3	45%	0.446	40%	0.399	S	S	.	.	H	α-helix	trans	-61.3	-42.8	176.6	0	0	0	0	0	112	I105 L106 L112 K113	I105-A109 VanDerWaalsContact O-CB 3.27Å; I105-A109 WeakPolarHBondContact O-CB 3.41Å; I105-A109 PolarHBondContact O-N 3.11Å; L106-A109 PolarHBondContact O-N 3.02Å; A109-L112 PolarHBondContact O-N 3.49Å; A109-K113 WeakPolarHBondContact O-CB 3.4Å; A109-K113 PolarHBondContact O-N 3.23Å
110	A	92.7	Very high	90.3	Very high	62 Å²	62	74.7 Å²	74.7	51%	0.512	39%	0.394	S	S	.	.	H	α-helix	trans	-62.3	-42.9	175.8	0	0	0	0	0	112.1	L106 L107 R108 K114	L106-A110 WeakPolarHBondContact O-CB 3.31Å; L106-A110 PolarHBondContact O-N 3.28Å; L107-A110 PolarHBondContact O-N 2.93Å; R108-A110 PolarHBondContact O-N 3.44Å; A110-K114 PolarHBondContact O-N 3.11Å; A110-K114 VanDerWaalsContact O-N 3.1Å
111	C	93.6	Very high	90.6	Very high	40 Å²	40	70.8 Å²	70.8	27%	0.27	38%	0.381	S	S	.	.	H	α-helix	trans	-61.7	-50	175.3	-178.2	0	0	0	0	111.7	C83 A86 L107 R108 K113 K114 C115	C83-C111 WeakPolarHBondContact CA-SG 3.23Å; C83-C111 HydrophobicContact CB-CB 3.75Å; C83-C111 WeakPolarHBondContact CB-SG 3.28Å; C83-C111 WeakPolarHBondContact SG-CB 3.3Å; C83-C111 CovalentContact SG-SG 2.04Å; C83-C111 PolarHBondContact SG-SG 3.37Å; A86-C111 HydrophobicContact CB-CB 4.1Å; L107-C111 PolarHBondContact O-N 3.3Å; R108-C111 PolarHBondContact O-N 2.94Å; C111-K113 VanDerWaalsContact C-N 3.35Å; C111-K113 PolarHBondContact O-N 3.06Å; C111-K114 PolarHBondContact O-N 3.47Å; C111-C115 PolarHBondContact O-N 2.7Å
112	L	92.4	Very high	90.9	Very high	26 Å²	26	68.6 Å²	68.6	14%	0.136	36%	0.364	C	S	.	.	H	α-helix	trans	-60.8	-44	179.8	-73.1	171.6	0	0	0	111.3	C79 C83 R108 A109 K114 C115 K116	C79-L112 HydrophobicContact CB-CD2 4.09Å; C83-L112 HydrophobicContact CB-CD2 3.94Å; C83-L112 HydrophobicContact CB-CG 4.11Å; C83-L112 PolarHBondContact SG-N 3.28Å; C83-L112 VanDerWaalsContact SG-N 3.43Å; R108-L112 HydrophobicContact CG-CD1 4.18Å; R108-L112 WeakPolarHBondContact O-CG 3.23Å; R108-L112 PolarHBondContact O-N 3.25Å; A109-L112 PolarHBondContact O-N 3.49Å; L112-K114 VanDerWaalsContact C-N 3.33Å; L112-K114 PolarHBondContact O-N 2.93Å; L112-C115 PolarHBondContact O-N 3.14Å; L112-K116 WeakPolarHBondContact O-CB 3.35Å; L112-K116 WeakPolarHBondContact O-CG 3.47Å; L112-K116 PolarHBondContact O-N 2.97Å
113	K	91.6	Very high	91	Very high	169 Å²	169	72.9 Å²	72.9	74%	0.735	38%	0.377	S	S	*	.	H	α-helix	trans	-58.2	-44.9	176.3	-177	176.1	-179.6	175.7	0	111.8	A109 C111 A117	A109-K113 WeakPolarHBondContact O-CB 3.4Å; A109-K113 PolarHBondContact O-N 3.23Å; C111-K113 VanDerWaalsContact C-N 3.35Å; C111-K113 PolarHBondContact O-N 3.06Å; K113-A117 WeakPolarHBondContact O-CB 3.29Å; K113-A117 PolarHBondContact O-N 3.27Å
114	K	93.8	Very high	91.2	Very high	158 Å²	158	71.6 Å²	71.6	69%	0.687	37%	0.374	S	S	*	.	H	α-helix	trans	-64.7	-46	177.8	-173.7	-178.9	177.3	-175.1	0	111.4	A110 C111 L112 A117	A110-K114 PolarHBondContact O-N 3.11Å; A110-K114 VanDerWaalsContact O-N 3.1Å; C111-K114 PolarHBondContact O-N 3.47Å; L112-K114 VanDerWaalsContact C-N 3.33Å; L112-K114 PolarHBondContact O-N 2.93Å; K114-A117 PolarHBondContact O-N 2.86Å
115	C	93.8	Very high	91.2	Very high	15 Å²	15	73.4 Å²	73.4	10%	0.101	40%	0.395	C	S	.	.	H	α-helix	trans	-64	-49.3	179.5	-177.9	0	0	0	0	112	C79 C111 L112 A117 E118 F119	C79-C115 WeakPolarHBondContact CA-SG 3.36Å; C79-C115 HydrophobicContact CB-CB 3.78Å; C79-C115 WeakPolarHBondContact CB-SG 3.39Å; C79-C115 WeakPolarHBondContact SG-CB 3.36Å; C79-C115 CovalentContact SG-SG 2.05Å; C79-C115 PolarHBondContact SG-SG 3.24Å; C111-C115 PolarHBondContact O-N 2.7Å; L112-C115 PolarHBondContact O-N 3.14Å; C115-A117 PolarHBondContact O-N 3.23Å; C115-E118 WeakPolarHBondContact O-CB 3.31Å; C115-E118 PolarHBondContact O-N 3.48Å; C115-E118 VanDerWaalsContact O-N 3.09Å; C115-F119 VanDerWaalsContact O-CD2 3.31Å; C115-F119 WeakPolarHBondContact O-CD2 3.39Å
116	K	92.5	Very high	91.2	Very high	29 Å²	29	73.6 Å²	73.6	13%	0.126	39%	0.392	C	S	.	.	H	α-helix	trans	-61.3	-30.2	179.8	-70	-168.6	179.9	-171.5	0	112.2	E76 C79 L112 E118 F119 F122 S243	E76-K116 IonicContact OE1-NZ 2.78Å; C79-K116 HydrophobicContact CB-CG 4.48Å; L112-K116 WeakPolarHBondContact O-CB 3.35Å; L112-K116 WeakPolarHBondContact O-CG 3.47Å; L112-K116 PolarHBondContact O-N 2.97Å; K116-E118 PolarHBondContact O-N 2.82Å; K116-E118 VanDerWaalsContact O-N 3.17Å; K116-F119 PolarHBondContact O-N 3.47Å; K116-F119 VanDerWaalsContact O-N 3.14Å; K116-F122 HydrophobicContact CB-CB 4.39Å; K116-F122 HydrophobicContact CB-CD2 3.53Å; K116-F122 HydrophobicContact CB-CE2 3.91Å; K116-F122 HydrophobicContact CB-CG 4Å; K116-F122 HydrophobicContact CD-CD1 4.15Å; K116-F122 HydrophobicContact CD-CD2 4.25Å; K116-F122 HydrophobicContact CD-CE1 4.08Å; K116-F122 HydrophobicContact CD-CE2 4.19Å; K116-F122 HydrophobicContact CD-CG 4.24Å; K116-F122 HydrophobicContact CD-CZ 4.1Å; K116-F122 HydrophobicContact CG-CD2 3.75Å; K116-F122 HydrophobicContact CG-CE1 4.42Å; K116-F122 HydrophobicContact CG-CE2 3.62Å; K116-F122 HydrophobicContact CG-CG 4.23Å; K116-F122 HydrophobicContact CG-CZ 3.98Å; K116-F122 WeakPolarHBondContact O-CD2 3.45Å; K116-S243 PolarHBondContact NZ-OG 3.43Å; K116-S243 VanDerWaalsContact NZ-OG 3.12Å
117	A	92.3	Very high	91.2	Very high	75 Å²	75	68.7 Å²	68.7	62%	0.62	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-21.3	177.1	0	0	0	0	0	114	K113 K114 C115 F119	K113-A117 WeakPolarHBondContact O-CB 3.29Å; K113-A117 PolarHBondContact O-N 3.27Å; K114-A117 PolarHBondContact O-N 2.86Å; C115-A117 PolarHBondContact O-N 3.23Å; A117-F119 VanDerWaalsContact C-N 3.35Å
118	E	91.4	Very high	91.2	Very high	139 Å²	139	70 Å²	70	65%	0.65	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-16.3	178.6	-61.6	-178.1	-180	0	0	112.9	C115 K116	C115-E118 WeakPolarHBondContact O-CB 3.31Å; C115-E118 PolarHBondContact O-N 3.48Å; C115-E118 VanDerWaalsContact O-N 3.09Å; K116-E118 PolarHBondContact O-N 2.82Å; K116-E118 VanDerWaalsContact O-N 3.17Å
119	F	91.1	Very high	91	Very high	29 Å²	29	73.2 Å²	73.2	13%	0.127	38%	0.379	C	S	.	.			trans	-104.9	125.1	-175.2	-63	-87.1	0	0	0	112.1	F28 S75 F78 C115 K116 A117 V121 F122	F28-F119 HydrophobicContact CE1-CE1 4.23Å; F28-F119 AromaticContact CE2-CE1 3.98Å; F28-F119 HydrophobicContact CE2-CE1 3.98Å; F28-F119 HydrophobicContact CZ-CD1 4.44Å; F28-F119 AromaticContact CZ-CE1 3.5Å; F28-F119 HydrophobicContact CZ-CE1 3.5Å; F28-F119 VanDerWaalsContact CZ-CE1 3.5Å; F28-F119 AromaticContact CZ-CZ 3.91Å; F28-F119 HydrophobicContact CZ-CZ 3.91Å; S75-F119 VanDerWaalsContact OG-CD1 3.27Å; S75-F119 WeakPolarHBondContact OG-CD1 3.33Å; F78-F119 AromaticContact CD1-CE2 3.84Å; F78-F119 HydrophobicContact CD1-CE2 3.84Å; F78-F119 AromaticContact CD1-CZ 3.51Å; F78-F119 HydrophobicContact CD1-CZ 3.51Å; F78-F119 HydrophobicContact CE1-CE2 4.09Å; F78-F119 AromaticContact CE1-CZ 3.72Å; F78-F119 HydrophobicContact CE1-CZ 3.72Å; F78-F119 HydrophobicContact CG-CZ 4.32Å; C115-F119 VanDerWaalsContact O-CD2 3.31Å; C115-F119 WeakPolarHBondContact O-CD2 3.39Å; K116-F119 PolarHBondContact O-N 3.47Å; K116-F119 VanDerWaalsContact O-N 3.14Å; A117-F119 VanDerWaalsContact C-N 3.35Å; F119-V121 HydrophobicContact CB-CG1 4.22Å; F119-V121 PolarHBondContact O-N 3.11Å; F119-F122 HydrophobicContact CB-CD2 3.75Å; F119-F122 HydrophobicContact CB-CE2 3.97Å; F119-F122 HydrophobicContact CD2-CE2 4.27Å; F119-F122 HydrophobicContact CG-CE2 4.34Å; F119-F122 PolarHBondContact O-N 2.74Å
120	P	89.1	Confident	91	Very high	59 Å²	59	74.4 Å²	74.4	38%	0.383	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-59.3	-27.7	178.6	-26.7	35.6	0	0	0	114.8	M36 F122 K123	M36-P120 HydrophobicContact CE-CB 3.89Å; M36-P120 HydrophobicContact SD-CB 4.4Å; P120-F122 PolarHBondContact O-N 3.44Å; P120-K123 WeakPolarHBondContact O-CB 3.11Å; P120-K123 PolarHBondContact O-N 2.91Å; P120-K123 VanDerWaalsContact O-N 3.09Å
121	V	90.6	Very high	91.1	Very high	18 Å²	18	71.8 Å²	71.8	11%	0.109	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-61.4	-29.9	-177.8	73.8	0	0	0	0	112.7	M36 L71 L72 F119 K123	M36-V121 HydrophobicContact CE-CB 4.1Å; L71-V121 HydrophobicContact CD2-CB 3.98Å; L71-V121 HydrophobicContact CD2-CG2 4.24Å; L71-V121 HydrophobicContact CG-CB 4.22Å; L71-V121 HydrophobicContact CG-CG2 4.39Å; L72-V121 HydrophobicContact CB-CG2 3.95Å; L72-V121 HydrophobicContact CD1-CG1 4.28Å; L72-V121 HydrophobicContact CD1-CG2 4.07Å; F119-V121 HydrophobicContact CB-CG1 4.22Å; F119-V121 PolarHBondContact O-N 3.11Å; V121-K123 VanDerWaalsContact C-N 3.31Å; V121-K123 PolarHBondContact O-N 3.32Å
122	F	90.8	Very high	91.1	Very high	40 Å²	40	71.3 Å²	71.3	18%	0.175	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-86.1	3.4	178.8	-58.8	-60.9	0	0	0	114.2	L72 E76 K116 F119 P120 F124	L72-F122 HydrophobicContact CD1-CD1 4.01Å; L72-F122 HydrophobicContact CD1-CE1 3.56Å; L72-F122 HydrophobicContact CD1-CZ 4.39Å; E76-F122 HydrophobicContact CG-CE1 3.59Å; E76-F122 HydrophobicContact CG-CZ 3.56Å; K116-F122 HydrophobicContact CB-CB 4.39Å; K116-F122 HydrophobicContact CB-CD2 3.53Å; K116-F122 HydrophobicContact CB-CE2 3.91Å; K116-F122 HydrophobicContact CB-CG 4Å; K116-F122 HydrophobicContact CD-CD1 4.15Å; K116-F122 HydrophobicContact CD-CD2 4.25Å; K116-F122 HydrophobicContact CD-CE1 4.08Å; K116-F122 HydrophobicContact CD-CE2 4.19Å; K116-F122 HydrophobicContact CD-CG 4.24Å; K116-F122 HydrophobicContact CD-CZ 4.1Å; K116-F122 HydrophobicContact CG-CD2 3.75Å; K116-F122 HydrophobicContact CG-CE1 4.42Å; K116-F122 HydrophobicContact CG-CE2 3.62Å; K116-F122 HydrophobicContact CG-CG 4.23Å; K116-F122 HydrophobicContact CG-CZ 3.98Å; K116-F122 WeakPolarHBondContact O-CD2 3.45Å; F119-F122 HydrophobicContact CB-CD2 3.75Å; F119-F122 HydrophobicContact CB-CE2 3.97Å; F119-F122 HydrophobicContact CD2-CE2 4.27Å; F119-F122 HydrophobicContact CG-CE2 4.34Å; F119-F122 PolarHBondContact O-N 2.74Å; P120-F122 PolarHBondContact O-N 3.44Å; F122-F124 VanDerWaalsContact C-N 3.31Å
123	K	90	Very high	91.1	Very high	167 Å²	167	72.9 Å²	72.9	73%	0.726	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-80.9	-17.3	172.6	-63.3	-177.7	-179.8	179.5	0	112.5	P120 V121	P120-K123 WeakPolarHBondContact O-CB 3.11Å; P120-K123 PolarHBondContact O-N 2.91Å; P120-K123 VanDerWaalsContact O-N 3.09Å; V121-K123 VanDerWaalsContact C-N 3.31Å; V121-K123 PolarHBondContact O-N 3.32Å
124	F	90.1	Very high	91.4	Very high	73 Å²	73	66.6 Å²	66.6	32%	0.32	33%	0.332	S	S	.	.	S	Bend	trans	-91.8	163.1	177.3	-56.5	-66.4	0	0	0	110.8	M36 P38 F122	M36-F124 HydrophobicContact CB-CE2 4.14Å; M36-F124 HydrophobicContact CB-CZ 4.23Å; M36-F124 HydrophobicContact CE-CD2 4.35Å; M36-F124 HydrophobicContact CE-CE2 3.71Å; P38-F124 HydrophobicContact CB-CB 4.41Å; P38-F124 HydrophobicContact CG-CB 4.25Å; P38-F124 HydrophobicContact CG-CD1 3.82Å; P38-F124 HydrophobicContact CG-CE1 4.48Å; P38-F124 HydrophobicContact CG-CG 4.16Å; F122-F124 VanDerWaalsContact C-N 3.31Å
125	S	87.4	Confident	91.5	Very high	108 Å²	108	59.1 Å²	59.1	76%	0.755	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-57.9	138.2	172.1	-48.8	0	0	0	0	109.9
126	Y	89	Confident	91.5	Very high	68 Å²	68	61.3 Å²	61.3	27%	0.267	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-67.9	139.6	-179.5	-162.9	-100.8	0	0	0	110.2	L72 E76 L132 S243	L72-Y126 HydrophobicContact CD1-CE2 4.02Å; L72-Y126 HydrophobicContact CD2-CE2 4.12Å; L72-Y126 HydrophobicContact CG-CE2 4.47Å; E76-Y126 WeakPolarHBondContact OE1-CE2 3.19Å; E76-Y126 PolarHBondContact OE1-OH 3.13Å; E76-Y126 PolarHBondContact OE2-OH 3.09Å; E76-Y126 VanDerWaalsContact OE2-OH 3.13Å; Y126-L132 HydrophobicContact CE1-CD1 3.81Å; Y126-S243 WeakPolarHBondContact CD1-O 3.22Å; Y126-S243 WeakPolarHBondContact CE1-O 3.35Å; Y126-S243 PolarHBondContact OH-O 2.75Å
127	P	90.9	Very high	91.6	Very high	10 Å²	10	65 Å²	65	7%	0.065	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-62.9	146.1	178.9	-22.5	35.2	0	0	0	112.3	L39 L72 L131 L132	L39-P127 HydrophobicContact CB-CG 4.05Å; L39-P127 HydrophobicContact CD2-CB 4.14Å; L39-P127 HydrophobicContact CD2-CG 3.8Å; L39-P127 HydrophobicContact CG-CG 4.48Å; L72-P127 HydrophobicContact CD2-CG 3.64Å; P127-L131 HydrophobicContact CB-CD2 4.22Å; P127-L132 HydrophobicContact CB-CD2 3.87Å; P127-L132 HydrophobicContact CB-CG 4.07Å; P127-L132 HydrophobicContact CG-CD2 4.14Å
128	R	90.1	Very high	91.8	Very high	95 Å²	95	62.4 Å²	62.4	36%	0.358	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-63.2	152.9	171.9	-61.7	-173.7	-71	124.9	2.7	111.2	E40 D130 L131 L132	E40-R128 IonicContact OE1-CZ 2.9Å; E40-R128 IonicContact OE1-NE 3.66Å; E40-R128 PolarHBondContact OE1-NE 3.5Å; E40-R128 IonicContact OE1-NH2 2.87Å; E40-R128 PolarHBondContact OE1-NH2 3.22Å; E40-R128 IonicContact OE2-NE 3.97Å; R128-D130 WeakPolarHBondContact CB-OD1 3.34Å; R128-D130 IonicContact CZ-OD1 2.62Å; R128-D130 IonicContact CZ-OD2 3.1Å; R128-D130 IonicContact NH1-OD1 3.88Å; R128-D130 PolarHBondContact NH1-OD1 3.4Å; R128-D130 IonicContact NH1-OD2 2.78Å; R128-D130 PolarHBondContact NH1-OD2 3.17Å; R128-D130 IonicContact NH2-OD2 3.19Å; R128-D130 PolarHBondContact O-N 2.86Å; R128-L131 WeakPolarHBondContact O-CB 3.45Å; R128-L131 PolarHBondContact O-N 3.13Å; R128-L132 PolarHBondContact O-N 3.28Å; R128-L132 VanDerWaalsContact O-N 3.14Å
129	R	87.6	Confident	92	Very high	103 Å²	103	57.6 Å²	57.6	39%	0.389	28%	0.277	S	S	.	.	H	α-helix	trans	-62.1	-42.9	-175.9	-177.2	177.2	177.3	149.6	1.8	113	L131 L132 E133 D262	R129-L131 VanDerWaalsContact C-N 3.28Å; R129-L131 PolarHBondContact O-N 3.35Å; R129-L132 PolarHBondContact O-N 3.01Å; R129-E133 IonicContact NE-OE1 3.67Å; R129-E133 PolarHBondContact NE-OE1 3Å; R129-E133 WeakPolarHBondContact O-CG 3.34Å; R129-E133 PolarHBondContact O-N 3.41Å; R129-D262 IonicContact CZ-OD1 2.78Å; R129-D262 IonicContact NH1-OD1 2.94Å; R129-D262 PolarHBondContact NH1-OD1 3.41Å; R129-D262 IonicContact NH1-OD2 3.77Å; R129-D262 PolarHBondContact NH1-OD2 3.43Å; R129-D262 IonicContact NH2-OD1 3.37Å
130	D	91.2	Very high	92.4	Very high	79 Å²	79	56.2 Å²	56.2	42%	0.422	27%	0.271	S	S	.	.	H	α-helix	trans	-58.8	-39.2	176.1	62.1	-34.8	0	0	0	112.2	R128 E133 T134	R128-D130 WeakPolarHBondContact CB-OD1 3.34Å; R128-D130 IonicContact CZ-OD1 2.62Å; R128-D130 IonicContact CZ-OD2 3.1Å; R128-D130 IonicContact NH1-OD1 3.88Å; R128-D130 PolarHBondContact NH1-OD1 3.4Å; R128-D130 IonicContact NH1-OD2 2.78Å; R128-D130 PolarHBondContact NH1-OD2 3.17Å; R128-D130 IonicContact NH2-OD2 3.19Å; R128-D130 PolarHBondContact O-N 2.86Å; D130-E133 PolarHBondContact O-N 3.21Å; D130-T134 PolarHBondContact O-N 3.37Å; D130-T134 PolarHBondContact O-OG1 2.95Å
131	L	94.4	Very high	92.7	Very high	7 Å²	7	53.4 Å²	53.4	4%	0.037	25%	0.253	C	S	.	.	H	α-helix	trans	-65.1	-47.3	174.7	-175.6	61.8	0	0	0	110.8	L39 E40 Y43 P127 R128 R129 E133 T134 F135	L39-L131 HydrophobicContact CD2-CD2 4.45Å; L39-L131 HydrophobicContact CG-CD2 4.23Å; E40-L131 VanDerWaalsContact CA-CD2 3.5Å; E40-L131 HydrophobicContact CB-CD2 3.55Å; E40-L131 HydrophobicContact CG-CD2 3.97Å; Y43-L131 HydrophobicContact CD1-CD1 3.42Å; Y43-L131 VanDerWaalsContact CD1-CD1 3.42Å; Y43-L131 HydrophobicContact CE1-CD1 3.89Å; Y43-L131 HydrophobicContact CG-CD1 4.08Å; P127-L131 HydrophobicContact CB-CD2 4.22Å; R128-L131 WeakPolarHBondContact O-CB 3.45Å; R128-L131 PolarHBondContact O-N 3.13Å; R129-L131 VanDerWaalsContact C-N 3.28Å; R129-L131 PolarHBondContact O-N 3.35Å; L131-E133 VanDerWaalsContact C-N 3.32Å; L131-E133 PolarHBondContact O-N 3.03Å; L131-T134 WeakPolarHBondContact O-CB 3.49Å; L131-T134 PolarHBondContact O-N 3.46Å; L131-T134 VanDerWaalsContact O-N 3.1Å; L131-F135 HydrophobicContact CD1-CD2 4.22Å; L131-F135 HydrophobicContact CD1-CE2 3.71Å; L131-F135 HydrophobicContact CG-CD2 4.28Å; L131-F135 HydrophobicContact CG-CE2 4.02Å; L131-F135 VanDerWaalsContact O-CD2 3.27Å; L131-F135 WeakPolarHBondContact O-CD2 3.46Å; L131-F135 PolarHBondContact O-N 3.34Å
132	L	93.2	Very high	93	Very high	30 Å²	30	56.5 Å²	56.5	16%	0.157	26%	0.263	C	S	.	.	H	α-helix	trans	-59.7	-43.1	177.1	-64.9	177.2	0	0	0	111.7	L39 L72 Y126 P127 R128 R129 T134 F135 E136	L39-L132 HydrophobicContact CD2-CD2 4.32Å; L72-L132 HydrophobicContact CD2-CD2 4.28Å; Y126-L132 HydrophobicContact CE1-CD1 3.81Å; P127-L132 HydrophobicContact CB-CD2 3.87Å; P127-L132 HydrophobicContact CB-CG 4.07Å; P127-L132 HydrophobicContact CG-CD2 4.14Å; R128-L132 PolarHBondContact O-N 3.28Å; R128-L132 VanDerWaalsContact O-N 3.14Å; R129-L132 PolarHBondContact O-N 3.01Å; L132-T134 VanDerWaalsContact C-N 3.27Å; L132-T134 PolarHBondContact O-N 3.42Å; L132-F135 PolarHBondContact O-N 2.93Å; L132-F135 VanDerWaalsContact O-N 3.08Å; L132-E136 WeakPolarHBondContact O-CG 3.43Å; L132-E136 PolarHBondContact O-N 3.34Å
133	E	93.2	Very high	93.3	Very high	60 Å²	60	57.6 Å²	57.6	28%	0.28	27%	0.266	S	S	.	.	H	α-helix	trans	-60.7	-35.4	175.2	-71.8	179.8	-167.6	0	0	112.5	R129 D130 L131 F135 E136 K137	R129-E133 IonicContact NE-OE1 3.67Å; R129-E133 PolarHBondContact NE-OE1 3Å; R129-E133 WeakPolarHBondContact O-CG 3.34Å; R129-E133 PolarHBondContact O-N 3.41Å; D130-E133 PolarHBondContact O-N 3.21Å; L131-E133 VanDerWaalsContact C-N 3.32Å; L131-E133 PolarHBondContact O-N 3.03Å; E133-F135 VanDerWaalsContact C-N 3.32Å; E133-F135 PolarHBondContact O-N 3.49Å; E133-E136 PolarHBondContact O-N 3.5Å; E133-K137 WeakPolarHBondContact O-CB 3.28Å; E133-K137 WeakPolarHBondContact O-CG 3.36Å; E133-K137 PolarHBondContact O-N 2.89Å
134	T	96.5	Very high	93.6	Very high	36 Å²	36	49.9 Å²	49.9	22%	0.221	23%	0.232	C	C	.	.	H	α-helix	trans	-59.7	-41.7	173.5	-61.3	0	0	0	0	111.4	Y43 D130 L131 L132 R138 I139	Y43-T134 HydrophobicContact CE1-CG2 4.24Å; Y43-T134 WeakPolarHBondContact OH-CG2 3.33Å; D130-T134 PolarHBondContact O-N 3.37Å; D130-T134 PolarHBondContact O-OG1 2.95Å; L131-T134 WeakPolarHBondContact O-CB 3.49Å; L131-T134 PolarHBondContact O-N 3.46Å; L131-T134 VanDerWaalsContact O-N 3.1Å; L132-T134 VanDerWaalsContact C-N 3.27Å; L132-T134 PolarHBondContact O-N 3.42Å; T134-R138 PolarHBondContact O-N 3.33Å; T134-I139 HydrophobicContact CG2-CB 3.6Å; T134-I139 HydrophobicContact CG2-CG1 4.05Å; T134-I139 HydrophobicContact CG2-CG2 3.9Å; T134-I139 WeakPolarHBondContact O-CB 3.21Å; T134-I139 WeakPolarHBondContact O-CG1 3.2Å; T134-I139 PolarHBondContact O-N 3.04Å
135	F	96.1	Very high	93.9	Very high	1 Å²	1	46.5 Å²	46.5	0%	0.004	22%	0.218	C	C	.	.	H	α-helix	trans	-73.3	-40	175.4	-77.7	-90.5	0	0	0	112.6	L39 Y43 L66 H69 L131 L132 E133 K137 R138 P140	L39-F135 HydrophobicContact CD1-CE1 4.26Å; L39-F135 HydrophobicContact CD1-CE2 3.97Å; L39-F135 HydrophobicContact CD1-CZ 3.71Å; L39-F135 HydrophobicContact CD2-CD2 4.31Å; L39-F135 HydrophobicContact CD2-CE2 4.12Å; L39-F135 HydrophobicContact CG-CE2 4.12Å; L39-F135 HydrophobicContact CG-CZ 4.36Å; Y43-F135 HydrophobicContact CD2-CE2 4.37Å; Y43-F135 AromaticContact CD2-CZ 3.95Å; Y43-F135 HydrophobicContact CD2-CZ 3.95Å; Y43-F135 HydrophobicContact CG-CE2 4.3Å; Y43-F135 HydrophobicContact CG-CZ 4.2Å; L66-F135 HydrophobicContact CD2-CD1 3.83Å; L66-F135 HydrophobicContact CD2-CE1 3.95Å; L66-F135 HydrophobicContact CG-CE1 4.17Å; H69-F135 HydrophobicContact CB-CD1 3.65Å; H69-F135 HydrophobicContact CB-CE1 3.97Å; H69-F135 HydrophobicContact CB-CG 4.03Å; H69-F135 AromaticContact CD2-CG 3.95Å; H69-F135 VanDerWaalsContact CE1-CB 3.43Å; H69-F135 WeakPolarHBondContact CE1-CB 3.34Å; H69-F135 AromaticContact CG-CD1 3.68Å; H69-F135 AromaticContact CG-CG 3.67Å; H69-F135 AromaticContact ND1-CD1 3.82Å; H69-F135 AromaticContact ND1-CG 3.89Å; L131-F135 HydrophobicContact CD1-CD2 4.22Å; L131-F135 HydrophobicContact CD1-CE2 3.71Å; L131-F135 HydrophobicContact CG-CD2 4.28Å; L131-F135 HydrophobicContact CG-CE2 4.02Å; L131-F135 VanDerWaalsContact O-CD2 3.27Å; L131-F135 WeakPolarHBondContact O-CD2 3.46Å; L131-F135 PolarHBondContact O-N 3.34Å; L132-F135 PolarHBondContact O-N 2.93Å; L132-F135 VanDerWaalsContact O-N 3.08Å; E133-F135 VanDerWaalsContact C-N 3.32Å; E133-F135 PolarHBondContact O-N 3.49Å; F135-K137 PolarHBondContact O-N 2.98Å; F135-R138 WeakPolarHBondContact O-CA 3.48Å; F135-R138 PolarHBondContact O-N 2.85Å; F135-P140 HydrophobicContact CD1-CG 3.77Å; F135-P140 HydrophobicContact CE1-CG 3.62Å; F135-P140 HydrophobicContact CG-CG 4.33Å; F135-P140 HydrophobicContact CZ-CG 4.06Å
136	E	93.6	Very high	94.2	Very high	62 Å²	62	42.9 Å²	42.9	29%	0.29	19%	0.188	S	C	.	.	H	α-helix	trans	-59.2	-35.3	175.4	-71.2	-175.2	161.3	0	0	112.3	L132 E133 R138 R269 Q273	L132-E136 WeakPolarHBondContact O-CG 3.43Å; L132-E136 PolarHBondContact O-N 3.34Å; E133-E136 PolarHBondContact O-N 3.5Å; E136-R138 PolarHBondContact O-N 2.92Å; E136-R269 IonicContact OE2-NH1 3.78Å; E136-Q273 PolarHBondContact OE1-NE2 2.94Å; E136-Q273 VanDerWaalsContact OE1-NE2 3.07Å; E136-Q273 PolarHBondContact OE2-NE2 3.07Å; E136-Q273 VanDerWaalsContact OE2-NE2 3.11Å
137	K	94.8	Very high	94.6	Very high	107 Å²	107	39.6 Å²	39.6	47%	0.465	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	3.2	174.7	-69.7	174.4	-175.7	173.1	0	113.5	E133 F135 I139 N168	E133-K137 WeakPolarHBondContact O-CB 3.28Å; E133-K137 WeakPolarHBondContact O-CG 3.36Å; E133-K137 PolarHBondContact O-N 2.89Å; F135-K137 PolarHBondContact O-N 2.98Å; K137-I139 HydrophobicContact CB-CD1 4.03Å; K137-I139 HydrophobicContact CB-CG1 3.85Å; K137-I139 PolarHBondContact O-N 3.41Å; K137-I139 VanDerWaalsContact O-N 3.16Å; K137-N168 PolarHBondContact O-ND2 3.13Å
138	R	96.3	Very high	94.9	Very high	20 Å²	20	39.9 Å²	39.9	8%	0.075	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	25.2	-177.8	-62.6	-170.7	-175	174.4	0.6	113.8	T134 F135 E136 P140 Y141 T163 F164 K166 K167 D193 E195	T134-R138 PolarHBondContact O-N 3.33Å; F135-R138 WeakPolarHBondContact O-CA 3.48Å; F135-R138 PolarHBondContact O-N 2.85Å; E136-R138 PolarHBondContact O-N 2.92Å; R138-P140 VanDerWaalsContact C-N 3.33Å; R138-Y141 HydrophobicContact CB-CD2 3.78Å; R138-Y141 HydrophobicContact CB-CE2 4.25Å; R138-Y141 HydrophobicContact CG-CD2 4.36Å; R138-Y141 HydrophobicContact CG-CE2 4.35Å; R138-Y141 WeakPolarHBondContact O-CB 3.4Å; R138-Y141 WeakPolarHBondContact O-CD2 3.37Å; R138-Y141 PolarHBondContact O-N 3.47Å; R138-Y141 VanDerWaalsContact O-N 3.08Å; R138-T163 WeakPolarHBondContact CD-O 3.48Å; R138-T163 PolarHBondContact NH1-O 3.19Å; R138-F164 VanDerWaalsContact O-CD2 3.29Å; R138-F164 WeakPolarHBondContact O-CD2 3.4Å; R138-K166 VanDerWaalsContact NH1-CB 3.33Å; R138-K167 HydrophobicContact CB-CB 4.35Å; R138-K167 HydrophobicContact CG-CB 3.94Å; R138-K167 HydrophobicContact CG-CG 4.2Å; R138-D193 IonicContact CZ-OD1 2.8Å; R138-D193 IonicContact CZ-OD2 3.19Å; R138-D193 IonicContact NH1-OD1 3.97Å; R138-D193 PolarHBondContact NH1-OD1 3.32Å; R138-D193 VanDerWaalsContact NH1-OD1 3.14Å; R138-D193 IonicContact NH1-OD2 3.8Å; R138-D193 PolarHBondContact NH1-OD2 3.18Å; R138-D193 IonicContact NH2-OD2 3.37Å; R138-E195 IonicContact NE-OE2 3.35Å; R138-E195 PolarHBondContact NE-OE2 3.36Å; R138-E195 PolarHBondContact NH2-O 2.85Å
139	I	97.1	Very high	95.1	Very high	37 Å²	37	37.7 Å²	37.7	19%	0.19	17%	0.167	C	C	.	.	H	α-helix	trans	-56.3	-35.6	-179.7	-58.2	-57.2	0	0	0	113.9	T134 K137 Y141 R142 Y143 F164	T134-I139 HydrophobicContact CG2-CB 3.6Å; T134-I139 HydrophobicContact CG2-CG1 4.05Å; T134-I139 HydrophobicContact CG2-CG2 3.9Å; T134-I139 WeakPolarHBondContact O-CB 3.21Å; T134-I139 WeakPolarHBondContact O-CG1 3.2Å; T134-I139 PolarHBondContact O-N 3.04Å; K137-I139 HydrophobicContact CB-CD1 4.03Å; K137-I139 HydrophobicContact CB-CG1 3.85Å; K137-I139 PolarHBondContact O-N 3.41Å; K137-I139 VanDerWaalsContact O-N 3.16Å; I139-Y141 PolarHBondContact O-N 3Å; I139-R142 WeakPolarHBondContact O-CB 3.04Å; I139-R142 PolarHBondContact O-N 3.49Å; I139-Y143 HydrophobicContact CG2-CD2 4.4Å; I139-Y143 HydrophobicContact CG2-CE2 3.8Å; I139-F164 HydrophobicContact CD1-CE2 3.99Å; I139-F164 HydrophobicContact CD1-CZ 4.45Å
140	P	97.6	Very high	95.5	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-53.4	-32.2	176.2	-29.5	36.6	0	0	0	114	Y43 L62 L66 F135 R138 R142 Y143 I144	Y43-P140 HydrophobicContact CE2-CB 4.4Å; Y43-P140 HydrophobicContact CE2-CG 4.01Å; L62-P140 HydrophobicContact CD2-CB 4.39Å; L66-P140 HydrophobicContact CD1-CB 4.02Å; L66-P140 HydrophobicContact CD2-CB 3.98Å; L66-P140 HydrophobicContact CD2-CG 4.07Å; L66-P140 HydrophobicContact CG-CB 4.05Å; L66-P140 HydrophobicContact CG-CG 4.49Å; F135-P140 HydrophobicContact CD1-CG 3.77Å; F135-P140 HydrophobicContact CE1-CG 3.62Å; F135-P140 HydrophobicContact CG-CG 4.33Å; F135-P140 HydrophobicContact CZ-CG 4.06Å; R138-P140 VanDerWaalsContact C-N 3.33Å; P140-R142 VanDerWaalsContact C-N 3.27Å; P140-R142 PolarHBondContact O-N 2.91Å; P140-Y143 PolarHBondContact O-N 3.22Å; P140-I144 WeakPolarHBondContact O-CG1 3.34Å; P140-I144 PolarHBondContact O-N 2.85Å
141	Y	97.1	Very high	95.7	Very high	1 Å²	1	36.1 Å²	36.1	0%	0.004	16%	0.163	C	C	.	.	H	α-helix	trans	-67.3	-26.2	177.6	-66.3	-86.3	0	0	0	113.5	Y23 L66 R138 I139 Y143 I144 Q145 A160 T163 H194 E195	Y23-Y141 WeakPolarHBondContact CE2-OH 3.49Å; Y23-Y141 WeakPolarHBondContact OH-CE1 3.31Å; Y23-Y141 PolarHBondContact OH-OH 2.86Å; L66-Y141 HydrophobicContact CD1-CE1 4.28Å; L66-Y141 HydrophobicContact CD1-CE2 4.15Å; L66-Y141 HydrophobicContact CD2-CE2 3.83Å; R138-Y141 HydrophobicContact CB-CD2 3.78Å; R138-Y141 HydrophobicContact CB-CE2 4.25Å; R138-Y141 HydrophobicContact CG-CD2 4.36Å; R138-Y141 HydrophobicContact CG-CE2 4.35Å; R138-Y141 WeakPolarHBondContact O-CB 3.4Å; R138-Y141 WeakPolarHBondContact O-CD2 3.37Å; R138-Y141 PolarHBondContact O-N 3.47Å; R138-Y141 VanDerWaalsContact O-N 3.08Å; I139-Y141 PolarHBondContact O-N 3Å; Y141-Y143 VanDerWaalsContact C-N 3.27Å; Y141-Y143 PolarHBondContact O-N 3.38Å; Y141-I144 PolarHBondContact O-N 3.16Å; Y141-Q145 WeakPolarHBondContact O-CG 3.39Å; Y141-Q145 PolarHBondContact O-N 2.74Å; Y141-A160 HydrophobicContact CD1-CB 4.14Å; Y141-T163 HydrophobicContact CD1-CG2 3.71Å; Y141-T163 HydrophobicContact CD2-CG2 3.92Å; Y141-T163 HydrophobicContact CE1-CG2 3.41Å; Y141-T163 VanDerWaalsContact CE1-CG2 3.41Å; Y141-T163 HydrophobicContact CE2-CG2 3.65Å; Y141-T163 HydrophobicContact CG-CG2 3.94Å; Y141-H194 HydrophobicContact CE1-CB 4.06Å; Y141-E195 HydrophobicContact CE2-CG 4.14Å; Y141-E195 WeakPolarHBondContact CE2-OE1 2.89Å; Y141-E195 WeakPolarHBondContact OH-CG 3.12Å; Y141-E195 PolarHBondContact OH-OE1 3.1Å
142	R	95.7	Very high	95.7	Very high	83 Å²	83	42.4 Å²	42.4	31%	0.313	20%	0.197	S	C	.	.	H	α-helix	trans	-60.4	-39.8	172.9	179.8	175.3	179	-165.8	-0.1	111.5	I139 P140 Q145 F164 L174	I139-R142 WeakPolarHBondContact O-CB 3.04Å; I139-R142 PolarHBondContact O-N 3.49Å; P140-R142 VanDerWaalsContact C-N 3.27Å; P140-R142 PolarHBondContact O-N 2.91Å; R142-Q145 WeakPolarHBondContact O-CG 3.2Å; R142-Q145 PolarHBondContact O-NE2 2.92Å; R142-Q145 VanDerWaalsContact O-NE2 3.08Å; R142-F164 HydrophobicContact CB-CD2 4.15Å; R142-F164 HydrophobicContact CB-CE2 4Å; R142-L174 HydrophobicContact CG-CD1 4.02Å
143	Y	97	Very high	95.8	Very high	63 Å²	63	43.2 Å²	43.2	25%	0.247	20%	0.202	C	C	.	.	H	α-helix	trans	-78	-45.1	176.1	-61.4	-75.6	0	0	0	111.6	Y43 L47 Y50 I139 P140 Y141 Q145 Y146 A147	Y43-Y143 WeakPolarHBondContact OH-CE2 3.38Å; L47-Y143 HydrophobicContact CD2-CD1 4.08Å; L47-Y143 HydrophobicContact CD2-CD2 3.94Å; L47-Y143 HydrophobicContact CD2-CE1 4Å; L47-Y143 HydrophobicContact CD2-CE2 3.84Å; L47-Y143 HydrophobicContact CD2-CG 4.06Å; Y50-Y143 HydrophobicContact CD1-CD1 4.18Å; Y50-Y143 HydrophobicContact CD2-CD1 4.17Å; Y50-Y143 AromaticContact CE1-CD1 3.97Å; Y50-Y143 HydrophobicContact CE1-CD1 3.97Å; Y50-Y143 HydrophobicContact CE1-CE1 4.45Å; Y50-Y143 AromaticContact CE2-CD1 3.95Å; Y50-Y143 HydrophobicContact CE2-CD1 3.95Å; Y50-Y143 HydrophobicContact CE2-CG 4.48Å; Y50-Y143 WeakPolarHBondContact CE2-O 3.37Å; Y50-Y143 HydrophobicContact CG-CD1 4.26Å; Y50-Y143 AromaticContact CZ-CD1 3.83Å; I139-Y143 HydrophobicContact CG2-CD2 4.4Å; I139-Y143 HydrophobicContact CG2-CE2 3.8Å; P140-Y143 PolarHBondContact O-N 3.22Å; Y141-Y143 VanDerWaalsContact C-N 3.27Å; Y141-Y143 PolarHBondContact O-N 3.38Å; Y143-Q145 VanDerWaalsContact C-N 3.33Å; Y143-Q145 PolarHBondContact O-N 3.22Å; Y143-Y146 PolarHBondContact O-N 3.38Å; Y143-A147 PolarHBondContact O-N 2.86Å
144	I	96.8	Very high	95.7	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.021	20%	0.2	C	C	.	.	H	α-helix	trans	-57.3	-45.3	-179.5	-70.8	174.5	0	0	0	111.4	L62 E63 L66 P140 Y141 Y146 A147 Y148 A160	L62-I144 HydrophobicContact CB-CD1 3.84Å; L62-I144 HydrophobicContact CB-CG1 3.57Å; L62-I144 HydrophobicContact CD1-CG1 3.72Å; L62-I144 HydrophobicContact CG-CG1 4.19Å; E63-I144 HydrophobicContact CG-CD1 4.37Å; L66-I144 HydrophobicContact CD1-CD1 3.35Å; P140-I144 WeakPolarHBondContact O-CG1 3.34Å; P140-I144 PolarHBondContact O-N 2.85Å; Y141-I144 PolarHBondContact O-N 3.16Å; I144-Y146 VanDerWaalsContact C-N 3.29Å; I144-Y146 PolarHBondContact O-N 2.93Å; I144-A147 PolarHBondContact O-N 2.73Å; I144-Y148 HydrophobicContact CG2-CD2 3.35Å; I144-Y148 HydrophobicContact CG2-CE2 3.34Å; I144-Y148 WeakPolarHBondContact O-CB 3.23Å; I144-Y148 WeakPolarHBondContact O-CD2 3.26Å; I144-Y148 PolarHBondContact O-N 2.81Å; I144-A160 HydrophobicContact CB-CB 4.34Å; I144-A160 HydrophobicContact CG2-CB 3.76Å
145	Q	95.6	Very high	95.6	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.009	21%	0.21	C	C	.	.	H	α-helix	trans	-61	-40.3	-178.2	67.5	78	35.5	0	0	112.2	Y141 R142 Y143 Y148 Y149 A157 A160 T161 L174 N177 Y181	Y141-Q145 WeakPolarHBondContact O-CG 3.39Å; Y141-Q145 PolarHBondContact O-N 2.74Å; R142-Q145 WeakPolarHBondContact O-CG 3.2Å; R142-Q145 PolarHBondContact O-NE2 2.92Å; R142-Q145 VanDerWaalsContact O-NE2 3.08Å; Y143-Q145 VanDerWaalsContact C-N 3.33Å; Y143-Q145 PolarHBondContact O-N 3.22Å; Q145-Y148 PolarHBondContact O-N 3.31Å; Q145-Y149 WeakPolarHBondContact O-CB 3.4Å; Q145-Y149 PolarHBondContact O-N 3.2Å; Q145-A157 WeakPolarHBondContact CB-O 3.27Å; Q145-A157 WeakPolarHBondContact O-CB 3.46Å; Q145-A160 HydrophobicContact CB-CB 3.8Å; Q145-T161 VanDerWaalsContact CB-OG1 3.25Å; Q145-T161 WeakPolarHBondContact CB-OG1 3.38Å; Q145-L174 HydrophobicContact CG-CD2 4.09Å; Q145-N177 PolarHBondContact OE1-ND2 3.25Å; Q145-Y181 PolarHBondContact OE1-OH 2.97Å
146	Y	95.3	Very high	95.5	Very high	32 Å²	32	48.1 Å²	48.1	13%	0.125	22%	0.222	C	C	.	.	H	α-helix	trans	-71.4	-43.7	-179.5	-174.3	-102.3	0	0	0	111.2	Y50 W55 Y143 I144 Y148 Y149 Q150	Y50-Y146 AromaticContact CE2-CD1 4Å; Y50-Y146 HydrophobicContact CE2-CD1 4Å; Y50-Y146 AromaticContact CZ-CD1 3.63Å; Y50-Y146 WeakPolarHBondContact OH-CB 3.42Å; Y50-Y146 WeakPolarHBondContact OH-CD1 3.41Å; W55-Y146 HydrophobicContact CH2-CD1 4.01Å; W55-Y146 AromaticContact CH2-CE1 3.54Å; W55-Y146 HydrophobicContact CH2-CE1 3.54Å; W55-Y146 HydrophobicContact CZ2-CE1 4.15Å; W55-Y146 AromaticContact CZ3-CD1 3.85Å; W55-Y146 HydrophobicContact CZ3-CD1 3.85Å; W55-Y146 AromaticContact CZ3-CE1 3.89Å; W55-Y146 HydrophobicContact CZ3-CE1 3.89Å; Y143-Y146 PolarHBondContact O-N 3.38Å; I144-Y146 VanDerWaalsContact C-N 3.29Å; I144-Y146 PolarHBondContact O-N 2.93Å; Y146-Y148 VanDerWaalsContact C-N 3.28Å; Y146-Y148 PolarHBondContact O-N 3.4Å; Y146-Y149 WeakPolarHBondContact O-CB 3.13Å; Y146-Y149 PolarHBondContact O-N 3.17Å; Y146-Q150 HydrophobicContact CD1-CG 4.01Å; Y146-Q150 HydrophobicContact CE1-CG 3.73Å; Y146-Q150 WeakPolarHBondContact O-CG 3.37Å; Y146-Q150 PolarHBondContact O-N 3.16Å; Y146-Q150 PolarHBondContact OH-NE2 2.85Å
147	A	96.8	Very high	95.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.1	-37	177.8	0	0	0	0	0	111.5	Y50 W55 V59 Y143 I144 Q150 L151	Y50-A147 HydrophobicContact CD2-CB 4.42Å; Y50-A147 HydrophobicContact CE2-CB 4.31Å; W55-A147 HydrophobicContact CB-CB 4.39Å; W55-A147 HydrophobicContact CE3-CB 3.91Å; V59-A147 HydrophobicContact CG2-CB 3.43Å; V59-A147 VanDerWaalsContact CG2-CB 3.43Å; Y143-A147 PolarHBondContact O-N 2.86Å; I144-A147 PolarHBondContact O-N 2.73Å; A147-Q150 PolarHBondContact O-N 3.26Å; A147-L151 VanDerWaalsContact O-CG 3.27Å; A147-L151 WeakPolarHBondContact O-CG 3.45Å; A147-L151 PolarHBondContact O-N 2.56Å; A147-L151 VanDerWaalsContact O-N 3.12Å
148	Y	96.3	Very high	95.7	Very high	16 Å²	16	40 Å²	40	6%	0.063	19%	0.186	C	C	.	.	H	α-helix	trans	-67	-39.5	172.6	-84.8	-49.4	0	0	0	113.4	V59 E63 I144 Q145 Y146 Q150 L151 N152 N153 K156	V59-Y148 HydrophobicContact CG1-CD1 4.47Å; V59-Y148 HydrophobicContact CG1-CE1 3.7Å; V59-Y148 HydrophobicContact CG1-CE2 3.91Å; V59-Y148 WeakPolarHBondContact CG1-OH 3.34Å; V59-Y148 HydrophobicContact CG2-CD1 4.42Å; V59-Y148 HydrophobicContact CG2-CE1 4.41Å; E63-Y148 PolarHBondContact OE1-OH 3.17Å; I144-Y148 HydrophobicContact CG2-CD2 3.35Å; I144-Y148 HydrophobicContact CG2-CE2 3.34Å; I144-Y148 WeakPolarHBondContact O-CB 3.23Å; I144-Y148 WeakPolarHBondContact O-CD2 3.26Å; I144-Y148 PolarHBondContact O-N 2.81Å; Q145-Y148 PolarHBondContact O-N 3.31Å; Y146-Y148 VanDerWaalsContact C-N 3.28Å; Y146-Y148 PolarHBondContact O-N 3.4Å; Y148-Q150 VanDerWaalsContact C-N 3.34Å; Y148-Q150 PolarHBondContact O-N 3.47Å; Y148-L151 HydrophobicContact CD1-CD1 4.49Å; Y148-L151 CarbonylContact O-C 3.55Å; Y148-L151 PolarHBondContact O-N 2.89Å; Y148-L151 VanDerWaalsContact O-N 3.17Å; Y148-N152 PolarHBondContact O-N 2.78Å; Y148-N153 HydrophobicContact CD1-CB 3.99Å; Y148-N153 PolarHBondContact O-N 3.26Å; Y148-K156 HydrophobicContact CD1-CB 3.9Å; Y148-K156 HydrophobicContact CD1-CD 4.07Å; Y148-K156 HydrophobicContact CD2-CB 3.58Å; Y148-K156 HydrophobicContact CE1-CB 4.04Å; Y148-K156 HydrophobicContact CE1-CD 3.46Å; Y148-K156 VanDerWaalsContact CE1-CD 3.46Å; Y148-K156 HydrophobicContact CE1-CG 4.41Å; Y148-K156 HydrophobicContact CE2-CB 3.75Å; Y148-K156 HydrophobicContact CE2-CD 4.03Å; Y148-K156 HydrophobicContact CG-CB 3.67Å; Y148-K156 VanDerWaalsContact CZ-CD 3.43Å
149	Y	94.5	Very high	95.6	Very high	49 Å²	49	39.3 Å²	39.3	19%	0.192	18%	0.183	C	C	.	.	H	α-helix	trans	-57.8	-46.9	172.7	174.1	-99.3	0	0	0	111.5	Q145 Y146 L151 N152 M154 Y180 Y181	Q145-Y149 WeakPolarHBondContact O-CB 3.4Å; Q145-Y149 PolarHBondContact O-N 3.2Å; Y146-Y149 WeakPolarHBondContact O-CB 3.13Å; Y146-Y149 PolarHBondContact O-N 3.17Å; Y149-L151 PolarHBondContact O-N 2.75Å; Y149-N152 WeakPolarHBondContact O-CA 3.48Å; Y149-N152 PolarHBondContact O-N 3.37Å; Y149-M154 HydrophobicContact CD2-CE 3.77Å; Y149-M154 HydrophobicContact CD2-SD 3.49Å; Y149-M154 WeakPolarHBondContact CD2-SD 3.47Å; Y149-M154 HydrophobicContact CE2-CE 3.53Å; Y149-M154 HydrophobicContact CE2-SD 3.87Å; Y149-Y180 AromaticContact CE2-CE1 4Å; Y149-Y180 HydrophobicContact CE2-CE1 4Å; Y149-Y181 AromaticContact CD2-CE1 3.68Å; Y149-Y181 HydrophobicContact CD2-CE1 3.68Å; Y149-Y181 HydrophobicContact CE2-CE1 4.15Å
150	Q	96.1	Very high	95.6	Very high	72 Å²	72	37.6 Å²	37.6	34%	0.336	18%	0.175	S	C	.	.	H	α-helix	trans	-63.9	-26.8	177.2	-68.4	-66.3	-16	0	0	113.5	W55 Y146 A147 Y148 N152	W55-Q150 HydrophobicContact CD2-CB 3.72Å; W55-Q150 HydrophobicContact CD2-CG 3.97Å; W55-Q150 HydrophobicContact CE3-CB 4.46Å; W55-Q150 HydrophobicContact CE3-CG 4.41Å; W55-Q150 HydrophobicContact CG-CB 3.72Å; W55-Q150 HydrophobicContact CG-CG 4.48Å; W55-Q150 HydrophobicContact CH2-CG 4.33Å; W55-Q150 HydrophobicContact CZ2-CB 4.38Å; W55-Q150 HydrophobicContact CZ2-CG 3.83Å; Y146-Q150 HydrophobicContact CD1-CG 4.01Å; Y146-Q150 HydrophobicContact CE1-CG 3.73Å; Y146-Q150 WeakPolarHBondContact O-CG 3.37Å; Y146-Q150 PolarHBondContact O-N 3.16Å; Y146-Q150 PolarHBondContact OH-NE2 2.85Å; A147-Q150 PolarHBondContact O-N 3.26Å; Y148-Q150 VanDerWaalsContact C-N 3.34Å; Y148-Q150 PolarHBondContact O-N 3.47Å; Q150-N152 PolarHBondContact O-N 3.1Å
151	L	96.3	Very high	95.5	Very high	76 Å²	76	37.6 Å²	37.6	40%	0.398	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	7.8	173.4	-68	170	0	0	0	113.4	W55 A56 V59 A147 Y148 Y149 N153	W55-L151 HydrophobicContact CB-CD1 4.11Å; W55-L151 HydrophobicContact CB-CD2 3.88Å; W55-L151 HydrophobicContact CB-CG 3.76Å; A56-L151 HydrophobicContact CB-CD1 4.41Å; A56-L151 HydrophobicContact CB-CD2 4.27Å; V59-L151 HydrophobicContact CG2-CD1 4.27Å; A147-L151 VanDerWaalsContact O-CG 3.27Å; A147-L151 WeakPolarHBondContact O-CG 3.45Å; A147-L151 PolarHBondContact O-N 2.56Å; A147-L151 VanDerWaalsContact O-N 3.12Å; Y148-L151 HydrophobicContact CD1-CD1 4.49Å; Y148-L151 CarbonylContact O-C 3.55Å; Y148-L151 PolarHBondContact O-N 2.89Å; Y148-L151 VanDerWaalsContact O-N 3.17Å; Y149-L151 PolarHBondContact O-N 2.75Å; L151-N153 PolarHBondContact O-N 3.25Å
152	N	94.5	Very high	95.4	Very high	139 Å²	139	39.2 Å²	39.2	74%	0.743	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.5	26.7	-172.8	-66	-32.7	0	0	0	113.8	Y148 Y149 Q150	Y148-N152 PolarHBondContact O-N 2.78Å; Y149-N152 WeakPolarHBondContact O-CA 3.48Å; Y149-N152 PolarHBondContact O-N 3.37Å; Q150-N152 PolarHBondContact O-N 3.1Å
153	N	94.1	Very high	95.4	Very high	48 Å²	48	35.3 Å²	35.3	26%	0.257	17%	0.168	S	C	.	.			trans	-101.7	76.4	174.9	-164.9	-33.6	0	0	0	110.1	Y148 L151 E155 K156 A157	Y148-N153 HydrophobicContact CD1-CB 3.99Å; Y148-N153 PolarHBondContact O-N 3.26Å; L151-N153 PolarHBondContact O-N 3.25Å; N153-E155 VanDerWaalsContact C-N 3.32Å; N153-E155 PolarHBondContact O-N 3.4Å; N153-K156 PolarHBondContact O-N 3.28Å; N153-K156 WeakPolarHBondContact OD1-CB 3.3Å; N153-K156 WeakPolarHBondContact OD1-CG 3.31Å; N153-K156 PolarHBondContact OD1-N 3.38Å; N153-A157 PolarHBondContact O-N 3.45Å; N153-A157 VanDerWaalsContact O-N 3.11Å
154	M	92.5	Very high	95.4	Very high	48 Å²	48	32.6 Å²	32.6	24%	0.236	16%	0.157	C	C	.	.	H	α-helix	trans	-63.3	-38	-176	-61.2	-58.7	-167.5	0	0	112.7	Y149 K156 A157 V158 Y181 L184 F185	Y149-M154 HydrophobicContact CD2-CE 3.77Å; Y149-M154 HydrophobicContact CD2-SD 3.49Å; Y149-M154 WeakPolarHBondContact CD2-SD 3.47Å; Y149-M154 HydrophobicContact CE2-CE 3.53Å; Y149-M154 HydrophobicContact CE2-SD 3.87Å; M154-K156 PolarHBondContact O-N 3.48Å; M154-A157 WeakPolarHBondContact O-CB 3.39Å; M154-A157 PolarHBondContact O-N 2.92Å; M154-V158 WeakPolarHBondContact O-CG2 3.49Å; M154-V158 PolarHBondContact O-N 3.09Å; M154-Y181 HydrophobicContact SD-CE1 4.48Å; M154-L184 HydrophobicContact CE-CD1 4.26Å; M154-F185 HydrophobicContact CB-CE1 3.67Å; M154-F185 HydrophobicContact CB-CZ 3.86Å; M154-F185 HydrophobicContact CG-CE1 4.41Å
155	E	93.8	Very high	95.4	Very high	93 Å²	93	33.6 Å²	33.6	44%	0.435	16%	0.162	S	C	.	.	H	α-helix	trans	-56.4	-50.6	179.9	-58.1	-179.3	164.6	0	0	111.1	N153 V158 S159 Y190	N153-E155 VanDerWaalsContact C-N 3.32Å; N153-E155 PolarHBondContact O-N 3.4Å; E155-V158 PolarHBondContact O-N 2.92Å; E155-S159 PolarHBondContact O-N 3.14Å; E155-S159 VanDerWaalsContact O-N 3.1Å; E155-S159 PolarHBondContact O-OG 3Å; E155-Y190 HydrophobicContact CB-CD1 3.53Å; E155-Y190 HydrophobicContact CB-CE1 3.61Å; E155-Y190 HydrophobicContact CB-CG 4.18Å; E155-Y190 HydrophobicContact CG-CD1 3.75Å; E155-Y190 HydrophobicContact CG-CE1 3.3Å; E155-Y190 HydrophobicContact CG-CE2 4.26Å; E155-Y190 HydrophobicContact CG-CG 4.35Å; E155-Y190 WeakPolarHBondContact OE1-CE1 3.49Å; E155-Y190 VanDerWaalsContact OE1-CZ 3.28Å; E155-Y190 PolarHBondContact OE1-OH 3.26Å
156	K	94.1	Very high	95.3	Very high	58 Å²	58	35.3 Å²	35.3	25%	0.252	17%	0.17	S	C	.	.	H	α-helix	trans	-72	-30.2	178	-65.9	-172.3	-178.8	-163.9	0	113	Y148 N153 M154 V158 S159 A160	Y148-K156 HydrophobicContact CD1-CB 3.9Å; Y148-K156 HydrophobicContact CD1-CD 4.07Å; Y148-K156 HydrophobicContact CD2-CB 3.58Å; Y148-K156 HydrophobicContact CE1-CB 4.04Å; Y148-K156 HydrophobicContact CE1-CD 3.46Å; Y148-K156 VanDerWaalsContact CE1-CD 3.46Å; Y148-K156 HydrophobicContact CE1-CG 4.41Å; Y148-K156 HydrophobicContact CE2-CB 3.75Å; Y148-K156 HydrophobicContact CE2-CD 4.03Å; Y148-K156 HydrophobicContact CG-CB 3.67Å; Y148-K156 VanDerWaalsContact CZ-CD 3.43Å; N153-K156 PolarHBondContact O-N 3.28Å; N153-K156 WeakPolarHBondContact OD1-CB 3.3Å; N153-K156 WeakPolarHBondContact OD1-CG 3.31Å; N153-K156 PolarHBondContact OD1-N 3.38Å; M154-K156 PolarHBondContact O-N 3.48Å; K156-V158 VanDerWaalsContact C-N 3.33Å; K156-S159 PolarHBondContact O-N 3.19Å; K156-A160 WeakPolarHBondContact O-CB 3.48Å; K156-A160 PolarHBondContact O-N 3.38Å
157	A	95.3	Very high	95.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.4	-41	172.8	0	0	0	0	0	111.3	Q145 N153 M154 T161 Y181	Q145-A157 WeakPolarHBondContact CB-O 3.27Å; Q145-A157 WeakPolarHBondContact O-CB 3.46Å; N153-A157 PolarHBondContact O-N 3.45Å; N153-A157 VanDerWaalsContact O-N 3.11Å; M154-A157 WeakPolarHBondContact O-CB 3.39Å; M154-A157 PolarHBondContact O-N 2.92Å; A157-T161 WeakPolarHBondContact O-CB 3.36Å; A157-T161 PolarHBondContact O-N 2.92Å; A157-T161 PolarHBondContact O-OG1 3.42Å; A157-Y181 HydrophobicContact CB-CE2 4.31Å
158	V	96.3	Very high	95.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.2	-51.9	174.1	169.8	0	0	0	0	110.6	M154 E155 K156 A160 T161 H162 M178 Y181 F185 V187 L191	M154-V158 WeakPolarHBondContact O-CG2 3.49Å; M154-V158 PolarHBondContact O-N 3.09Å; E155-V158 PolarHBondContact O-N 2.92Å; K156-V158 VanDerWaalsContact C-N 3.33Å; V158-A160 VanDerWaalsContact C-N 3.32Å; V158-A160 PolarHBondContact O-N 3.36Å; V158-T161 PolarHBondContact O-N 3.46Å; V158-T161 VanDerWaalsContact O-N 3.15Å; V158-H162 WeakPolarHBondContact O-CB 3.41Å; V158-H162 PolarHBondContact O-N 3.25Å; V158-M178 HydrophobicContact CG1-CE 4.18Å; V158-M178 HydrophobicContact CG1-SD 4.32Å; V158-Y181 HydrophobicContact CG2-CD2 3.79Å; V158-Y181 HydrophobicContact CG2-CG 3.88Å; V158-F185 HydrophobicContact CG2-CE1 4.36Å; V158-F185 HydrophobicContact CG2-CZ 3.76Å; V158-V187 HydrophobicContact CG1-CB 4.05Å; V158-V187 HydrophobicContact CG1-CG1 4.4Å; V158-V187 HydrophobicContact CG2-CG1 3.98Å; V158-L191 HydrophobicContact CG1-CD2 4.02Å
159	S	95.4	Very high	95	Very high	4 Å²	4	38 Å²	38	3%	0.028	19%	0.187	C	C	.	.	H	α-helix	trans	-59.7	-41.7	-179.6	-50.6	0	0	0	0	112.3	E155 K156 H162 T163 Y190 H194	E155-S159 PolarHBondContact O-N 3.14Å; E155-S159 VanDerWaalsContact O-N 3.1Å; E155-S159 PolarHBondContact O-OG 3Å; K156-S159 PolarHBondContact O-N 3.19Å; S159-H162 PolarHBondContact O-N 2.88Å; S159-T163 WeakPolarHBondContact O-CB 3.39Å; S159-T163 PolarHBondContact O-N 3.48Å; S159-T163 PolarHBondContact O-OG1 3.2Å; S159-Y190 WeakPolarHBondContact CA-O 3.37Å; S159-Y190 PolarHBondContact OG-O 3.06Å; S159-H194 WeakPolarHBondContact CB-NE2 3.37Å
160	A	96.2	Very high	94.8	Very high	2 Å²	2	42.3 Å²	42.3	2%	0.017	21%	0.213	C	C	.	.	H	α-helix	trans	-65.5	-42	176	0	0	0	0	0	112.2	Y141 I144 Q145 K156 V158 T163 F164	Y141-A160 HydrophobicContact CD1-CB 4.14Å; I144-A160 HydrophobicContact CB-CB 4.34Å; I144-A160 HydrophobicContact CG2-CB 3.76Å; Q145-A160 HydrophobicContact CB-CB 3.8Å; K156-A160 WeakPolarHBondContact O-CB 3.48Å; K156-A160 PolarHBondContact O-N 3.38Å; V158-A160 VanDerWaalsContact C-N 3.32Å; V158-A160 PolarHBondContact O-N 3.36Å; A160-T163 PolarHBondContact O-N 3.35Å; A160-F164 PolarHBondContact O-N 2.87Å
161	T	96.6	Very high	94.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64	-44.2	176.5	-56	0	0	0	0	111.2	Q145 A157 V158 F164 L165 L174 M178	Q145-T161 VanDerWaalsContact CB-OG1 3.25Å; Q145-T161 WeakPolarHBondContact CB-OG1 3.38Å; A157-T161 WeakPolarHBondContact O-CB 3.36Å; A157-T161 PolarHBondContact O-N 2.92Å; A157-T161 PolarHBondContact O-OG1 3.42Å; V158-T161 PolarHBondContact O-N 3.46Å; V158-T161 VanDerWaalsContact O-N 3.15Å; T161-F164 PolarHBondContact O-N 3.33Å; T161-L165 HydrophobicContact CG2-CD1 3.99Å; T161-L165 HydrophobicContact CG2-CG 4.46Å; T161-L165 WeakPolarHBondContact O-CG 3.39Å; T161-L165 PolarHBondContact O-N 2.83Å; T161-L174 HydrophobicContact CG2-CB 4.19Å; T161-L174 HydrophobicContact CG2-CD2 4.28Å; T161-M178 HydrophobicContact CG2-CB 3.98Å; T161-M178 HydrophobicContact CG2-CE 3.74Å
162	H	95.4	Very high	94.4	Very high	35 Å²	35	42.9 Å²	42.9	16%	0.162	22%	0.222	C	C	.	.	H	α-helix	trans	-61.2	-46.2	176.1	177.1	-110	0	0	0	111.4	V158 S159 F164 L165 K166 M178 L191 I192 D193	V158-H162 WeakPolarHBondContact O-CB 3.41Å; V158-H162 PolarHBondContact O-N 3.25Å; S159-H162 PolarHBondContact O-N 2.88Å; H162-F164 VanDerWaalsContact C-N 3.29Å; H162-F164 PolarHBondContact O-N 3.46Å; H162-L165 PolarHBondContact O-N 2.97Å; H162-K166 VanDerWaalsContact CE1-CE 3.47Å; H162-K166 WeakPolarHBondContact CE1-CE 3.36Å; H162-K166 WeakPolarHBondContact NE2-CE 3.25Å; H162-K166 VanDerWaalsContact O-CG 3.29Å; H162-K166 WeakPolarHBondContact O-CG 3.4Å; H162-K166 PolarHBondContact O-N 3.35Å; H162-M178 HydrophobicContact CB-CE 3.88Å; H162-L191 HydrophobicContact CB-CD2 4.3Å; H162-L191 PolarHBondContact CE1-O 2.77Å; H162-L191 VanDerWaalsContact CE1-O 3.24Å; H162-L191 PolarHBondContact ND1-O 2.95Å; H162-I192 VanDerWaalsContact ND1-C 3.28Å; H162-I192 PolarHBondContact ND1-O 3.29Å; H162-D193 PolarHBondContact ND1-N 3.2Å
163	T	95.4	Very high	94.1	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-57.3	-41.1	176	-58.8	0	0	0	0	112	R138 Y141 S159 A160 I192 D193 H194 E195	R138-T163 WeakPolarHBondContact CD-O 3.48Å; R138-T163 PolarHBondContact NH1-O 3.19Å; Y141-T163 HydrophobicContact CD1-CG2 3.71Å; Y141-T163 HydrophobicContact CD2-CG2 3.92Å; Y141-T163 HydrophobicContact CE1-CG2 3.41Å; Y141-T163 VanDerWaalsContact CE1-CG2 3.41Å; Y141-T163 HydrophobicContact CE2-CG2 3.65Å; Y141-T163 HydrophobicContact CG-CG2 3.94Å; S159-T163 WeakPolarHBondContact O-CB 3.39Å; S159-T163 PolarHBondContact O-N 3.48Å; S159-T163 PolarHBondContact O-OG1 3.2Å; A160-T163 PolarHBondContact O-N 3.35Å; T163-I192 PolarHBondContact OG1-O 3.42Å; T163-D193 WeakPolarHBondContact CG2-OD1 3.01Å; T163-H194 HydrophobicContact CG2-CB 4.25Å; T163-H194 PolarHBondContact OG1-CD2 3.05Å; T163-H194 PolarHBondContact OG1-N 2.95Å; T163-E195 HydrophobicContact CG2-CG 4.2Å
164	F	96.4	Very high	94	Very high	6 Å²	6	36 Å²	36	3%	0.026	18%	0.183	C	C	.	.	H	α-helix	trans	-65.6	-50.2	175.6	-178.5	-84.6	0	0	0	112.3	R138 I139 R142 A160 T161 H162 K166 K167 N168 E171 L174	R138-F164 VanDerWaalsContact O-CD2 3.29Å; R138-F164 WeakPolarHBondContact O-CD2 3.4Å; I139-F164 HydrophobicContact CD1-CE2 3.99Å; I139-F164 HydrophobicContact CD1-CZ 4.45Å; R142-F164 HydrophobicContact CB-CD2 4.15Å; R142-F164 HydrophobicContact CB-CE2 4Å; A160-F164 PolarHBondContact O-N 2.87Å; T161-F164 PolarHBondContact O-N 3.33Å; H162-F164 VanDerWaalsContact C-N 3.29Å; H162-F164 PolarHBondContact O-N 3.46Å; F164-K166 PolarHBondContact O-N 3.06Å; F164-K167 PolarHBondContact O-N 2.96Å; F164-N168 HydrophobicContact CD1-CB 4.09Å; F164-N168 HydrophobicContact CE1-CB 3.55Å; F164-N168 HydrophobicContact CZ-CB 3.96Å; F164-N168 PolarHBondContact O-N 3.04Å; F164-N168 PolarHBondContact O-ND2 3.01Å; F164-E171 HydrophobicContact CE1-CB 3.8Å; F164-E171 HydrophobicContact CE1-CG 3.76Å; F164-E171 HydrophobicContact CZ-CG 4.28Å; F164-L174 HydrophobicContact CB-CD2 3.9Å; F164-L174 HydrophobicContact CD1-CB 4.22Å; F164-L174 HydrophobicContact CD1-CD1 4.24Å; F164-L174 HydrophobicContact CD1-CD2 3.57Å; F164-L174 HydrophobicContact CD1-CG 4.22Å; F164-L174 HydrophobicContact CD2-CD2 4.29Å; F164-L174 HydrophobicContact CE1-CB 4.48Å; F164-L174 HydrophobicContact CE1-CD1 3.97Å; F164-L174 HydrophobicContact CE1-CD2 4.13Å; F164-L174 HydrophobicContact CE1-CG 4.43Å; F164-L174 HydrophobicContact CG-CD2 3.65Å; F164-L174 HydrophobicContact CZ-CD1 4.34Å
165	L	95.8	Very high	94.1	Very high	25 Å²	25	36.1 Å²	36.1	13%	0.131	19%	0.186	C	C	.	.	H	α-helix	trans	-66	-25	-175.9	-71	174.1	0	0	0	112.7	T161 H162 K167 N168 P169 L174 M178	T161-L165 HydrophobicContact CG2-CD1 3.99Å; T161-L165 HydrophobicContact CG2-CG 4.46Å; T161-L165 WeakPolarHBondContact O-CG 3.39Å; T161-L165 PolarHBondContact O-N 2.83Å; H162-L165 PolarHBondContact O-N 2.97Å; L165-K167 PolarHBondContact O-N 3.19Å; L165-N168 CarbonylContact O-C 3.55Å; L165-N168 PolarHBondContact O-N 3.27Å; L165-P169 WeakPolarHBondContact O-CA 3.33Å; L165-P169 VanDerWaalsContact O-N 3.17Å; L165-L174 HydrophobicContact CD2-CB 3.89Å; L165-L174 HydrophobicContact CG-CB 4.26Å; L165-M178 HydrophobicContact CD1-CB 3.96Å; L165-M178 HydrophobicContact CD1-CG 4.35Å
166	K	94.1	Very high	94	Very high	39 Å²	39	36.4 Å²	36.4	17%	0.17	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-28.8	171	-78.9	-75.9	179.7	172.5	0	113.4	R138 H162 F164 D193 S277	R138-K166 VanDerWaalsContact NH1-CB 3.33Å; H162-K166 VanDerWaalsContact CE1-CE 3.47Å; H162-K166 WeakPolarHBondContact CE1-CE 3.36Å; H162-K166 WeakPolarHBondContact NE2-CE 3.25Å; H162-K166 VanDerWaalsContact O-CG 3.29Å; H162-K166 WeakPolarHBondContact O-CG 3.4Å; H162-K166 PolarHBondContact O-N 3.35Å; F164-K166 PolarHBondContact O-N 3.06Å; K166-D193 WeakPolarHBondContact CB-OD2 3.47Å; K166-D193 HydrophobicContact CG-CB 4.24Å; K166-D193 WeakPolarHBondContact CG-OD2 3.32Å; K166-S277 PolarHBondContact NZ-O 3.22Å; K166-S277 WeakPolarHBondContact O-CB 3.5Å
167	K	94.5	Very high	93.9	Very high	43 Å²	43	33.8 Å²	33.8	19%	0.187	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-25.6	176.1	-169	59	172.9	175	0	113.4	R138 F164 L165 Q273	R138-K167 HydrophobicContact CB-CB 4.35Å; R138-K167 HydrophobicContact CG-CB 3.94Å; R138-K167 HydrophobicContact CG-CG 4.2Å; F164-K167 PolarHBondContact O-N 2.96Å; L165-K167 PolarHBondContact O-N 3.19Å; K167-Q273 PolarHBondContact NZ-O 3.32Å
168	N	94.9	Very high	93.8	Very high	41 Å²	41	34.2 Å²	34.2	22%	0.219	18%	0.176	C	C	.	.			trans	-130.2	71.5	-177.4	-50.2	-83.5	0	0	0	109.7	K137 F164 L165 D170 E171	K137-N168 PolarHBondContact O-ND2 3.13Å; F164-N168 HydrophobicContact CD1-CB 4.09Å; F164-N168 HydrophobicContact CE1-CB 3.55Å; F164-N168 HydrophobicContact CZ-CB 3.96Å; F164-N168 PolarHBondContact O-N 3.04Å; F164-N168 PolarHBondContact O-ND2 3.01Å; L165-N168 CarbonylContact O-C 3.55Å; L165-N168 PolarHBondContact O-N 3.27Å; N168-D170 PolarHBondContact O-N 3.28Å; N168-E171 HydrophobicContact CB-CB 4.36Å; N168-E171 PolarHBondContact O-N 3.42Å
169	P	92.6	Very high	93.7	Very high	20 Å²	20	38.5 Å²	38.5	13%	0.13	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-28.2	-175	24.3	-33	0	0	0	113.3	L165 E171 G280 F282	L165-P169 WeakPolarHBondContact O-CA 3.33Å; L165-P169 VanDerWaalsContact O-N 3.17Å; P169-E171 VanDerWaalsContact C-N 3.28Å; P169-E171 PolarHBondContact O-N 2.9Å; P169-G280 WeakPolarHBondContact CB-O 3.46Å; P169-F282 HydrophobicContact CG-CD2 4.15Å; P169-F282 HydrophobicContact CG-CE2 3.58Å; P169-F282 HydrophobicContact CG-CZ 4.11Å
170	D	90.1	Very high	93.6	Very high	140 Å²	140	42.5 Å²	42.5	75%	0.749	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	2	-175.3	-57.6	-49.3	0	0	0	113.6	N168 P172	N168-D170 PolarHBondContact O-N 3.28Å; D170-P172 WeakPolarHBondContact O-CD 3.45Å
171	E	93	Very high	93.4	Very high	62 Å²	62	42.6 Å²	42.6	29%	0.29	21%	0.214	S	C	.	.			trans	-76.1	110.4	-176.3	-179.4	57.2	-171	0	0	111.6	F164 N168 P169 Y173 L174 T175	F164-E171 HydrophobicContact CE1-CB 3.8Å; F164-E171 HydrophobicContact CE1-CG 3.76Å; F164-E171 HydrophobicContact CZ-CG 4.28Å; N168-E171 HydrophobicContact CB-CB 4.36Å; N168-E171 PolarHBondContact O-N 3.42Å; P169-E171 VanDerWaalsContact C-N 3.28Å; P169-E171 PolarHBondContact O-N 2.9Å; E171-Y173 PolarHBondContact O-N 3.02Å; E171-L174 HydrophobicContact CG-CB 4.46Å; E171-L174 HydrophobicContact CG-CD1 3.91Å; E171-T175 WeakPolarHBondContact O-CB 3.34Å; E171-T175 PolarHBondContact O-N 3.31Å; E171-T175 PolarHBondContact O-OG1 3.47Å
172	P	90.9	Very high	93.3	Very high	97 Å²	97	47.8 Å²	47.8	63%	0.63	24%	0.237	S	C	*	.	H	α-helix	trans	-70.8	-34.3	-168.7	27.6	-34.4	0	0	0	112.2	D170 K176	D170-P172 WeakPolarHBondContact O-CD 3.45Å; P172-K176 PolarHBondContact O-N 2.92Å
173	Y	89.5	Confident	93.2	Very high	44 Å²	44	50.3 Å²	50.3	17%	0.173	26%	0.259	C	S	.	.	H	α-helix	trans	-65	-52.3	-177.3	177.2	-94.8	0	0	0	111.6	E171 T175 K176 N177 L408 W411	E171-Y173 PolarHBondContact O-N 3.02Å; Y173-T175 VanDerWaalsContact C-N 3.3Å; Y173-T175 PolarHBondContact O-N 3.18Å; Y173-K176 WeakPolarHBondContact O-CB 3.33Å; Y173-K176 PolarHBondContact O-N 3.2Å; Y173-K176 VanDerWaalsContact O-N 3.15Å; Y173-N177 WeakPolarHBondContact CE1-ND2 3.01Å; Y173-N177 PolarHBondContact O-N 3.04Å; Y173-N177 PolarHBondContact O-OD1 3.46Å; Y173-L408 HydrophobicContact CE2-CD2 4.34Å; Y173-W411 HydrophobicContact CD2-CZ3 4.28Å; Y173-W411 AromaticContact CE2-CE3 3.7Å; Y173-W411 HydrophobicContact CE2-CE3 3.7Å; Y173-W411 AromaticContact CE2-CZ3 3.48Å; Y173-W411 HydrophobicContact CE2-CZ3 3.48Å; Y173-W411 VanDerWaalsContact CE2-CZ3 3.48Å; Y173-W411 AromaticContact CZ-CE3 3.99Å; Y173-W411 AromaticContact CZ-CZ3 3.79Å
174	L	92	Very high	93	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-71.8	-27.5	-179	-80.6	91.4	0	0	0	112.5	R142 Q145 T161 F164 L165 E171 K176 N177 M178	R142-L174 HydrophobicContact CG-CD1 4.02Å; Q145-L174 HydrophobicContact CG-CD2 4.09Å; T161-L174 HydrophobicContact CG2-CB 4.19Å; T161-L174 HydrophobicContact CG2-CD2 4.28Å; F164-L174 HydrophobicContact CB-CD2 3.9Å; F164-L174 HydrophobicContact CD1-CB 4.22Å; F164-L174 HydrophobicContact CD1-CD1 4.24Å; F164-L174 HydrophobicContact CD1-CD2 3.57Å; F164-L174 HydrophobicContact CD1-CG 4.22Å; F164-L174 HydrophobicContact CD2-CD2 4.29Å; F164-L174 HydrophobicContact CE1-CB 4.48Å; F164-L174 HydrophobicContact CE1-CD1 3.97Å; F164-L174 HydrophobicContact CE1-CD2 4.13Å; F164-L174 HydrophobicContact CE1-CG 4.43Å; F164-L174 HydrophobicContact CG-CD2 3.65Å; F164-L174 HydrophobicContact CZ-CD1 4.34Å; L165-L174 HydrophobicContact CD2-CB 3.89Å; L165-L174 HydrophobicContact CG-CB 4.26Å; E171-L174 HydrophobicContact CG-CB 4.46Å; E171-L174 HydrophobicContact CG-CD1 3.91Å; L174-K176 VanDerWaalsContact C-N 3.33Å; L174-N177 PolarHBondContact O-N 3.31Å; L174-M178 WeakPolarHBondContact O-CB 3.42Å; L174-M178 PolarHBondContact O-N 3.01Å
175	T	93.2	Very high	92.8	Very high	49 Å²	49	56.9 Å²	56.9	30%	0.301	29%	0.291	S	S	.	.	H	α-helix	trans	-62.3	-42.3	170.1	-61.6	0	0	0	0	111	E171 Y173 M178 N179	E171-T175 WeakPolarHBondContact O-CB 3.34Å; E171-T175 PolarHBondContact O-N 3.31Å; E171-T175 PolarHBondContact O-OG1 3.47Å; Y173-T175 VanDerWaalsContact C-N 3.3Å; Y173-T175 PolarHBondContact O-N 3.18Å; T175-M178 PolarHBondContact O-N 3.45Å; T175-N179 VanDerWaalsContact O-CG 3.29Å; T175-N179 PolarHBondContact O-N 3.38Å; T175-N179 PolarHBondContact O-ND2 3.36Å
176	K	92.6	Very high	92.6	Very high	100 Å²	100	61 Å²	61	44%	0.435	31%	0.313	S	S	.	.	H	α-helix	trans	-62.9	-43.7	173.7	-171.7	-178.3	175.9	-172.4	0	111.7	P172 Y173 L174 M178 N179 Y180 W412	P172-K176 PolarHBondContact O-N 2.92Å; Y173-K176 WeakPolarHBondContact O-CB 3.33Å; Y173-K176 PolarHBondContact O-N 3.2Å; Y173-K176 VanDerWaalsContact O-N 3.15Å; L174-K176 VanDerWaalsContact C-N 3.33Å; K176-M178 VanDerWaalsContact C-N 3.34Å; K176-M178 PolarHBondContact O-N 3.49Å; K176-N179 PolarHBondContact O-N 3.03Å; K176-Y180 PolarHBondContact O-N 3.42Å; K176-W412 VanDerWaalsContact NZ-CH2 3.32Å
177	N	92.2	Very high	92.5	Very high	3 Å²	3	59.4 Å²	59.4	2%	0.016	31%	0.306	C	S	.	.	H	α-helix	trans	-59.4	-45.2	176.1	-66.5	19.8	0	0	0	111.5	Q145 Y173 L174 N179 Y180 Y181 W411	Q145-N177 PolarHBondContact OE1-ND2 3.25Å; Y173-N177 WeakPolarHBondContact CE1-ND2 3.01Å; Y173-N177 PolarHBondContact O-N 3.04Å; Y173-N177 PolarHBondContact O-OD1 3.46Å; L174-N177 PolarHBondContact O-N 3.31Å; N177-N179 VanDerWaalsContact C-N 3.34Å; N177-N179 PolarHBondContact O-N 2.9Å; N177-Y180 WeakPolarHBondContact O-CB 3.21Å; N177-Y180 PolarHBondContact O-N 3.39Å; N177-Y181 HydrophobicContact CB-CE2 4.15Å; N177-Y181 VanDerWaalsContact O-CD2 3.29Å; N177-Y181 WeakPolarHBondContact O-CD2 3.38Å; N177-Y181 VanDerWaalsContact O-CG 3.28Å; N177-Y181 PolarHBondContact O-N 2.64Å; N177-W411 WeakPolarHBondContact OD1-CH2 3.28Å; N177-W411 WeakPolarHBondContact OD1-CZ3 3.37Å
178	M	93.8	Very high	92.3	Very high	9 Å²	9	62.8 Å²	62.8	4%	0.044	33%	0.327	C	S	.	.	H	α-helix	trans	-61	-42.5	177.1	-179.4	56.6	71.3	0	0	112	V158 T161 H162 L165 L174 T175 K176 Y180 Y181 K182 L191	V158-M178 HydrophobicContact CG1-CE 4.18Å; V158-M178 HydrophobicContact CG1-SD 4.32Å; T161-M178 HydrophobicContact CG2-CB 3.98Å; T161-M178 HydrophobicContact CG2-CE 3.74Å; H162-M178 HydrophobicContact CB-CE 3.88Å; L165-M178 HydrophobicContact CD1-CB 3.96Å; L165-M178 HydrophobicContact CD1-CG 4.35Å; L174-M178 WeakPolarHBondContact O-CB 3.42Å; L174-M178 PolarHBondContact O-N 3.01Å; T175-M178 PolarHBondContact O-N 3.45Å; K176-M178 VanDerWaalsContact C-N 3.34Å; K176-M178 PolarHBondContact O-N 3.49Å; M178-Y180 VanDerWaalsContact C-N 3.31Å; M178-Y180 PolarHBondContact O-N 3.19Å; M178-Y181 PolarHBondContact O-N 3.34Å; M178-K182 HydrophobicContact CG-CD 4.42Å; M178-K182 WeakPolarHBondContact O-CG 3.48Å; M178-K182 PolarHBondContact O-N 3.39Å; M178-L191 HydrophobicContact CE-CD2 4.18Å; M178-L191 HydrophobicContact SD-CD2 4.12Å
179	N	93.6	Very high	92.1	Very high	90 Å²	90	68.3 Å²	68.3	48%	0.481	35%	0.351	S	S	.	.	H	α-helix	trans	-64.9	-36.6	175.9	-69.7	-24	0	0	0	112.1	T175 K176 N177 K182 S183	T175-N179 VanDerWaalsContact O-CG 3.29Å; T175-N179 PolarHBondContact O-N 3.38Å; T175-N179 PolarHBondContact O-ND2 3.36Å; K176-N179 PolarHBondContact O-N 3.03Å; N177-N179 VanDerWaalsContact C-N 3.34Å; N177-N179 PolarHBondContact O-N 2.9Å; N179-K182 PolarHBondContact O-N 3.15Å; N179-S183 PolarHBondContact O-N 3.03Å
180	Y	92.8	Very high	92	Very high	87 Å²	87	70 Å²	70	34%	0.341	36%	0.355	S	S	.	.	H	α-helix	trans	-62.6	-47.7	172	175.1	-104.4	0	0	0	111.3	Y149 K176 N177 M178 K182 S183 L184	Y149-Y180 AromaticContact CE2-CE1 4Å; Y149-Y180 HydrophobicContact CE2-CE1 4Å; K176-Y180 PolarHBondContact O-N 3.42Å; N177-Y180 WeakPolarHBondContact O-CB 3.21Å; N177-Y180 PolarHBondContact O-N 3.39Å; M178-Y180 VanDerWaalsContact C-N 3.31Å; M178-Y180 PolarHBondContact O-N 3.19Å; Y180-K182 VanDerWaalsContact C-N 3.34Å; Y180-K182 PolarHBondContact O-N 3.23Å; Y180-S183 WeakPolarHBondContact O-CB 3.46Å; Y180-S183 PolarHBondContact O-N 3.4Å; Y180-S183 PolarHBondContact O-OG 3.28Å; Y180-L184 HydrophobicContact CD1-CD1 4.18Å; Y180-L184 HydrophobicContact CE1-CD1 3.56Å; Y180-L184 HydrophobicContact CE1-CG 4.36Å; Y180-L184 HydrophobicContact CE2-CD2 4.4Å; Y180-L184 PolarHBondContact O-N 2.99Å
181	Y	93.2	Very high	92.1	Very high	5 Å²	5	66.1 Å²	66.1	2%	0.02	33%	0.334	C	S	.	.	H	α-helix	trans	-59.8	-42.4	177	-57.9	-34.7	0	0	0	112.6	Q145 Y149 M154 A157 V158 N177 M178 S183 L184 F185	Q145-Y181 PolarHBondContact OE1-OH 2.97Å; Y149-Y181 AromaticContact CD2-CE1 3.68Å; Y149-Y181 HydrophobicContact CD2-CE1 3.68Å; Y149-Y181 HydrophobicContact CE2-CE1 4.15Å; M154-Y181 HydrophobicContact SD-CE1 4.48Å; A157-Y181 HydrophobicContact CB-CE2 4.31Å; V158-Y181 HydrophobicContact CG2-CD2 3.79Å; V158-Y181 HydrophobicContact CG2-CG 3.88Å; N177-Y181 HydrophobicContact CB-CE2 4.15Å; N177-Y181 VanDerWaalsContact O-CD2 3.29Å; N177-Y181 WeakPolarHBondContact O-CD2 3.38Å; N177-Y181 VanDerWaalsContact O-CG 3.28Å; N177-Y181 PolarHBondContact O-N 2.64Å; M178-Y181 PolarHBondContact O-N 3.34Å; Y181-S183 PolarHBondContact O-N 2.99Å; Y181-L184 PolarHBondContact O-N 3.29Å; Y181-F185 PolarHBondContact O-N 3.24Å
182	K	93.8	Very high	92	Very high	108 Å²	108	65.3 Å²	65.3	47%	0.47	33%	0.331	S	S	.	.	H	α-helix	trans	-57.7	-28.2	173.4	-76.3	173.3	177.4	-176.8	0	114	M178 N179 Y180 L184 V187	M178-K182 HydrophobicContact CG-CD 4.42Å; M178-K182 WeakPolarHBondContact O-CG 3.48Å; M178-K182 PolarHBondContact O-N 3.39Å; N179-K182 PolarHBondContact O-N 3.15Å; Y180-K182 VanDerWaalsContact C-N 3.34Å; Y180-K182 PolarHBondContact O-N 3.23Å; K182-L184 VanDerWaalsContact C-N 3.33Å; K182-V187 HydrophobicContact CD-CG2 4.42Å; K182-V187 HydrophobicContact CG-CG1 4.24Å; K182-V187 HydrophobicContact CG-CG2 3.48Å; K182-V187 VanDerWaalsContact CG-CG2 3.48Å
183	S	93.8	Very high	92.1	Very high	89 Å²	89	61.1 Å²	61.1	62%	0.622	30%	0.303	S	S	*	.	H	α-helix	trans	-77.9	-19.4	177.8	77.5	0	0	0	0	113.4	N179 Y180 Y181	N179-S183 PolarHBondContact O-N 3.03Å; Y180-S183 WeakPolarHBondContact O-CB 3.46Å; Y180-S183 PolarHBondContact O-N 3.4Å; Y180-S183 PolarHBondContact O-OG 3.28Å; Y181-S183 PolarHBondContact O-N 2.99Å
184	L	91.1	Very high	92.2	Very high	83 Å²	83	59.8 Å²	59.8	44%	0.435	30%	0.299	S	S	.	.	H	α-helix	trans	-90.6	-38.4	-175	-65.2	179.2	0	0	0	112.8	M154 Y180 Y181 K182	M154-L184 HydrophobicContact CE-CD1 4.26Å; Y180-L184 HydrophobicContact CD1-CD1 4.18Å; Y180-L184 HydrophobicContact CE1-CD1 3.56Å; Y180-L184 HydrophobicContact CE1-CG 4.36Å; Y180-L184 HydrophobicContact CE2-CD2 4.4Å; Y180-L184 PolarHBondContact O-N 2.99Å; Y181-L184 PolarHBondContact O-N 3.29Å; K182-L184 VanDerWaalsContact C-N 3.33Å
185	F	91.1	Very high	92.3	Very high	61 Å²	61	61.4 Å²	61.4	27%	0.268	31%	0.307	S	S	.	.	S	Bend	trans	-159.2	170.1	-178	66	-76.1	0	0	0	111.3	M154 V158 Y181 V187 Y190	M154-F185 HydrophobicContact CB-CE1 3.67Å; M154-F185 HydrophobicContact CB-CZ 3.86Å; M154-F185 HydrophobicContact CG-CE1 4.41Å; V158-F185 HydrophobicContact CG2-CE1 4.36Å; V158-F185 HydrophobicContact CG2-CZ 3.76Å; Y181-F185 PolarHBondContact O-N 3.24Å; F185-V187 HydrophobicContact CD2-CG1 4.37Å; F185-V187 HydrophobicContact CE1-CG1 4.28Å; F185-V187 HydrophobicContact CE2-CG1 4.04Å; F185-V187 HydrophobicContact CZ-CG1 4Å; F185-V187 PolarHBondContact O-N 3.01Å; F185-Y190 HydrophobicContact CD2-CD2 4.37Å; F185-Y190 HydrophobicContact CD2-CE2 4.16Å; F185-Y190 AromaticContact CE2-CD2 3.64Å; F185-Y190 HydrophobicContact CE2-CD2 3.64Å; F185-Y190 AromaticContact CE2-CE2 3.74Å; F185-Y190 HydrophobicContact CE2-CE2 3.74Å
186	D	92.4	Very high	92.2	Very high	112 Å²	112	63.2 Å²	63.2	60%	0.599	31%	0.311	S	S	*	.			trans	-70.3	111.7	173	-172.3	1.2	0	0	0	110.1	D188	D186-D188 PolarHBondContact OD1-N 3.49Å
187	V	92	Very high	92.3	Very high	4 Å²	4	59.9 Å²	59.9	2%	0.024	30%	0.298	C	S	.	.			trans	-92.2	-9.1	-173.4	-61.2	0	0	0	0	113.3	V158 K182 F185 E189 Y190 L191	V158-V187 HydrophobicContact CG1-CB 4.05Å; V158-V187 HydrophobicContact CG1-CG1 4.4Å; V158-V187 HydrophobicContact CG2-CG1 3.98Å; K182-V187 HydrophobicContact CD-CG2 4.42Å; K182-V187 HydrophobicContact CG-CG1 4.24Å; K182-V187 HydrophobicContact CG-CG2 3.48Å; K182-V187 VanDerWaalsContact CG-CG2 3.48Å; F185-V187 HydrophobicContact CD2-CG1 4.37Å; F185-V187 HydrophobicContact CE1-CG1 4.28Å; F185-V187 HydrophobicContact CE2-CG1 4.04Å; F185-V187 HydrophobicContact CZ-CG1 4Å; F185-V187 PolarHBondContact O-N 3.01Å; V187-E189 VanDerWaalsContact C-N 3.26Å; V187-E189 PolarHBondContact O-N 3.24Å; V187-Y190 CarbonylContact O-C 3.58Å; V187-Y190 WeakPolarHBondContact O-CA 3.46Å; V187-Y190 PolarHBondContact O-N 2.98Å; V187-L191 HydrophobicContact CG2-CD2 4.25Å; V187-L191 HydrophobicContact CG2-CG 4.42Å; V187-L191 PolarHBondContact O-N 2.8Å
188	D	89.8	Confident	92.4	Very high	115 Å²	115	63.1 Å²	63.1	62%	0.615	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-59.7	-36	-165.2	-78.1	-10.9	0	0	0	112.7	D186 Y190 L191	D186-D188 PolarHBondContact OD1-N 3.49Å; D188-Y190 PolarHBondContact O-N 2.9Å; D188-L191 PolarHBondContact O-N 3.37Å
189	E	90.1	Very high	92.5	Very high	156 Å²	156	62.7 Å²	62.7	73%	0.729	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-68.1	-19.6	176.3	-62.8	-171.7	171.1	0	0	113.5	V187	V187-E189 VanDerWaalsContact C-N 3.26Å; V187-E189 PolarHBondContact O-N 3.24Å
190	Y	91	Very high	92.5	Very high	57 Å²	57	59 Å²	59	22%	0.224	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-107.5	5.9	-175	-50.1	-78.2	0	0	0	113	E155 S159 F185 V187 D188 I192	E155-Y190 HydrophobicContact CB-CD1 3.53Å; E155-Y190 HydrophobicContact CB-CE1 3.61Å; E155-Y190 HydrophobicContact CB-CG 4.18Å; E155-Y190 HydrophobicContact CG-CD1 3.75Å; E155-Y190 HydrophobicContact CG-CE1 3.3Å; E155-Y190 HydrophobicContact CG-CE2 4.26Å; E155-Y190 HydrophobicContact CG-CG 4.35Å; E155-Y190 WeakPolarHBondContact OE1-CE1 3.49Å; E155-Y190 VanDerWaalsContact OE1-CZ 3.28Å; E155-Y190 PolarHBondContact OE1-OH 3.26Å; S159-Y190 WeakPolarHBondContact CA-O 3.37Å; S159-Y190 PolarHBondContact OG-O 3.06Å; F185-Y190 HydrophobicContact CD2-CD2 4.37Å; F185-Y190 HydrophobicContact CD2-CE2 4.16Å; F185-Y190 AromaticContact CE2-CD2 3.64Å; F185-Y190 HydrophobicContact CE2-CD2 3.64Å; F185-Y190 AromaticContact CE2-CE2 3.74Å; F185-Y190 HydrophobicContact CE2-CE2 3.74Å; V187-Y190 CarbonylContact O-C 3.58Å; V187-Y190 WeakPolarHBondContact O-CA 3.46Å; V187-Y190 PolarHBondContact O-N 2.98Å; D188-Y190 PolarHBondContact O-N 2.9Å; Y190-I192 PolarHBondContact O-N 3.02Å
191	L	91.8	Very high	92.6	Very high	58 Å²	58	57.3 Å²	57.3	30%	0.304	30%	0.297	S	S	.	.			trans	-76.7	60	173.4	-64	178.8	0	0	0	111.5	V158 H162 M178 V187 D188	V158-L191 HydrophobicContact CG1-CD2 4.02Å; H162-L191 HydrophobicContact CB-CD2 4.3Å; H162-L191 PolarHBondContact CE1-O 2.77Å; H162-L191 VanDerWaalsContact CE1-O 3.24Å; H162-L191 PolarHBondContact ND1-O 2.95Å; M178-L191 HydrophobicContact CE-CD2 4.18Å; M178-L191 HydrophobicContact SD-CD2 4.12Å; V187-L191 HydrophobicContact CG2-CD2 4.25Å; V187-L191 HydrophobicContact CG2-CG 4.42Å; V187-L191 PolarHBondContact O-N 2.8Å; D188-L191 PolarHBondContact O-N 3.37Å
192	I	91.8	Very high	92.7	Very high	44 Å²	44	57.9 Å²	57.9	23%	0.226	30%	0.301	C	S	.	.			trans	-95.3	126	-178.5	-59.9	168.6	0	0	0	108.5	A21 H162 T163 Y190	A21-I192 HydrophobicContact CB-CG2 3.64Å; H162-I192 VanDerWaalsContact ND1-C 3.28Å; H162-I192 PolarHBondContact ND1-O 3.29Å; T163-I192 PolarHBondContact OG1-O 3.42Å; Y190-I192 PolarHBondContact O-N 3.02Å
193	D	92.8	Very high	92.9	Very high	9 Å²	9	53 Å²	53	5%	0.048	28%	0.28	C	S	.	.			trans	-89.7	111.9	166.8	-176.9	-5.1	0	0	0	109.1	R138 H162 T163 K166 E195 E196	R138-D193 IonicContact CZ-OD1 2.8Å; R138-D193 IonicContact CZ-OD2 3.19Å; R138-D193 IonicContact NH1-OD1 3.97Å; R138-D193 PolarHBondContact NH1-OD1 3.32Å; R138-D193 VanDerWaalsContact NH1-OD1 3.14Å; R138-D193 IonicContact NH1-OD2 3.8Å; R138-D193 PolarHBondContact NH1-OD2 3.18Å; R138-D193 IonicContact NH2-OD2 3.37Å; H162-D193 PolarHBondContact ND1-N 3.2Å; T163-D193 WeakPolarHBondContact CG2-OD1 3.01Å; K166-D193 WeakPolarHBondContact CB-OD2 3.47Å; K166-D193 HydrophobicContact CG-CB 4.24Å; K166-D193 WeakPolarHBondContact CG-OD2 3.32Å; D193-E195 PolarHBondContact O-N 3.42Å; D193-E195 PolarHBondContact OD1-N 2.81Å; D193-E196 HydrophobicContact CB-CB 4.07Å; D193-E196 WeakPolarHBondContact O-CB 3.29Å; D193-E196 PolarHBondContact O-N 3.14Å; D193-E196 PolarHBondContact OD1-N 3.16Å
194	H	92.2	Very high	93	Very high	17 Å²	17	51.2 Å²	51.2	8%	0.079	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-10.6	-179.9	-65.1	-55.5	0	0	0	113.9	Q22 Y23 Y141 S159 T163	Q22-H194 VanDerWaalsContact CB-CE1 3.47Å; Q22-H194 WeakPolarHBondContact CB-CE1 3.37Å; Q22-H194 PolarHBondContact N-ND1 2.95Å; Y23-H194 HydrophobicContact CE2-CB 3.78Å; Y141-H194 HydrophobicContact CE1-CB 4.06Å; S159-H194 WeakPolarHBondContact CB-NE2 3.37Å; T163-H194 HydrophobicContact CG2-CB 4.25Å; T163-H194 PolarHBondContact OG1-CD2 3.05Å; T163-H194 PolarHBondContact OG1-N 2.95Å
195	E	92.8	Very high	93.2	Very high	34 Å²	34	53.1 Å²	53.1	16%	0.159	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	20.5	175	-56.6	-160.9	-179.5	0	0	113.3	R138 Y141 T163 D193 Q197	R138-E195 IonicContact NE-OE2 3.35Å; R138-E195 PolarHBondContact NE-OE2 3.36Å; R138-E195 PolarHBondContact NH2-O 2.85Å; Y141-E195 HydrophobicContact CE2-CG 4.14Å; Y141-E195 WeakPolarHBondContact CE2-OE1 2.89Å; Y141-E195 WeakPolarHBondContact OH-CG 3.12Å; Y141-E195 PolarHBondContact OH-OE1 3.1Å; T163-E195 HydrophobicContact CG2-CG 4.2Å; D193-E195 PolarHBondContact O-N 3.42Å; D193-E195 PolarHBondContact OD1-N 2.81Å; E195-Q197 PolarHBondContact O-N 3.25Å; E195-Q197 PolarHBondContact O-NE2 3.27Å
196	E	92.8	Very high	93.4	Very high	86 Å²	86	50.2 Å²	50.2	40%	0.402	26%	0.255	S	S	.	.			trans	-52.1	129.4	175.6	-169.5	-179.4	-129.8	0	0	110.8	D193 E200 S201	D193-E196 HydrophobicContact CB-CB 4.07Å; D193-E196 WeakPolarHBondContact O-CB 3.29Å; D193-E196 PolarHBondContact O-N 3.14Å; D193-E196 PolarHBondContact OD1-N 3.16Å; E196-E200 HydrophobicContact CG-CB 3.97Å; E196-S201 WeakPolarHBondContact OE1-CB 3.4Å
197	Q	93.4	Very high	93.5	Very high	31 Å²	31	45.9 Å²	45.9	15%	0.145	23%	0.233	C	C	.	.			trans	-80.1	147.7	173.4	-57.7	-56.9	-57.4	0	0	111.4	E195 Y199 E200 L274	E195-Q197 PolarHBondContact O-N 3.25Å; E195-Q197 PolarHBondContact O-NE2 3.27Å; Q197-Y199 HydrophobicContact CB-CD1 3.86Å; Q197-Y199 HydrophobicContact CB-CE1 3.3Å; Q197-Y199 HydrophobicContact CB-CE2 4.48Å; Q197-Y199 HydrophobicContact CG-CE1 3.93Å; Q197-Y199 PolarHBondContact O-N 2.99Å; Q197-E200 HydrophobicContact CB-CG 4.02Å; Q197-E200 WeakPolarHBondContact CB-OE1 3.36Å; Q197-E200 VanDerWaalsContact CG-OE1 3.29Å; Q197-E200 WeakPolarHBondContact CG-OE1 3.41Å; Q197-E200 PolarHBondContact N-OE1 3.32Å; Q197-E200 WeakPolarHBondContact O-CB 3.46Å; Q197-E200 PolarHBondContact O-N 3.34Å; Q197-L274 HydrophobicContact CG-CD2 4.27Å
198	P	93.7	Very high	93.7	Very high	71 Å²	71	50.4 Å²	50.4	46%	0.461	26%	0.26	S	S	.	.	H	α-helix	trans	-53.4	-28.3	-176.3	-30.5	34.6	0	0	0	116.7	Q228	P198-Q228 PolarHBondContact O-OE1 2.85Å
199	Y	95.9	Very high	94	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-83.9	-19	179.6	60	-91.8	0	0	0	113.4	Q197 V202 F203 A225 F229 V232 L274 F286	Q197-Y199 HydrophobicContact CB-CD1 3.86Å; Q197-Y199 HydrophobicContact CB-CE1 3.3Å; Q197-Y199 HydrophobicContact CB-CE2 4.48Å; Q197-Y199 HydrophobicContact CG-CE1 3.93Å; Q197-Y199 PolarHBondContact O-N 2.99Å; Y199-V202 PolarHBondContact O-N 3.33Å; Y199-F203 WeakPolarHBondContact O-CB 3.27Å; Y199-F203 PolarHBondContact O-N 3.45Å; Y199-A225 WeakPolarHBondContact CB-O 3.31Å; Y199-F229 HydrophobicContact CD1-CB 4.13Å; Y199-F229 HydrophobicContact CD1-CD2 4.31Å; Y199-F229 HydrophobicContact CD2-CB 4.33Å; Y199-F229 HydrophobicContact CD2-CD2 4.21Å; Y199-F229 HydrophobicContact CE1-CD2 4.02Å; Y199-F229 AromaticContact CE2-CD2 3.91Å; Y199-F229 HydrophobicContact CE2-CD2 3.91Å; Y199-F229 HydrophobicContact CG-CB 3.97Å; Y199-F229 HydrophobicContact CG-CD2 4.42Å; Y199-F229 AromaticContact CZ-CD2 3.84Å; Y199-V232 HydrophobicContact CD1-CB 4.31Å; Y199-V232 HydrophobicContact CD1-CG2 4.12Å; Y199-V232 HydrophobicContact CE1-CB 4.06Å; Y199-V232 HydrophobicContact CE1-CG1 4.08Å; Y199-V232 HydrophobicContact CE1-CG2 4.22Å; Y199-L274 WeakPolarHBondContact OH-CA 3.48Å; Y199-L274 WeakPolarHBondContact OH-CB 3.21Å; Y199-L274 PolarHBondContact OH-O 2.68Å; Y199-F286 AromaticContact CD2-CE1 3.93Å; Y199-F286 HydrophobicContact CD2-CE1 3.93Å; Y199-F286 AromaticContact CD2-CZ 3.85Å; Y199-F286 HydrophobicContact CD2-CZ 3.85Å; Y199-F286 AromaticContact CE2-CE1 3.61Å; Y199-F286 HydrophobicContact CE2-CE1 3.61Å; Y199-F286 AromaticContact CE2-CZ 3.83Å; Y199-F286 HydrophobicContact CE2-CZ 3.83Å
200	E	95.3	Very high	94.2	Very high	13 Å²	13	40.7 Å²	40.7	6%	0.061	21%	0.211	C	C	.	.	H	α-helix	trans	-67.6	-52.9	-170.6	-67.9	-177	-143	0	0	111.9	E196 Q197 V202 F203 L204 P276	E196-E200 HydrophobicContact CG-CB 3.97Å; Q197-E200 HydrophobicContact CB-CG 4.02Å; Q197-E200 WeakPolarHBondContact CB-OE1 3.36Å; Q197-E200 VanDerWaalsContact CG-OE1 3.29Å; Q197-E200 WeakPolarHBondContact CG-OE1 3.41Å; Q197-E200 PolarHBondContact N-OE1 3.32Å; Q197-E200 WeakPolarHBondContact O-CB 3.46Å; Q197-E200 PolarHBondContact O-N 3.34Å; E200-V202 VanDerWaalsContact C-N 3.29Å; E200-V202 PolarHBondContact O-N 2.97Å; E200-F203 WeakPolarHBondContact O-CB 3.43Å; E200-F203 PolarHBondContact O-N 2.98Å; E200-L204 WeakPolarHBondContact O-CG 3.29Å; E200-L204 PolarHBondContact O-N 3.31Å; E200-P276 HydrophobicContact CG-CB 3.98Å
201	S	93.6	Very high	94.3	Very high	51 Å²	51	43.6 Å²	43.6	36%	0.357	23%	0.23	S	C	.	.	H	α-helix	trans	-62.2	-37.4	177.3	51.8	0	0	0	0	112.3	E196 K205	E196-S201 WeakPolarHBondContact OE1-CB 3.4Å; S201-K205 VanDerWaalsContact O-CB 3.28Å; S201-K205 WeakPolarHBondContact O-CB 3.44Å; S201-K205 PolarHBondContact O-N 3.47Å
202	V	96.6	Very high	94.5	Very high	16 Å²	16	44.9 Å²	44.9	10%	0.097	24%	0.244	C	C	.	.	H	α-helix	trans	-68.9	-41.5	177.4	-176.9	0	0	0	0	111.3	Y199 E200 K205 S206 N221 Q224 A225	Y199-V202 PolarHBondContact O-N 3.33Å; E200-V202 VanDerWaalsContact C-N 3.29Å; E200-V202 PolarHBondContact O-N 2.97Å; V202-K205 PolarHBondContact O-N 2.92Å; V202-S206 WeakPolarHBondContact O-CB 3.38Å; V202-S206 PolarHBondContact O-N 2.85Å; V202-N221 HydrophobicContact CG1-CB 3.99Å; V202-N221 WeakPolarHBondContact CG1-O 3.39Å; V202-Q224 HydrophobicContact CG1-CB 4.04Å; V202-Q224 HydrophobicContact CG1-CG 4.06Å; V202-A225 HydrophobicContact CB-CB 4.42Å; V202-A225 HydrophobicContact CG1-CB 4.19Å
203	F	96.8	Very high	94.6	Very high	6 Å²	6	44.6 Å²	44.6	3%	0.026	25%	0.251	C	S	.	.	H	α-helix	trans	-60.6	-52.1	174	168.2	-101.1	0	0	0	110.8	Y199 E200 K205 S206 V207 M222 A225 V283 F286 T289 M290 Y293	Y199-F203 WeakPolarHBondContact O-CB 3.27Å; Y199-F203 PolarHBondContact O-N 3.45Å; E200-F203 WeakPolarHBondContact O-CB 3.43Å; E200-F203 PolarHBondContact O-N 2.98Å; F203-K205 VanDerWaalsContact C-N 3.32Å; F203-K205 PolarHBondContact O-N 2.79Å; F203-S206 WeakPolarHBondContact O-CA 3.46Å; F203-S206 VanDerWaalsContact O-CB 3.3Å; F203-S206 WeakPolarHBondContact O-CB 3.07Å; F203-S206 PolarHBondContact O-N 3.35Å; F203-V207 HydrophobicContact CD2-CG2 4.42Å; F203-V207 HydrophobicContact CE1-CG2 4.14Å; F203-V207 HydrophobicContact CE2-CG2 3.96Å; F203-V207 HydrophobicContact CZ-CG2 3.8Å; F203-V207 WeakPolarHBondContact O-CG2 3.22Å; F203-V207 PolarHBondContact O-N 2.94Å; F203-M222 HydrophobicContact CD2-CE 3.74Å; F203-M222 HydrophobicContact CD2-SD 3.85Å; F203-M222 HydrophobicContact CE2-CE 3.85Å; F203-M222 HydrophobicContact CE2-SD 4.27Å; F203-A225 HydrophobicContact CB-CB 4.05Å; F203-V283 HydrophobicContact CE1-CG2 4.28Å; F203-V283 HydrophobicContact CZ-CG1 4.48Å; F203-F286 AromaticContact CD1-CE2 3.98Å; F203-F286 HydrophobicContact CD1-CE2 3.98Å; F203-F286 AromaticContact CD2-CE2 3.89Å; F203-F286 HydrophobicContact CD2-CE2 3.89Å; F203-F286 HydrophobicContact CD2-CZ 4.34Å; F203-F286 AromaticContact CE1-CE2 3.9Å; F203-F286 HydrophobicContact CE1-CE2 3.9Å; F203-F286 AromaticContact CE2-CE2 3.81Å; F203-F286 HydrophobicContact CE2-CE2 3.81Å; F203-F286 AromaticContact CG-CE2 3.98Å; F203-F286 HydrophobicContact CG-CE2 3.98Å; F203-F286 HydrophobicContact CG-CZ 4.27Å; F203-F286 HydrophobicContact CZ-CD2 4.39Å; F203-F286 AromaticContact CZ-CE2 3.81Å; F203-F286 HydrophobicContact CZ-CE2 3.81Å; F203-T289 HydrophobicContact CZ-CG2 4.42Å; F203-M290 HydrophobicContact CD2-CG 3.89Å; F203-M290 HydrophobicContact CE2-CG 3.93Å; F203-Y293 HydrophobicContact CE2-CD2 4.42Å
204	L	95.4	Very high	94.8	Very high	52 Å²	52	47 Å²	47	27%	0.272	27%	0.265	S	S	.	.	H	α-helix	trans	-57.5	-45.7	178.6	-73.9	177	0	0	0	111.7	E200 S206 V207 V208 V278	E200-L204 WeakPolarHBondContact O-CG 3.29Å; E200-L204 PolarHBondContact O-N 3.31Å; L204-S206 VanDerWaalsContact C-N 3.3Å; L204-S206 PolarHBondContact O-N 3.32Å; L204-V207 PolarHBondContact O-N 3.46Å; L204-V208 WeakPolarHBondContact O-CG2 3.38Å; L204-V208 PolarHBondContact O-N 3.4Å; L204-V278 HydrophobicContact CD2-CB 4.22Å; L204-V278 HydrophobicContact CD2-CG1 3.57Å; L204-V278 HydrophobicContact CD2-CG2 3.59Å
205	K	95.8	Very high	95.1	Very high	123 Å²	123	48.3 Å²	48.3	54%	0.535	27%	0.27	S	S	.	.	H	α-helix	trans	-59.4	-41.3	175.4	-175.5	175.1	-176.8	175	0	112.1	S201 V202 F203 V208 L209	S201-K205 VanDerWaalsContact O-CB 3.28Å; S201-K205 WeakPolarHBondContact O-CB 3.44Å; S201-K205 PolarHBondContact O-N 3.47Å; V202-K205 PolarHBondContact O-N 2.92Å; F203-K205 VanDerWaalsContact C-N 3.32Å; F203-K205 PolarHBondContact O-N 2.79Å; K205-V208 PolarHBondContact O-N 2.95Å; K205-L209 HydrophobicContact CG-CD1 4Å; K205-L209 WeakPolarHBondContact O-CB 3.47Å; K205-L209 WeakPolarHBondContact O-CD1 3.45Å; K205-L209 VanDerWaalsContact O-CG 3.27Å; K205-L209 WeakPolarHBondContact O-CG 3.29Å; K205-L209 PolarHBondContact O-N 3.4Å
206	S	95.7	Very high	95.3	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61	-43.2	175.9	-179.8	0	0	0	0	112.2	V202 F203 L204 L209 Y210 S218 M222	V202-S206 WeakPolarHBondContact O-CB 3.38Å; V202-S206 PolarHBondContact O-N 2.85Å; F203-S206 WeakPolarHBondContact O-CA 3.46Å; F203-S206 VanDerWaalsContact O-CB 3.3Å; F203-S206 WeakPolarHBondContact O-CB 3.07Å; F203-S206 PolarHBondContact O-N 3.35Å; L204-S206 VanDerWaalsContact C-N 3.3Å; L204-S206 PolarHBondContact O-N 3.32Å; S206-L209 PolarHBondContact O-N 3.07Å; S206-Y210 WeakPolarHBondContact O-CB 3.29Å; S206-Y210 PolarHBondContact O-N 3.47Å; S206-S218 WeakPolarHBondContact O-CB 3.28Å; S206-S218 PolarHBondContact O-OG 3.31Å; S206-S218 PolarHBondContact OG-O 3.09Å; S206-S218 PolarHBondContact OG-OG 3.01Å; S206-M222 WeakPolarHBondContact OG-CB 3.48Å; S206-M222 VanDerWaalsContact OG-CE 3.31Å; S206-M222 WeakPolarHBondContact OG-CE 3.22Å; S206-M222 PolarHBondContact OG-N 3.47Å
207	V	95.4	Very high	95.6	Very high	21 Å²	21	47.2 Å²	47.2	13%	0.127	28%	0.276	C	S	.	.	H	α-helix	trans	-66	-41.4	177.9	175.7	0	0	0	0	111.6	F203 L204 L209 Y210 N211 M222 Y293	F203-V207 HydrophobicContact CD2-CG2 4.42Å; F203-V207 HydrophobicContact CE1-CG2 4.14Å; F203-V207 HydrophobicContact CE2-CG2 3.96Å; F203-V207 HydrophobicContact CZ-CG2 3.8Å; F203-V207 WeakPolarHBondContact O-CG2 3.22Å; F203-V207 PolarHBondContact O-N 2.94Å; L204-V207 PolarHBondContact O-N 3.46Å; V207-L209 PolarHBondContact O-N 2.05Å; V207-Y210 WeakPolarHBondContact O-CB 3.34Å; V207-Y210 PolarHBondContact O-N 3.18Å; V207-N211 PolarHBondContact O-N 2.81Å; V207-N211 PolarHBondContact O-ND2 3.42Å; V207-M222 HydrophobicContact CG2-CE 4.27Å; V207-Y293 HydrophobicContact CG1-CE1 4.23Å; V207-Y293 HydrophobicContact CG2-CD2 4.06Å; V207-Y293 HydrophobicContact CG2-CE1 4.31Å; V207-Y293 HydrophobicContact CG2-CE2 3.68Å
208	V	95.6	Very high	95.8	Very high	98 Å²	98	45.7 Å²	45.7	59%	0.594	27%	0.269	S	S	*	.	H	α-helix	trans	-61.1	-46.2	174.8	171.9	0	0	0	0	110.8	L204 K205 Y210 N211 S212	L204-V208 WeakPolarHBondContact O-CG2 3.38Å; L204-V208 PolarHBondContact O-N 3.4Å; K205-V208 PolarHBondContact O-N 2.95Å; V208-Y210 VanDerWaalsContact C-N 3.34Å; V208-Y210 PolarHBondContact O-N 3.11Å; V208-N211 PolarHBondContact O-N 3.19Å; V208-S212 PolarHBondContact O-N 3.22Å; V208-S212 PolarHBondContact O-OG 2.97Å
209	L	96.3	Very high	96	Very high	34 Å²	34	42.5 Å²	42.5	18%	0.178	25%	0.248	C	C	.	.	H	α-helix	trans	-63.2	-40.4	178.2	-72.3	164.5	0	0	0	112	K205 S206 V207 N211 S212 G213 D214	K205-L209 HydrophobicContact CG-CD1 4Å; K205-L209 WeakPolarHBondContact O-CB 3.47Å; K205-L209 WeakPolarHBondContact O-CD1 3.45Å; K205-L209 VanDerWaalsContact O-CG 3.27Å; K205-L209 WeakPolarHBondContact O-CG 3.29Å; K205-L209 PolarHBondContact O-N 3.4Å; S206-L209 PolarHBondContact O-N 3.07Å; V207-L209 PolarHBondContact O-N 2.05Å; L209-N211 PolarHBondContact O-N 2.91Å; L209-S212 WeakPolarHBondContact CA-OG 3.14Å; L209-S212 PolarHBondContact O-N 3.35Å; L209-S212 PolarHBondContact O-OG 3.48Å; L209-G213 PolarHBondContact O-N 2.04Å; L209-G213 VanDerWaalsContact O-N 3.13Å; L209-D214 HydrophobicContact CD2-CB 4.14Å; L209-D214 PolarHBondContact O-N 3.45Å
210	Y	93.9	Very high	96.1	Very high	34 Å²	34	50.8 Å²	50.8	13%	0.133	28%	0.279	C	S	.	.	H	α-helix	trans	-55.9	-50.8	173.9	177.7	-91.5	0	0	0	111.6	S206 V207 V208 S212 G213 F215 S218 Y293 F296	S206-Y210 WeakPolarHBondContact O-CB 3.29Å; S206-Y210 PolarHBondContact O-N 3.47Å; V207-Y210 WeakPolarHBondContact O-CB 3.34Å; V207-Y210 PolarHBondContact O-N 3.18Å; V208-Y210 VanDerWaalsContact C-N 3.34Å; V208-Y210 PolarHBondContact O-N 3.11Å; Y210-S212 VanDerWaalsContact C-N 3.26Å; Y210-S212 PolarHBondContact O-N 3.17Å; Y210-G213 PolarHBondContact O-N 3.47Å; Y210-G213 VanDerWaalsContact O-N 3.09Å; Y210-F215 HydrophobicContact CD2-CD1 4.15Å; Y210-F215 HydrophobicContact CD2-CE1 4.13Å; Y210-F215 HydrophobicContact CE2-CD1 4.45Å; Y210-F215 HydrophobicContact CE2-CE1 4.2Å; Y210-S218 WeakPolarHBondContact CB-OG 3.48Å; Y210-Y293 AromaticContact CD1-CD1 3.75Å; Y210-Y293 HydrophobicContact CD1-CD1 3.75Å; Y210-Y293 AromaticContact CD1-CE1 3.62Å; Y210-Y293 HydrophobicContact CD1-CE1 3.62Å; Y210-Y293 AromaticContact CD2-CD1 3.75Å; Y210-Y293 HydrophobicContact CD2-CD1 3.75Å; Y210-Y293 HydrophobicContact CD2-CE1 4.47Å; Y210-Y293 AromaticContact CE1-CD1 3.97Å; Y210-Y293 HydrophobicContact CE1-CD1 3.97Å; Y210-Y293 AromaticContact CE1-CE1 3.84Å; Y210-Y293 HydrophobicContact CE1-CE1 3.84Å; Y210-Y293 AromaticContact CE2-CD1 3.93Å; Y210-Y293 HydrophobicContact CE2-CD1 3.93Å; Y210-Y293 AromaticContact CG-CD1 3.63Å; Y210-Y293 HydrophobicContact CG-CD1 3.63Å; Y210-Y293 AromaticContact CG-CE1 3.97Å; Y210-Y293 HydrophobicContact CG-CE1 3.97Å; Y210-F296 HydrophobicContact CD2-CD1 4.4Å; Y210-F296 HydrophobicContact CE2-CB 3.9Å; Y210-F296 AromaticContact CE2-CD1 3.26Å; Y210-F296 HydrophobicContact CE2-CD1 3.26Å; Y210-F296 AromaticContact CE2-CE1 3.94Å; Y210-F296 HydrophobicContact CE2-CE1 3.94Å; Y210-F296 AromaticContact CE2-CG 3.86Å; Y210-F296 HydrophobicContact CE2-CG 3.86Å; Y210-F296 AromaticContact CZ-CD1 3.48Å; Y210-F296 VanDerWaalsContact CZ-CD1 3.48Å; Y210-F296 AromaticContact CZ-CE1 3.79Å; Y210-F296 AromaticContact CZ-CG 3.96Å; Y210-F296 WeakPolarHBondContact OH-CD1 3.4Å; Y210-F296 VanDerWaalsContact OH-CE1 3.31Å; Y210-F296 WeakPolarHBondContact OH-CE1 3.34Å; Y210-F296 WeakPolarHBondContact OH-CG 3.27Å
211	N	93.4	Very high	96.3	Very high	118 Å²	118	50.8 Å²	50.8	63%	0.631	28%	0.28	S	S	*	.	H	α-helix	trans	-66.8	-28	-179.4	-70.3	-32.8	0	0	0	112.6	V207 V208 L209 G213	V207-N211 PolarHBondContact O-N 2.81Å; V207-N211 PolarHBondContact O-ND2 3.42Å; V208-N211 PolarHBondContact O-N 3.19Å; L209-N211 PolarHBondContact O-N 2.91Å; N211-G213 VanDerWaalsContact C-N 3.32Å
212	S	95.8	Very high	96.5	Very high	85 Å²	85	48.3 Å²	48.3	59%	0.594	26%	0.263	S	S	*	.	H	α-helix	trans	-80.1	-9.4	174.4	74.2	0	0	0	0	114.4	V208 L209 Y210	V208-S212 PolarHBondContact O-N 3.22Å; V208-S212 PolarHBondContact O-OG 2.97Å; L209-S212 WeakPolarHBondContact CA-OG 3.14Å; L209-S212 PolarHBondContact O-N 3.35Å; L209-S212 PolarHBondContact O-OG 3.48Å; Y210-S212 VanDerWaalsContact C-N 3.26Å; Y210-S212 PolarHBondContact O-N 3.17Å
213	G	94	Very high	96.6	Very high	37 Å²	37	49.6 Å²	49.6	38%	0.381	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.5	0.9	-179.2	0	0	0	0	0	115.7	L209 Y210 N211 F215	L209-G213 PolarHBondContact O-N 2.04Å; L209-G213 VanDerWaalsContact O-N 3.13Å; Y210-G213 PolarHBondContact O-N 3.47Å; Y210-G213 VanDerWaalsContact O-N 3.09Å; N211-G213 VanDerWaalsContact C-N 3.32Å; G213-F215 VanDerWaalsContact C-N 3.25Å; G213-F215 WeakPolarHBondContact O-CD2 3.47Å; G213-F215 WeakPolarHBondContact O-CE2 3.34Å; G213-F215 PolarHBondContact O-N 3.01Å
214	D	97.6	Very high	96.7	Very high	61 Å²	61	53.5 Å²	53.5	33%	0.326	29%	0.286	S	S	.	.			trans	-80.1	75.1	170.5	-174.5	-2.8	0	0	0	110.5	L209 S216 S217 S218	L209-D214 HydrophobicContact CD2-CB 4.14Å; L209-D214 PolarHBondContact O-N 3.45Å; D214-S216 VanDerWaalsContact C-N 3.25Å; D214-S216 PolarHBondContact O-N 3.23Å; D214-S216 PolarHBondContact OD1-N 3.06Å; D214-S217 VanDerWaalsContact CG-CB 3.46Å; D214-S217 VanDerWaalsContact CG-OG 3.31Å; D214-S217 PolarHBondContact OD1-N 3.22Å; D214-S217 PolarHBondContact OD1-OG 3.38Å; D214-S217 WeakPolarHBondContact OD2-CB 3.42Å; D214-S217 PolarHBondContact OD2-OG 3.38Å; D214-S218 VanDerWaalsContact O-CB 3.23Å; D214-S218 WeakPolarHBondContact O-CB 3.48Å; D214-S218 PolarHBondContact O-N 3.43Å
215	F	97.4	Very high	96.8	Very high	43 Å²	43	51 Å²	51	19%	0.189	27%	0.273	C	S	.	.	H	α-helix	trans	-64.5	-28	-179.1	-58.6	-64.4	0	0	0	113.1	Y210 G213 A219 F296 K300 L301	Y210-F215 HydrophobicContact CD2-CD1 4.15Å; Y210-F215 HydrophobicContact CD2-CE1 4.13Å; Y210-F215 HydrophobicContact CE2-CD1 4.45Å; Y210-F215 HydrophobicContact CE2-CE1 4.2Å; G213-F215 VanDerWaalsContact C-N 3.25Å; G213-F215 WeakPolarHBondContact O-CD2 3.47Å; G213-F215 WeakPolarHBondContact O-CE2 3.34Å; G213-F215 PolarHBondContact O-N 3.01Å; F215-A219 VanDerWaalsContact O-CB 3.27Å; F215-A219 WeakPolarHBondContact O-CB 3.22Å; F215-A219 PolarHBondContact O-N 2.67Å; F215-F296 HydrophobicContact CE1-CD1 4.07Å; F215-F296 AromaticContact CE1-CE1 3.83Å; F215-F296 HydrophobicContact CE1-CE1 3.83Å; F215-F296 HydrophobicContact CZ-CE1 4.17Å; F215-K300 HydrophobicContact CB-CB 4.19Å; F215-K300 HydrophobicContact CD1-CB 4.02Å; F215-K300 HydrophobicContact CD1-CG 4.1Å; F215-K300 HydrophobicContact CD2-CB 3.42Å; F215-K300 VanDerWaalsContact CD2-CB 3.42Å; F215-K300 HydrophobicContact CD2-CG 3.98Å; F215-K300 HydrophobicContact CE1-CB 4.3Å; F215-K300 HydrophobicContact CE1-CG 3.92Å; F215-K300 HydrophobicContact CE2-CB 3.72Å; F215-K300 HydrophobicContact CE2-CD 4.19Å; F215-K300 HydrophobicContact CE2-CG 3.78Å; F215-K300 HydrophobicContact CG-CB 3.59Å; F215-K300 HydrophobicContact CG-CG 4.14Å; F215-K300 HydrophobicContact CZ-CB 4.16Å; F215-K300 HydrophobicContact CZ-CD 4.26Å; F215-K300 HydrophobicContact CZ-CG 3.75Å; F215-L301 HydrophobicContact CB-CD1 4.46Å; F215-L301 HydrophobicContact CB-CD2 4.05Å; F215-L301 HydrophobicContact CB-CG 4Å
216	S	98.1	Very high	96.9	Very high	72 Å²	72	45.2 Å²	45.2	50%	0.503	25%	0.248	S	C	.	.	H	α-helix	trans	-69.2	-52	179.5	-177.6	0	0	0	0	111.3	D214 S218 A219 R220	D214-S216 VanDerWaalsContact C-N 3.25Å; D214-S216 PolarHBondContact O-N 3.23Å; D214-S216 PolarHBondContact OD1-N 3.06Å; S216-S218 VanDerWaalsContact C-N 3.32Å; S216-A219 PolarHBondContact O-N 2.7Å; S216-R220 PolarHBondContact O-N 3.23Å; S216-R220 VanDerWaalsContact O-N 3.14Å
217	S	98	Very high	97	Very high	25 Å²	25	49.7 Å²	49.7	18%	0.175	28%	0.275	C	S	.	.	H	α-helix	trans	-67.8	-36.3	175.6	-59.2	0	0	0	0	111.3	D214 R220 N221	D214-S217 VanDerWaalsContact CG-CB 3.46Å; D214-S217 VanDerWaalsContact CG-OG 3.31Å; D214-S217 PolarHBondContact OD1-N 3.22Å; D214-S217 PolarHBondContact OD1-OG 3.38Å; D214-S217 WeakPolarHBondContact OD2-CB 3.42Å; D214-S217 PolarHBondContact OD2-OG 3.38Å; S217-R220 PolarHBondContact O-N 2.89Å; S217-N221 PolarHBondContact O-N 3.3Å; S217-N221 PolarHBondContact O-ND2 3.46Å
218	S	97.4	Very high	97.1	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-58.3	-52.3	175.3	179.9	0	0	0	0	111.5	S206 Y210 D214 S216 R220 N221 M222	S206-S218 WeakPolarHBondContact O-CB 3.28Å; S206-S218 PolarHBondContact O-OG 3.31Å; S206-S218 PolarHBondContact OG-O 3.09Å; S206-S218 PolarHBondContact OG-OG 3.01Å; Y210-S218 WeakPolarHBondContact CB-OG 3.48Å; D214-S218 VanDerWaalsContact O-CB 3.23Å; D214-S218 WeakPolarHBondContact O-CB 3.48Å; D214-S218 PolarHBondContact O-N 3.43Å; S216-S218 VanDerWaalsContact C-N 3.32Å; S218-R220 PolarHBondContact O-N 2.58Å; S218-N221 PolarHBondContact O-N 2.84Å; S218-M222 WeakPolarHBondContact O-CB 3.2Å; S218-M222 PolarHBondContact O-N 2.98Å
219	A	98.3	Very high	97.3	Very high	4 Å²	4	46.3 Å²	46.3	3%	0.033	25%	0.252	C	S	.	.	H	α-helix	trans	-56.5	-47.7	178	0	0	0	0	0	111.6	F215 S216 N221 M222 E223 L294 Y298	F215-A219 VanDerWaalsContact O-CB 3.27Å; F215-A219 WeakPolarHBondContact O-CB 3.22Å; F215-A219 PolarHBondContact O-N 2.67Å; S216-A219 PolarHBondContact O-N 2.7Å; A219-N221 PolarHBondContact O-N 3.05Å; A219-M222 PolarHBondContact O-N 3.25Å; A219-E223 WeakPolarHBondContact O-CG 3.5Å; A219-E223 PolarHBondContact O-N 3.34Å; A219-L294 HydrophobicContact CB-CD1 4.2Å; A219-Y298 HydrophobicContact CB-CE1 4.36Å
220	R	98.4	Very high	97.3	Very high	173 Å²	173	45.5 Å²	45.5	65%	0.653	25%	0.247	S	C	*	.	H	α-helix	trans	-58.9	-44.9	178.5	-177.3	179.2	63.4	-175	-5.8	112.8	S216 S217 S218 Q224	S216-R220 PolarHBondContact O-N 3.23Å; S216-R220 VanDerWaalsContact O-N 3.14Å; S217-R220 PolarHBondContact O-N 2.89Å; S218-R220 PolarHBondContact O-N 2.58Å; R220-Q224 PolarHBondContact O-N 3.4Å
221	N	98.2	Very high	97.5	Very high	13 Å²	13	47.5 Å²	47.5	7%	0.07	26%	0.257	C	S	.	.	H	α-helix	trans	-69.6	-36.7	177.7	-73.8	-88.4	0	0	0	110.9	V202 S217 S218 A219 Q224 A225	V202-N221 HydrophobicContact CG1-CB 3.99Å; V202-N221 WeakPolarHBondContact CG1-O 3.39Å; S217-N221 PolarHBondContact O-N 3.3Å; S217-N221 PolarHBondContact O-ND2 3.46Å; S218-N221 PolarHBondContact O-N 2.84Å; A219-N221 PolarHBondContact O-N 3.05Å; N221-Q224 WeakPolarHBondContact O-CB 3.27Å; N221-Q224 PolarHBondContact O-N 2.96Å; N221-A225 WeakPolarHBondContact O-CB 3.47Å; N221-A225 PolarHBondContact O-N 3.44Å
222	M	98.2	Very high	97.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-66.6	-41.4	178.7	-164.5	56.3	74.5	0	0	112.1	F203 S206 V207 S218 A219 Q224 A225 I226 M290 Y293 L294	F203-M222 HydrophobicContact CD2-CE 3.74Å; F203-M222 HydrophobicContact CD2-SD 3.85Å; F203-M222 HydrophobicContact CE2-CE 3.85Å; F203-M222 HydrophobicContact CE2-SD 4.27Å; S206-M222 WeakPolarHBondContact OG-CB 3.48Å; S206-M222 VanDerWaalsContact OG-CE 3.31Å; S206-M222 WeakPolarHBondContact OG-CE 3.22Å; S206-M222 PolarHBondContact OG-N 3.47Å; V207-M222 HydrophobicContact CG2-CE 4.27Å; S218-M222 WeakPolarHBondContact O-CB 3.2Å; S218-M222 PolarHBondContact O-N 2.98Å; A219-M222 PolarHBondContact O-N 3.25Å; M222-Q224 VanDerWaalsContact C-N 3.28Å; M222-Q224 PolarHBondContact O-N 3.48Å; M222-A225 PolarHBondContact O-N 3.22Å; M222-A225 HydrophobicContact SD-CB 4.48Å; M222-I226 HydrophobicContact CG-CD1 4.29Å; M222-I226 WeakPolarHBondContact O-CG1 3.29Å; M222-I226 PolarHBondContact O-N 2.96Å; M222-M290 WeakPolarHBondContact CG-O 3.12Å; M222-M290 HydrophobicContact SD-CB 3.78Å; M222-M290 HydrophobicContact SD-CG 3.79Å; M222-Y293 HydrophobicContact CE-CD2 3.83Å; M222-Y293 HydrophobicContact CE-CG 3.87Å; M222-L294 HydrophobicContact CB-CB 4.5Å; M222-L294 HydrophobicContact CB-CD1 4.12Å; M222-L294 HydrophobicContact CG-CB 3.96Å; M222-L294 HydrophobicContact CG-CD1 4.44Å
223	E	98.5	Very high	97.7	Very high	42 Å²	42	39 Å²	39	20%	0.196	21%	0.205	C	C	.	.	H	α-helix	trans	-57.2	-42.6	172.3	-70.7	-70.4	-178	0	0	111.8	A219 T227 L294 Y298 R348	A219-E223 WeakPolarHBondContact O-CG 3.5Å; A219-E223 PolarHBondContact O-N 3.34Å; E223-T227 WeakPolarHBondContact O-CB 3.41Å; E223-T227 PolarHBondContact O-N 2.91Å; E223-T227 VanDerWaalsContact O-N 3.09Å; E223-T227 PolarHBondContact O-OG1 3.2Å; E223-L294 HydrophobicContact CG-CD1 3.82Å; E223-L294 HydrophobicContact CG-CD2 4.43Å; E223-L294 WeakPolarHBondContact OE1-CD2 3.3Å; E223-Y298 WeakPolarHBondContact OE1-CE2 3.37Å; E223-Y298 PolarHBondContact OE1-OH 2.62Å; E223-R348 IonicContact OE1-CZ 3.72Å; E223-R348 IonicContact OE1-NH1 2.89Å; E223-R348 PolarHBondContact OE1-NH1 3.06Å; E223-R348 IonicContact OE1-NH2 3.77Å; E223-R348 PolarHBondContact OE1-NH2 2.96Å; E223-R348 IonicContact OE2-NH1 3.21Å; E223-R348 PolarHBondContact OE2-NH1 3.11Å
224	Q	98.4	Very high	97.7	Very high	88 Å²	88	39 Å²	39	41%	0.411	20%	0.2	S	C	.	.	H	α-helix	trans	-65.4	-44.7	176.1	-178.3	-179.9	-14.7	0	0	111.5	V202 R220 N221 M222 T227 Q228	V202-Q224 HydrophobicContact CG1-CB 4.04Å; V202-Q224 HydrophobicContact CG1-CG 4.06Å; R220-Q224 PolarHBondContact O-N 3.4Å; N221-Q224 WeakPolarHBondContact O-CB 3.27Å; N221-Q224 PolarHBondContact O-N 2.96Å; M222-Q224 VanDerWaalsContact C-N 3.28Å; M222-Q224 PolarHBondContact O-N 3.48Å; Q224-T227 PolarHBondContact O-N 2.99Å; Q224-Q228 HydrophobicContact CG-CG 4.38Å; Q224-Q228 VanDerWaalsContact NE2-NE2 3.18Å; Q224-Q228 WeakPolarHBondContact O-CB 3.34Å; Q224-Q228 VanDerWaalsContact O-CG 3.31Å; Q224-Q228 WeakPolarHBondContact O-CG 3.44Å; Q224-Q228 PolarHBondContact O-N 3.34Å
225	A	98.2	Very high	97.6	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.1	-45.1	178.6	0	0	0	0	0	111.8	Y199 V202 F203 N221 M222 T227 Q228 F229	Y199-A225 WeakPolarHBondContact CB-O 3.31Å; V202-A225 HydrophobicContact CB-CB 4.42Å; V202-A225 HydrophobicContact CG1-CB 4.19Å; F203-A225 HydrophobicContact CB-CB 4.05Å; N221-A225 WeakPolarHBondContact O-CB 3.47Å; N221-A225 PolarHBondContact O-N 3.44Å; M222-A225 PolarHBondContact O-N 3.22Å; M222-A225 HydrophobicContact SD-CB 4.48Å; A225-T227 PolarHBondContact O-N 3.19Å; A225-Q228 PolarHBondContact O-N 2.97Å; A225-F229 VanDerWaalsContact O-CB 3.29Å; A225-F229 WeakPolarHBondContact O-CB 3.45Å; A225-F229 PolarHBondContact O-N 3.11Å
226	I	98.3	Very high	97.5	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-60	-46.5	176.2	-69.9	168.9	0	0	0	110.8	M222 Q228 F229 F230 M290 Y291 L294	M222-I226 HydrophobicContact CG-CD1 4.29Å; M222-I226 WeakPolarHBondContact O-CG1 3.29Å; M222-I226 PolarHBondContact O-N 2.96Å; I226-Q228 PolarHBondContact O-N 3.47Å; I226-F229 PolarHBondContact O-N 3.02Å; I226-F230 HydrophobicContact CG2-CD2 3.81Å; I226-F230 HydrophobicContact CG2-CE2 3.42Å; I226-F230 VanDerWaalsContact CG2-CE2 3.42Å; I226-F230 HydrophobicContact CG2-CZ 4.1Å; I226-F230 PolarHBondContact O-N 3.43Å; I226-M290 HydrophobicContact CD1-CB 4.03Å; I226-M290 HydrophobicContact CG1-CB 3.73Å; I226-M290 HydrophobicContact CG1-CE 4.34Å; I226-M290 HydrophobicContact CG1-CG 4.32Å; I226-M290 HydrophobicContact CG1-SD 3.76Å; I226-Y291 HydrophobicContact CD1-CD1 4.27Å; I226-Y291 HydrophobicContact CD1-CE1 4.01Å; I226-L294 HydrophobicContact CD1-CD2 3.69Å
227	T	98.1	Very high	97.3	Very high	95 Å²	95	35.2 Å²	35.2	58%	0.583	18%	0.178	S	C	*	.	H	α-helix	trans	-60.4	-46.8	178.9	-59	0	0	0	0	111.1	E223 Q224 A225 E231	E223-T227 WeakPolarHBondContact O-CB 3.41Å; E223-T227 PolarHBondContact O-N 2.91Å; E223-T227 VanDerWaalsContact O-N 3.09Å; E223-T227 PolarHBondContact O-OG1 3.2Å; Q224-T227 PolarHBondContact O-N 2.99Å; A225-T227 PolarHBondContact O-N 3.19Å; T227-E231 PolarHBondContact O-N 2.63Å
228	Q	98.1	Very high	97.1	Very high	47 Å²	47	34.6 Å²	34.6	22%	0.22	18%	0.175	C	C	.	.	H	α-helix	trans	-66.7	-40.6	178.6	-73.5	173.8	-27.3	0	0	111.9	P198 Q224 A225 I226 E231 V232	P198-Q228 PolarHBondContact O-OE1 2.85Å; Q224-Q228 HydrophobicContact CG-CG 4.38Å; Q224-Q228 VanDerWaalsContact NE2-NE2 3.18Å; Q224-Q228 WeakPolarHBondContact O-CB 3.34Å; Q224-Q228 VanDerWaalsContact O-CG 3.31Å; Q224-Q228 WeakPolarHBondContact O-CG 3.44Å; Q224-Q228 PolarHBondContact O-N 3.34Å; A225-Q228 PolarHBondContact O-N 2.97Å; I226-Q228 PolarHBondContact O-N 3.47Å; Q228-E231 PolarHBondContact O-N 3.4Å; Q228-V232 WeakPolarHBondContact O-CG2 3.44Å; Q228-V232 PolarHBondContact O-N 2.95Å
229	F	98.2	Very high	96.8	Very high	1 Å²	1	35.2 Å²	35.2	0%	0.004	18%	0.181	C	C	.	.	H	α-helix	trans	-60.7	-49.1	177.2	172.6	-99.3	0	0	0	111.5	Y199 A225 I226 E231 V232 Y233 L274 F286 V287 M290 Y354	Y199-F229 HydrophobicContact CD1-CB 4.13Å; Y199-F229 HydrophobicContact CD1-CD2 4.31Å; Y199-F229 HydrophobicContact CD2-CB 4.33Å; Y199-F229 HydrophobicContact CD2-CD2 4.21Å; Y199-F229 HydrophobicContact CE1-CD2 4.02Å; Y199-F229 AromaticContact CE2-CD2 3.91Å; Y199-F229 HydrophobicContact CE2-CD2 3.91Å; Y199-F229 HydrophobicContact CG-CB 3.97Å; Y199-F229 HydrophobicContact CG-CD2 4.42Å; Y199-F229 AromaticContact CZ-CD2 3.84Å; A225-F229 VanDerWaalsContact O-CB 3.29Å; A225-F229 WeakPolarHBondContact O-CB 3.45Å; A225-F229 PolarHBondContact O-N 3.11Å; I226-F229 PolarHBondContact O-N 3.02Å; F229-E231 VanDerWaalsContact C-N 3.27Å; F229-E231 PolarHBondContact O-N 3.46Å; F229-V232 PolarHBondContact O-N 3.23Å; F229-Y233 WeakPolarHBondContact O-CB 2.99Å; F229-Y233 PolarHBondContact O-N 3.48Å; F229-L274 HydrophobicContact CE2-CB 4.07Å; F229-F286 HydrophobicContact CD2-CD1 4.05Å; F229-F286 AromaticContact CD2-CE1 3.57Å; F229-F286 HydrophobicContact CD2-CE1 3.57Å; F229-F286 AromaticContact CE2-CD1 3.75Å; F229-F286 HydrophobicContact CE2-CD1 3.75Å; F229-F286 AromaticContact CE2-CE1 3.75Å; F229-F286 HydrophobicContact CE2-CE1 3.75Å; F229-F286 HydrophobicContact CG-CE1 4.21Å; F229-F286 HydrophobicContact CZ-CD1 4.23Å; F229-V287 HydrophobicContact CD1-CG2 4.22Å; F229-V287 HydrophobicContact CE1-CG2 3.39Å; F229-V287 HydrophobicContact CZ-CG2 3.79Å; F229-M290 HydrophobicContact CB-CE 4.12Å; F229-M290 HydrophobicContact CD1-CE 3.75Å; F229-M290 HydrophobicContact CE1-CE 4.34Å; F229-M290 HydrophobicContact CG-CE 3.87Å; F229-Y354 HydrophobicContact CE1-CE2 4.23Å
230	F	97.7	Very high	96.5	Very high	16 Å²	16	35.2 Å²	35.2	7%	0.07	18%	0.181	C	C	.	.	H	α-helix	trans	-64.6	-32.9	178.8	-69.4	-31.7	0	0	0	113	I226 S234 V287 Y291 E350 Y354	I226-F230 HydrophobicContact CG2-CD2 3.81Å; I226-F230 HydrophobicContact CG2-CE2 3.42Å; I226-F230 VanDerWaalsContact CG2-CE2 3.42Å; I226-F230 HydrophobicContact CG2-CZ 4.1Å; I226-F230 PolarHBondContact O-N 3.43Å; F230-S234 WeakPolarHBondContact O-CB 3.09Å; F230-S234 PolarHBondContact O-N 3.47Å; F230-V287 HydrophobicContact CE1-CG1 4.11Å; F230-V287 HydrophobicContact CZ-CG1 4.13Å; F230-Y291 HydrophobicContact CZ-CE2 4.36Å; F230-E350 HydrophobicContact CD2-CB 4.07Å; F230-E350 HydrophobicContact CD2-CG 4.05Å; F230-E350 HydrophobicContact CE2-CB 3.97Å; F230-E350 HydrophobicContact CE2-CG 3.64Å; F230-Y354 AromaticContact CD1-CD2 3.76Å; F230-Y354 HydrophobicContact CD1-CD2 3.76Å; F230-Y354 HydrophobicContact CD1-CE2 4.3Å; F230-Y354 AromaticContact CD1-CG 3.92Å; F230-Y354 HydrophobicContact CD1-CG 3.92Å; F230-Y354 AromaticContact CE1-CD1 3.78Å; F230-Y354 HydrophobicContact CE1-CD1 3.78Å; F230-Y354 AromaticContact CE1-CD2 3.75Å; F230-Y354 HydrophobicContact CE1-CD2 3.75Å; F230-Y354 HydrophobicContact CE1-CE1 4.34Å; F230-Y354 HydrophobicContact CE1-CE2 4.29Å; F230-Y354 AromaticContact CE1-CG 3.45Å; F230-Y354 HydrophobicContact CE1-CG 3.45Å; F230-Y354 VanDerWaalsContact CE1-CG 3.45Å; F230-Y354 HydrophobicContact CZ-CD1 4.45Å; F230-Y354 HydrophobicContact CZ-CG 4.23Å
231	E	96.4	Very high	95.8	Very high	77 Å²	77	28.8 Å²	28.8	36%	0.36	16%	0.158	S	C	.	.	H	α-helix	trans	-65	-49.1	172.9	-178.1	66.9	177.9	0	0	111.1	R81 T227 Q228 F229 Y233 S234 L235	R81-E231 IonicContact CZ-OE1 3.47Å; R81-E231 IonicContact CZ-OE2 3.89Å; R81-E231 IonicContact NH1-OE1 3.25Å; R81-E231 PolarHBondContact NH1-OE1 2.97Å; R81-E231 IonicContact NH2-OE1 2.78Å; R81-E231 PolarHBondContact NH2-OE1 2.91Å; R81-E231 IonicContact NH2-OE2 3.19Å; R81-E231 PolarHBondContact NH2-OE2 3.28Å; T227-E231 PolarHBondContact O-N 2.63Å; Q228-E231 PolarHBondContact O-N 3.4Å; F229-E231 VanDerWaalsContact C-N 3.27Å; F229-E231 PolarHBondContact O-N 3.46Å; E231-Y233 PolarHBondContact O-N 3.3Å; E231-S234 WeakPolarHBondContact O-CB 3.38Å; E231-S234 PolarHBondContact O-N 3.21Å; E231-S234 VanDerWaalsContact O-N 3.16Å; E231-S234 PolarHBondContact O-OG 3.02Å; E231-L235 WeakPolarHBondContact O-CG 3.38Å; E231-L235 PolarHBondContact O-N 3.38Å
232	V	96.4	Very high	94.7	Very high	18 Å²	18	28.7 Å²	28.7	11%	0.109	16%	0.16	C	C	.	.	H	α-helix	trans	-63	-41.4	177.9	176	0	0	0	0	111.3	Y199 Q228 F229 S234 L235 C236 L274	Y199-V232 HydrophobicContact CD1-CB 4.31Å; Y199-V232 HydrophobicContact CD1-CG2 4.12Å; Y199-V232 HydrophobicContact CE1-CB 4.06Å; Y199-V232 HydrophobicContact CE1-CG1 4.08Å; Y199-V232 HydrophobicContact CE1-CG2 4.22Å; Q228-V232 WeakPolarHBondContact O-CG2 3.44Å; Q228-V232 PolarHBondContact O-N 2.95Å; F229-V232 PolarHBondContact O-N 3.23Å; V232-S234 VanDerWaalsContact C-N 3.32Å; V232-S234 PolarHBondContact O-N 3.24Å; V232-L235 PolarHBondContact O-N 3.34Å; V232-C236 PolarHBondContact O-N 2.9Å; V232-L274 HydrophobicContact CG1-CD1 3.97Å; V232-L274 HydrophobicContact CG1-CD2 3.56Å; V232-L274 HydrophobicContact CG1-CG 4.43Å
233	Y	96.9	Very high	93.3	Very high	5 Å²	5	30.8 Å²	30.8	2%	0.02	18%	0.175	C	C	.	.	H	α-helix	trans	-59	-43.5	173.3	-179.8	-91.5	0	0	0	111.9	F229 E231 L235 C236 S237 C270 E271 L274 Y354 T358 Q361	F229-Y233 WeakPolarHBondContact O-CB 2.99Å; F229-Y233 PolarHBondContact O-N 3.48Å; E231-Y233 PolarHBondContact O-N 3.3Å; Y233-L235 VanDerWaalsContact C-N 3.28Å; Y233-L235 PolarHBondContact O-N 3.3Å; Y233-C236 PolarHBondContact O-N 2.85Å; Y233-S237 WeakPolarHBondContact O-CB 3.47Å; Y233-S237 PolarHBondContact O-N 2.7Å; Y233-C270 HydrophobicContact CD2-CB 4Å; Y233-C270 HydrophobicContact CE2-CB 3.71Å; Y233-E271 HydrophobicContact CE2-CB 4.33Å; Y233-L274 HydrophobicContact CD2-CD1 4.31Å; Y233-Y354 AromaticContact CD1-CD2 3.83Å; Y233-Y354 HydrophobicContact CD1-CD2 3.83Å; Y233-Y354 AromaticContact CD1-CE2 3.53Å; Y233-Y354 HydrophobicContact CD1-CE2 3.53Å; Y233-Y354 AromaticContact CD2-CE2 3.71Å; Y233-Y354 HydrophobicContact CD2-CE2 3.71Å; Y233-Y354 AromaticContact CE1-CD2 3.93Å; Y233-Y354 HydrophobicContact CE1-CD2 3.93Å; Y233-Y354 AromaticContact CE1-CE2 3.59Å; Y233-Y354 HydrophobicContact CE1-CE2 3.59Å; Y233-Y354 AromaticContact CE2-CE2 3.75Å; Y233-Y354 HydrophobicContact CE2-CE2 3.75Å; Y233-Y354 HydrophobicContact CG-CD2 4.27Å; Y233-Y354 AromaticContact CG-CE2 3.6Å; Y233-Y354 HydrophobicContact CG-CE2 3.6Å; Y233-Y354 AromaticContact CZ-CE2 3.72Å; Y233-T358 HydrophobicContact CE1-CG2 4.37Å; Y233-T358 HydrophobicContact CE2-CG2 4.45Å; Y233-T358 WeakPolarHBondContact OH-CG2 3.47Å; Y233-Q361 PolarHBondContact OH-OE1 2.96Å; Y233-Q361 VanDerWaalsContact OH-OE1 3.06Å
234	S	95.3	Very high	91.9	Very high	39 Å²	39	32.3 Å²	32.3	27%	0.273	18%	0.179	S	C	.	.	H	α-helix	trans	-63.1	-36	178	81.8	0	0	0	0	112.4	F230 E231 V232 A238	F230-S234 WeakPolarHBondContact O-CB 3.09Å; F230-S234 PolarHBondContact O-N 3.47Å; E231-S234 WeakPolarHBondContact O-CB 3.38Å; E231-S234 PolarHBondContact O-N 3.21Å; E231-S234 VanDerWaalsContact O-N 3.16Å; E231-S234 PolarHBondContact O-OG 3.02Å; V232-S234 VanDerWaalsContact C-N 3.32Å; V232-S234 PolarHBondContact O-N 3.24Å; S234-A238 VanDerWaalsContact O-CB 3.28Å; S234-A238 WeakPolarHBondContact O-CB 3.4Å; S234-A238 PolarHBondContact O-N 2.95Å
235	L	94.6	Very high	90.3	Very high	58 Å²	58	32.9 Å²	32.9	30%	0.304	18%	0.182	S	C	.	.	H	α-helix	trans	-69.8	-44.1	175.5	-69.3	171.3	0	0	0	111.4	A77 E231 V232 Y233 A238 G239	A77-L235 HydrophobicContact CB-CB 4.25Å; A77-L235 HydrophobicContact CB-CD2 4.34Å; A77-L235 WeakPolarHBondContact CB-O 3.39Å; E231-L235 WeakPolarHBondContact O-CG 3.38Å; E231-L235 PolarHBondContact O-N 3.38Å; V232-L235 PolarHBondContact O-N 3.34Å; Y233-L235 VanDerWaalsContact C-N 3.28Å; Y233-L235 PolarHBondContact O-N 3.3Å; L235-A238 PolarHBondContact O-N 3.15Å; L235-G239 PolarHBondContact O-N 2.82Å
236	C	95	Very high	88.9	Confident	28 Å²	28	38.2 Å²	38.2	19%	0.189	21%	0.209	C	C	.	.	H	α-helix	trans	-56.9	-51.7	173.5	-179.4	0	0	0	0	110.9	V232 Y233 A238 G239 C240 C270 L274	V232-C236 PolarHBondContact O-N 2.9Å; Y233-C236 PolarHBondContact O-N 2.85Å; C236-A238 PolarHBondContact O-N 3.18Å; C236-G239 PolarHBondContact O-N 3.32Å; C236-C240 PolarHBondContact O-N 3.45Å; C236-C240 PolarHBondContact O-SG 2.98Å; C236-C270 HydrophobicContact CB-CB 3.87Å; C236-C270 WeakPolarHBondContact CB-SG 3.07Å; C236-C270 VanDerWaalsContact SG-CA 3.52Å; C236-C270 WeakPolarHBondContact SG-CB 3.36Å; C236-C270 CovalentContact SG-SG 2.05Å; C236-C270 PolarHBondContact SG-SG 3.08Å; C236-L274 HydrophobicContact CB-CD1 4.1Å
237	S	94.6	Very high	87.4	Confident	10 Å²	10	44.6 Å²	44.6	7%	0.07	24%	0.242	C	C	.	.	H	α-helix	trans	-63	-30	179.9	179	0	0	0	0	112.8	Y233 K267 C270	Y233-S237 WeakPolarHBondContact O-CB 3.47Å; Y233-S237 PolarHBondContact O-N 2.7Å; S237-K267 VanDerWaalsContact O-CE 3.24Å; S237-K267 WeakPolarHBondContact O-CE 3.34Å; S237-C270 PolarHBondContact N-SG 2.62Å
238	A	93.3	Very high	86.1	Confident	12 Å²	12	46 Å²	46	10%	0.099	24%	0.242	C	C	.	.	H	α-helix	trans	-76.4	-33.5	175.2	0	0	0	0	0	112.4	R81 S234 L235 C236 C240	R81-A238 HydrophobicContact CB-CB 4.21Å; S234-A238 VanDerWaalsContact O-CB 3.28Å; S234-A238 WeakPolarHBondContact O-CB 3.4Å; S234-A238 PolarHBondContact O-N 2.95Å; L235-A238 PolarHBondContact O-N 3.15Å; C236-A238 PolarHBondContact O-N 3.18Å; A238-C240 VanDerWaalsContact C-N 3.27Å; A238-C240 PolarHBondContact O-N 3.28Å
239	G	92.2	Very high	84.9	Confident	13 Å²	13	53.5 Å²	53.5	13%	0.134	28%	0.275	C	S	.	.	H	α-helix	trans	-67.6	-24.4	176.6	0	0	0	0	0	113.6	L235 C236 E241 G242	L235-G239 PolarHBondContact O-N 2.82Å; C236-G239 PolarHBondContact O-N 3.32Å; G239-E241 PolarHBondContact O-N 3.35Å; G239-G242 PolarHBondContact O-N 3.42Å; G239-G242 VanDerWaalsContact O-N 3.14Å
240	C	91.5	Very high	84	Confident	4 Å²	4	57.9 Å²	57.9	3%	0.027	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-2.4	176.2	-69.1	0	0	0	0	115.4	C236 A238 G242 Y244 C266 K267	C236-C240 PolarHBondContact O-N 3.45Å; C236-C240 PolarHBondContact O-SG 2.98Å; A238-C240 VanDerWaalsContact C-N 3.27Å; A238-C240 PolarHBondContact O-N 3.28Å; C240-G242 VanDerWaalsContact C-N 3.26Å; C240-Y244 PolarHBondContact O-OH 3.35Å; C240-C266 WeakPolarHBondContact CA-SG 3.19Å; C240-C266 HydrophobicContact CB-CB 3.59Å; C240-C266 WeakPolarHBondContact CB-SG 3.48Å; C240-C266 WeakPolarHBondContact SG-CB 3.47Å; C240-C266 CovalentContact SG-SG 2.04Å; C240-C266 PolarHBondContact SG-SG 3.24Å; C240-K267 HydrophobicContact CB-CG 3.72Å; C240-K267 PolarHBondContact SG-N 2.69Å; C240-K267 VanDerWaalsContact SG-N 3.36Å
241	E	84.1	Confident	83.5	Confident	38 Å²	38	63.4 Å²	63.4	18%	0.178	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	28.3	173.8	-61.1	174	-171.7	0	0	111.1	R108 G239 V263 K267	R108-E241 IonicContact CZ-OE1 2.76Å; R108-E241 IonicContact CZ-OE2 3.41Å; R108-E241 IonicContact NE-OE1 3.74Å; R108-E241 IonicContact NE-OE2 3.48Å; R108-E241 PolarHBondContact NE-OE2 3.41Å; R108-E241 IonicContact NH2-OE1 2.74Å; R108-E241 PolarHBondContact NH2-OE1 3.24Å; R108-E241 IonicContact NH2-OE2 3.76Å; R108-E241 PolarHBondContact NH2-OE2 3.25Å; G239-E241 PolarHBondContact O-N 3.35Å; E241-V263 HydrophobicContact CG-CG1 4.22Å; E241-K267 IonicContact OE1-NZ 3.72Å; E241-K267 PolarHBondContact OE1-NZ 3.37Å
242	G	75.3	Confident	83.1	Confident	10 Å²	10	66.7 Å²	66.7	10%	0.103	34%	0.337	C	S	.	.			trans	-59.4	176.4	174.7	0	0	0	0	0	113.7	E76 G239 C240 Y244	E76-G242 WeakPolarHBondContact OE1-CA 3.28Å; G239-G242 PolarHBondContact O-N 3.42Å; G239-G242 VanDerWaalsContact O-N 3.14Å; C240-G242 VanDerWaalsContact C-N 3.26Å; G242-Y244 WeakPolarHBondContact O-CD2 3.29Å; G242-Y244 VanDerWaalsContact O-CE2 3.29Å; G242-Y244 WeakPolarHBondContact O-CE2 3.24Å
243	S	69.2	Low	82.7	Confident	45 Å²	45	74.2 Å²	74.2	32%	0.315	37%	0.365	S	S	.	.			trans	-73.2	144.8	172.9	-55.6	0	0	0	0	109	E76 K116 Y126	E76-S243 PolarHBondContact OE1-N 3.18Å; E76-S243 VanDerWaalsContact OE1-N 3.14Å; K116-S243 PolarHBondContact NZ-OG 3.43Å; K116-S243 VanDerWaalsContact NZ-OG 3.12Å; Y126-S243 WeakPolarHBondContact CD1-O 3.22Å; Y126-S243 WeakPolarHBondContact CE1-O 3.35Å; Y126-S243 PolarHBondContact OH-O 2.75Å
244	Y	68.1	Low	82.3	Confident	74 Å²	74	76.8 Å²	76.8	29%	0.29	38%	0.382	S	S	.	.			trans	-117.7	144.1	179	-70.8	-88.3	0	0	0	109.8	C240 G242 L259 D262 V263	C240-Y244 PolarHBondContact O-OH 3.35Å; G242-Y244 WeakPolarHBondContact O-CD2 3.29Å; G242-Y244 VanDerWaalsContact O-CE2 3.29Å; G242-Y244 WeakPolarHBondContact O-CE2 3.24Å; Y244-L259 HydrophobicContact CG-CD2 4.43Å; Y244-D262 HydrophobicContact CD1-CB 4.28Å; Y244-D262 HydrophobicContact CE1-CB 3.86Å; Y244-V263 HydrophobicContact CE2-CG2 3.61Å; Y244-V263 WeakPolarHBondContact OH-CA 3.35Å; Y244-V263 WeakPolarHBondContact OH-CG2 3.44Å
245	E	65.5	Low	81.9	Confident	100 Å²	100	76.6 Å²	76.6	47%	0.467	38%	0.381	S	S	.	.			trans	-76.1	122.7	166.9	-171.2	172.4	-161	0	0	108.6	L247	E245-L247 HydrophobicContact CG-CD2 3.79Å; E245-L247 HydrophobicContact CG-CG 4.44Å; E245-L247 PolarHBondContact O-N 2.9Å
246	I	67.6	Low	81.6	Confident	112 Å²	112	76.3 Å²	76.3	57%	0.574	38%	0.38	S	S	*	.			trans	-87.6	100.9	174.1	-59.7	173.5	0	0	0	106.5	E248	I246-E248 WeakPolarHBondContact CG2-O 3.29Å
247	L	66.3	Low	81.3	Confident	134 Å²	134	76.2 Å²	76.2	70%	0.702	38%	0.381	S	S	*	.			trans	-78.2	-33.8	-176.4	-63.1	172.4	0	0	0	112.4	E245	E245-L247 HydrophobicContact CG-CD2 3.79Å; E245-L247 HydrophobicContact CG-CG 4.44Å; E245-L247 PolarHBondContact O-N 2.9Å
248	E	71.5	Confident	81	Confident	125 Å²	125	78.4 Å²	78.4	58%	0.584	39%	0.392	S	S	*	.	S	Bend	trans	-131.3	141.9	-176.1	-67.5	-177.8	171.8	0	0	111.7	I246 K250	I246-E248 WeakPolarHBondContact CG2-O 3.29Å; E248-K250 HydrophobicContact CB-CG 4.41Å; E248-K250 PolarHBondContact O-N 3.02Å; E248-K250 WeakPolarHBondContact OE2-CE 3.37Å; E248-K250 IonicContact OE2-NZ 2.7Å
249	F	73	Confident	80.7	Confident	205 Å²	205	80.9 Å²	80.9	90%	0.899	40%	0.403	S	S	*	.			trans	-90	100.7	170.7	-69.5	-81.6	0	0	0	109.1
250	K	79.7	Confident	80.6	Confident	92 Å²	92	84.9 Å²	84.9	40%	0.4	42%	0.417	S	S	.	.			trans	-102.2	173.2	171.9	-56.7	-178.1	-178.6	175.7	0	110.5	E248 P254 S255 D258	E248-K250 HydrophobicContact CB-CG 4.41Å; E248-K250 PolarHBondContact O-N 3.02Å; E248-K250 WeakPolarHBondContact OE2-CE 3.37Å; E248-K250 IonicContact OE2-NZ 2.7Å; K250-P254 HydrophobicContact CB-CB 3.9Å; K250-P254 HydrophobicContact CD-CB 4.11Å; K250-S255 PolarHBondContact O-OG 2.94Å; K250-D258 WeakPolarHBondContact CD-OD2 3.42Å; K250-D258 WeakPolarHBondContact CE-OD2 3.21Å; K250-D258 IonicContact NZ-OD1 3.05Å; K250-D258 IonicContact NZ-OD2 3.95Å; K250-D258 PolarHBondContact NZ-OD2 3.39Å
251	D	86.3	Confident	80.6	Confident	133 Å²	133	85.3 Å²	85.3	71%	0.711	42%	0.419	S	S	*	.			trans	-58.4	163.5	168.3	-77.3	-31.4	0	0	0	111.5	Y253 P254 S255	D251-Y253 PolarHBondContact O-N 2.95Å; D251-P254 HydrophobicContact CB-CG 4.18Å; D251-P254 WeakPolarHBondContact O-CD 3.3Å; D251-S255 WeakPolarHBondContact O-CB 3.34Å; D251-S255 PolarHBondContact O-N 3.46Å; D251-S255 PolarHBondContact O-OG 3.31Å
252	F	88.3	Confident	80.8	Confident	145 Å²	145	85.2 Å²	85.2	64%	0.636	42%	0.42	S	S	*	.	H	α-helix	trans	-53.5	-50.3	-171.3	174.8	-104.4	0	0	0	114	L256	F252-L256 HydrophobicContact CZ-CD2 4.45Å; F252-L256 WeakPolarHBondContact O-CB 3.41Å; F252-L256 PolarHBondContact O-N 2.82Å
253	Y	88.9	Confident	81.6	Confident	177 Å²	177	85.8 Å²	85.8	69%	0.694	42%	0.421	S	S	*	.	H	α-helix	trans	-72.2	-44.6	-177.7	-78.6	-71.5	0	0	0	113.6	D251 S255 L256 A257	D251-Y253 PolarHBondContact O-N 2.95Å; Y253-S255 VanDerWaalsContact C-N 3.35Å; Y253-S255 PolarHBondContact O-N 3.42Å; Y253-L256 PolarHBondContact O-N 3.34Å; Y253-A257 WeakPolarHBondContact O-CB 3.25Å; Y253-A257 PolarHBondContact O-N 2.78Å
254	P	88.6	Confident	82.8	Confident	58 Å²	58	85 Å²	85	38%	0.377	41%	0.413	S	S	.	.	H	α-helix	trans	-55.8	-46	171.2	-29.5	36	0	0	0	113.2	K250 D251 L256 A257 D258	K250-P254 HydrophobicContact CB-CB 3.9Å; K250-P254 HydrophobicContact CD-CB 4.11Å; D251-P254 HydrophobicContact CB-CG 4.18Å; D251-P254 WeakPolarHBondContact O-CD 3.3Å; P254-L256 VanDerWaalsContact C-N 3.3Å; P254-L256 PolarHBondContact O-N 2.9Å; P254-A257 PolarHBondContact O-N 2.94Å; P254-D258 PolarHBondContact O-N 3.48Å
255	S	87	Confident	84	Confident	35 Å²	35	84.4 Å²	84.4	25%	0.245	41%	0.412	C	S	.	.	H	α-helix	trans	-60	-41.4	176.7	-59.5	0	0	0	0	112.1	K250 D251 Y253 L259	K250-S255 PolarHBondContact O-OG 2.94Å; D251-S255 WeakPolarHBondContact O-CB 3.34Å; D251-S255 PolarHBondContact O-N 3.46Å; D251-S255 PolarHBondContact O-OG 3.31Å; Y253-S255 VanDerWaalsContact C-N 3.35Å; Y253-S255 PolarHBondContact O-N 3.42Å; S255-L259 VanDerWaalsContact O-CG 3.29Å; S255-L259 WeakPolarHBondContact O-CG 3.29Å; S255-L259 PolarHBondContact O-N 3.04Å
256	L	87.7	Confident	85.3	Confident	53 Å²	53	80.6 Å²	80.6	28%	0.277	40%	0.396	S	S	.	.	H	α-helix	trans	-66.8	-41.2	177.6	-173.8	62	0	0	0	111.7	F252 Y253 P254 L259 F260	F252-L256 HydrophobicContact CZ-CD2 4.45Å; F252-L256 WeakPolarHBondContact O-CB 3.41Å; F252-L256 PolarHBondContact O-N 2.82Å; Y253-L256 PolarHBondContact O-N 3.34Å; P254-L256 VanDerWaalsContact C-N 3.3Å; P254-L256 PolarHBondContact O-N 2.9Å; L256-L259 PolarHBondContact O-N 2.93Å; L256-F260 HydrophobicContact CD1-CD2 3.88Å; L256-F260 HydrophobicContact CD1-CE2 3.47Å; L256-F260 VanDerWaalsContact CD1-CE2 3.47Å; L256-F260 HydrophobicContact CD1-CZ 4.45Å; L256-F260 HydrophobicContact CD2-CE2 4.24Å; L256-F260 HydrophobicContact CG-CD2 3.83Å; L256-F260 HydrophobicContact CG-CE2 3.69Å; L256-F260 WeakPolarHBondContact O-CD2 3.49Å; L256-F260 PolarHBondContact O-N 3.48Å
257	A	89.4	Confident	86.6	Confident	26 Å²	26	77 Å²	77	22%	0.215	38%	0.376	C	S	.	.	H	α-helix	trans	-62.7	-46.1	178.3	0	0	0	0	0	111.4	Y253 P254 L259 F260 L261 L372	Y253-A257 WeakPolarHBondContact O-CB 3.25Å; Y253-A257 PolarHBondContact O-N 2.78Å; P254-A257 PolarHBondContact O-N 2.94Å; A257-L259 PolarHBondContact O-N 3.38Å; A257-F260 PolarHBondContact O-N 2.84Å; A257-L261 VanDerWaalsContact O-CB 3.31Å; A257-L261 WeakPolarHBondContact O-CB 3.43Å; A257-L261 PolarHBondContact O-N 3.14Å; A257-L372 HydrophobicContact CB-CD1 3.96Å; A257-L372 HydrophobicContact CB-CD2 3.96Å
258	D	87.4	Confident	88	Confident	56 Å²	56	72.1 Å²	72.1	30%	0.299	35%	0.352	S	S	.	.	H	α-helix	trans	-60.2	-46	177.3	-73.5	-16.8	0	0	0	111.9	K250 P254 F260 L261 D262	K250-D258 WeakPolarHBondContact CD-OD2 3.42Å; K250-D258 WeakPolarHBondContact CE-OD2 3.21Å; K250-D258 IonicContact NZ-OD1 3.05Å; K250-D258 IonicContact NZ-OD2 3.95Å; K250-D258 PolarHBondContact NZ-OD2 3.39Å; P254-D258 PolarHBondContact O-N 3.48Å; D258-F260 PolarHBondContact O-N 3.06Å; D258-L261 WeakPolarHBondContact O-CB 3.4Å; D258-L261 PolarHBondContact O-N 3.08Å; D258-D262 PolarHBondContact O-N 3.44Å
259	L	87.9	Confident	89.1	Confident	64 Å²	64	69.7 Å²	69.7	34%	0.335	34%	0.337	S	S	.	.	H	α-helix	trans	-61.2	-42.4	177.1	-71.4	170.5	0	0	0	112.1	Y244 S255 L256 A257 V263	Y244-L259 HydrophobicContact CG-CD2 4.43Å; S255-L259 VanDerWaalsContact O-CG 3.29Å; S255-L259 WeakPolarHBondContact O-CG 3.29Å; S255-L259 PolarHBondContact O-N 3.04Å; L256-L259 PolarHBondContact O-N 2.93Å; A257-L259 PolarHBondContact O-N 3.38Å; L259-V263 VanDerWaalsContact O-CG2 3.28Å; L259-V263 WeakPolarHBondContact O-CG2 3.39Å; L259-V263 PolarHBondContact O-N 2.98Å
260	F	89.7	Confident	90.2	Very high	97 Å²	97	59.9 Å²	59.9	43%	0.425	30%	0.295	S	S	.	.	H	α-helix	trans	-67.2	-41.1	175.1	-84.3	-64.5	0	0	0	111.7	I105 L256 A257 D258 D262 V263 L264	I105-F260 HydrophobicContact CD1-CZ 4.09Å; L256-F260 HydrophobicContact CD1-CD2 3.88Å; L256-F260 HydrophobicContact CD1-CE2 3.47Å; L256-F260 VanDerWaalsContact CD1-CE2 3.47Å; L256-F260 HydrophobicContact CD1-CZ 4.45Å; L256-F260 HydrophobicContact CD2-CE2 4.24Å; L256-F260 HydrophobicContact CG-CD2 3.83Å; L256-F260 HydrophobicContact CG-CE2 3.69Å; L256-F260 WeakPolarHBondContact O-CD2 3.49Å; L256-F260 PolarHBondContact O-N 3.48Å; A257-F260 PolarHBondContact O-N 2.84Å; D258-F260 PolarHBondContact O-N 3.06Å; F260-D262 VanDerWaalsContact C-N 3.34Å; F260-D262 PolarHBondContact O-N 2.86Å; F260-V263 PolarHBondContact O-N 3.31Å; F260-L264 HydrophobicContact CB-CD1 4.46Å; F260-L264 WeakPolarHBondContact O-CD1 3.34Å; F260-L264 PolarHBondContact O-N 2.99Å
261	L	91.3	Very high	90.8	Very high	12 Å²	12	57.5 Å²	57.5	6%	0.063	29%	0.285	C	S	.	.	H	α-helix	trans	-59.8	-44.2	178.6	-179.7	61.2	0	0	0	111.2	A257 D258 L264 K265 L365 A368 L369 L372	A257-L261 VanDerWaalsContact O-CB 3.31Å; A257-L261 WeakPolarHBondContact O-CB 3.43Å; A257-L261 PolarHBondContact O-N 3.14Å; D258-L261 WeakPolarHBondContact O-CB 3.4Å; D258-L261 PolarHBondContact O-N 3.08Å; L261-L264 PolarHBondContact O-N 3Å; L261-K265 HydrophobicContact CD1-CG 4.44Å; L261-K265 HydrophobicContact CG-CD 4.25Å; L261-K265 WeakPolarHBondContact O-CB 3.41Å; L261-K265 WeakPolarHBondContact O-CG 3.15Å; L261-K265 PolarHBondContact O-N 2.89Å; L261-L365 HydrophobicContact CD1-CD1 3.5Å; L261-A368 HydrophobicContact CD1-CB 3.82Å; L261-L369 HydrophobicContact CD1-CD2 4.12Å; L261-L369 HydrophobicContact CD1-CG 4.5Å; L261-L369 HydrophobicContact CD2-CD2 4.49Å; L261-L372 HydrophobicContact CD2-CD1 4.28Å
262	D	89.1	Confident	91.2	Very high	37 Å²	37	58.1 Å²	58.1	20%	0.198	28%	0.283	C	S	.	.	H	α-helix	trans	-63.5	-43.3	176.5	-86	-24.3	0	0	0	112.5	R129 Y244 D258 F260 L264 K265 C266	R129-D262 IonicContact CZ-OD1 2.78Å; R129-D262 IonicContact NH1-OD1 2.94Å; R129-D262 PolarHBondContact NH1-OD1 3.41Å; R129-D262 IonicContact NH1-OD2 3.77Å; R129-D262 PolarHBondContact NH1-OD2 3.43Å; R129-D262 IonicContact NH2-OD1 3.37Å; Y244-D262 HydrophobicContact CD1-CB 4.28Å; Y244-D262 HydrophobicContact CE1-CB 3.86Å; D258-D262 PolarHBondContact O-N 3.44Å; F260-D262 VanDerWaalsContact C-N 3.34Å; F260-D262 PolarHBondContact O-N 2.86Å; D262-L264 VanDerWaalsContact C-N 3.31Å; D262-L264 PolarHBondContact O-N 2.84Å; D262-K265 PolarHBondContact O-N 3.08Å; D262-C266 PolarHBondContact O-N 2.76Å
263	V	91.5	Very high	91.4	Very high	22 Å²	22	53.7 Å²	53.7	13%	0.133	27%	0.265	C	S	.	.	H	α-helix	trans	-60.3	-42	173.9	173.1	0	0	0	0	111	E241 Y244 L259 F260 C266 K267	E241-V263 HydrophobicContact CG-CG1 4.22Å; Y244-V263 HydrophobicContact CE2-CG2 3.61Å; Y244-V263 WeakPolarHBondContact OH-CA 3.35Å; Y244-V263 WeakPolarHBondContact OH-CG2 3.44Å; L259-V263 VanDerWaalsContact O-CG2 3.28Å; L259-V263 WeakPolarHBondContact O-CG2 3.39Å; L259-V263 PolarHBondContact O-N 2.98Å; F260-V263 PolarHBondContact O-N 3.31Å; V263-C266 PolarHBondContact O-N 2.74Å; V263-K267 HydrophobicContact CG1-CD 4.09Å; V263-K267 WeakPolarHBondContact O-CG 3.25Å; V263-K267 PolarHBondContact O-N 3.05Å
264	L	93.6	Very high	91.7	Very high	28 Å²	28	46.1 Å²	46.1	15%	0.147	24%	0.236	C	C	.	.	H	α-helix	trans	-66	-46.1	177	-93	95.9	0	0	0	112	F260 L261 D262 C266 K267 V268 M364 L365	F260-L264 HydrophobicContact CB-CD1 4.46Å; F260-L264 WeakPolarHBondContact O-CD1 3.34Å; F260-L264 PolarHBondContact O-N 2.99Å; L261-L264 PolarHBondContact O-N 3Å; D262-L264 VanDerWaalsContact C-N 3.31Å; D262-L264 PolarHBondContact O-N 2.84Å; L264-C266 VanDerWaalsContact C-N 3.29Å; L264-C266 PolarHBondContact O-N 3.14Å; L264-K267 PolarHBondContact O-N 3.16Å; L264-K267 VanDerWaalsContact O-N 3.14Å; L264-V268 WeakPolarHBondContact O-CG2 3.15Å; L264-V268 PolarHBondContact O-N 2.8Å; L264-M364 HydrophobicContact CD2-CB 3.58Å; L264-M364 HydrophobicContact CD2-CG 3.38Å; L264-L365 HydrophobicContact CB-CD1 4.38Å; L264-L365 HydrophobicContact CD2-CB 4.24Å
265	K	93.4	Very high	92	Very high	61 Å²	61	44.6 Å²	44.6	27%	0.265	23%	0.226	S	C	.	.	H	α-helix	trans	-56.1	-44.3	175	-76	174.8	177.5	173.9	0	110.9	L261 D262 R269 L365	L261-K265 HydrophobicContact CD1-CG 4.44Å; L261-K265 HydrophobicContact CG-CD 4.25Å; L261-K265 WeakPolarHBondContact O-CB 3.41Å; L261-K265 WeakPolarHBondContact O-CG 3.15Å; L261-K265 PolarHBondContact O-N 2.89Å; D262-K265 PolarHBondContact O-N 3.08Å; K265-R269 WeakPolarHBondContact O-CB 3.37Å; K265-R269 VanDerWaalsContact O-CG 3.25Å; K265-R269 WeakPolarHBondContact O-CG 3.48Å; K265-R269 PolarHBondContact O-N 3.2Å; K265-R269 VanDerWaalsContact O-N 3.09Å; K265-R269 PolarHBondContact O-NE 2.89Å; K265-L365 HydrophobicContact CG-CD1 3.73Å
266	C	93.5	Very high	92.3	Very high	21 Å²	21	43.2 Å²	43.2	14%	0.142	22%	0.216	C	C	.	.	H	α-helix	trans	-60.3	-49.9	174.1	179.2	0	0	0	0	112	C240 D262 V263 L264 V268 R269 C270	C240-C266 WeakPolarHBondContact CA-SG 3.19Å; C240-C266 HydrophobicContact CB-CB 3.59Å; C240-C266 WeakPolarHBondContact CB-SG 3.48Å; C240-C266 WeakPolarHBondContact SG-CB 3.47Å; C240-C266 CovalentContact SG-SG 2.04Å; C240-C266 PolarHBondContact SG-SG 3.24Å; D262-C266 PolarHBondContact O-N 2.76Å; V263-C266 PolarHBondContact O-N 2.74Å; L264-C266 VanDerWaalsContact C-N 3.29Å; L264-C266 PolarHBondContact O-N 3.14Å; C266-V268 PolarHBondContact O-N 3.39Å; C266-R269 PolarHBondContact O-N 3.13Å; C266-C270 PolarHBondContact O-N 3.19Å
267	K	95.4	Very high	92.5	Very high	36 Å²	36	41 Å²	41	16%	0.157	21%	0.205	C	C	.	.	H	α-helix	trans	-61.7	-41.1	-177.5	-73.8	176.6	179.9	178.6	0	112.5	S237 C240 E241 V263 L264 C270	S237-K267 VanDerWaalsContact O-CE 3.24Å; S237-K267 WeakPolarHBondContact O-CE 3.34Å; C240-K267 HydrophobicContact CB-CG 3.72Å; C240-K267 PolarHBondContact SG-N 2.69Å; C240-K267 VanDerWaalsContact SG-N 3.36Å; E241-K267 IonicContact OE1-NZ 3.72Å; E241-K267 PolarHBondContact OE1-NZ 3.37Å; V263-K267 HydrophobicContact CG1-CD 4.09Å; V263-K267 WeakPolarHBondContact O-CG 3.25Å; V263-K267 PolarHBondContact O-N 3.05Å; L264-K267 PolarHBondContact O-N 3.16Å; L264-K267 VanDerWaalsContact O-N 3.14Å; K267-C270 WeakPolarHBondContact O-CB 3.38Å; K267-C270 PolarHBondContact O-N 2.78Å
268	V	95.5	Very high	92.4	Very high	31 Å²	31	42.2 Å²	42.2	19%	0.188	21%	0.21	C	C	.	.	H	α-helix	trans	-68	-37.8	177.6	172.8	0	0	0	0	111.3	L264 C266 C270 Q361 K362 L365	L264-V268 WeakPolarHBondContact O-CG2 3.15Å; L264-V268 PolarHBondContact O-N 2.8Å; C266-V268 PolarHBondContact O-N 3.39Å; V268-C270 PolarHBondContact O-N 2.97Å; V268-Q361 HydrophobicContact CG2-CB 3.96Å; V268-K362 HydrophobicContact CG1-CG 3.99Å; V268-K362 HydrophobicContact CG2-CG 4.23Å; V268-L365 HydrophobicContact CB-CD2 3.99Å; V268-L365 HydrophobicContact CG1-CD2 4.08Å; V268-L365 HydrophobicContact CG2-CB 4.32Å; V268-L365 HydrophobicContact CG2-CD2 3.86Å
269	R	94.9	Very high	92.1	Very high	74 Å²	74	43 Å²	43	28%	0.279	23%	0.231	S	C	.	.	H	α-helix	trans	-66.6	-17.9	176.9	-76.1	-172.9	-60.5	150.6	3.6	114.2	E136 K265 C266 E271 E272 Q273	E136-R269 IonicContact OE2-NH1 3.78Å; K265-R269 WeakPolarHBondContact O-CB 3.37Å; K265-R269 VanDerWaalsContact O-CG 3.25Å; K265-R269 WeakPolarHBondContact O-CG 3.48Å; K265-R269 PolarHBondContact O-N 3.2Å; K265-R269 VanDerWaalsContact O-N 3.09Å; K265-R269 PolarHBondContact O-NE 2.89Å; C266-R269 PolarHBondContact O-N 3.13Å; R269-E271 VanDerWaalsContact C-N 3.27Å; R269-E271 PolarHBondContact O-N 3.14Å; R269-E272 PolarHBondContact O-N 3.14Å; R269-Q273 WeakPolarHBondContact O-CB 3.41Å; R269-Q273 WeakPolarHBondContact O-CG 3.08Å; R269-Q273 PolarHBondContact O-N 2.83Å
270	C	95.4	Very high	92	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-56.7	-37.3	179.8	-77.8	0	0	0	0	113.6	Y233 C236 S237 C266 K267 V268 L274	Y233-C270 HydrophobicContact CD2-CB 4Å; Y233-C270 HydrophobicContact CE2-CB 3.71Å; C236-C270 HydrophobicContact CB-CB 3.87Å; C236-C270 WeakPolarHBondContact CB-SG 3.07Å; C236-C270 VanDerWaalsContact SG-CA 3.52Å; C236-C270 WeakPolarHBondContact SG-CB 3.36Å; C236-C270 CovalentContact SG-SG 2.05Å; C236-C270 PolarHBondContact SG-SG 3.08Å; S237-C270 PolarHBondContact N-SG 2.62Å; C266-C270 PolarHBondContact O-N 3.19Å; K267-C270 WeakPolarHBondContact O-CB 3.38Å; K267-C270 PolarHBondContact O-N 2.78Å; V268-C270 PolarHBondContact O-N 2.97Å; C270-L274 VanDerWaalsContact O-CB 3.27Å; C270-L274 WeakPolarHBondContact O-CB 3.27Å; C270-L274 WeakPolarHBondContact O-CD1 3.49Å; C270-L274 WeakPolarHBondContact O-CG 3.43Å; C270-L274 PolarHBondContact O-N 3.48Å; C270-L274 VanDerWaalsContact O-N 3.1Å
271	E	93.2	Very high	92	Very high	42 Å²	42	44.6 Å²	44.6	20%	0.196	25%	0.245	C	C	.	.	H	α-helix	trans	-65.1	-47.7	179.5	-176.5	175.3	-163.7	0	0	111.3	Y233 R269 L274 T275 Y354 K362	Y233-E271 HydrophobicContact CE2-CB 4.33Å; R269-E271 VanDerWaalsContact C-N 3.27Å; R269-E271 PolarHBondContact O-N 3.14Å; E271-L274 PolarHBondContact O-N 3.41Å; E271-T275 PolarHBondContact O-N 3.36Å; E271-T275 VanDerWaalsContact O-N 3.16Å; E271-T275 PolarHBondContact O-OG1 3.26Å; E271-Y354 WeakPolarHBondContact CG-OH 3.16Å; E271-K362 IonicContact OE2-NZ 2.78Å; E271-K362 PolarHBondContact OE2-NZ 3.11Å
272	E	92.9	Very high	92.1	Very high	145 Å²	145	48 Å²	48	68%	0.678	26%	0.259	S	S	*	.	H	α-helix	trans	-63.7	-44.6	175.6	-175.1	-172	169	0	0	111.3	R269 L274 T275	R269-E272 PolarHBondContact O-N 3.14Å; E272-L274 PolarHBondContact O-N 3.13Å; E272-T275 PolarHBondContact O-N 3.11Å
273	Q	92.6	Very high	92.2	Very high	52 Å²	52	47.5 Å²	47.5	24%	0.243	26%	0.257	C	S	.	.	H	α-helix	trans	-61.7	-33.8	-178.4	-78.2	-176.4	-12.2	0	0	113.2	E136 K167 R269	E136-Q273 PolarHBondContact OE1-NE2 2.94Å; E136-Q273 VanDerWaalsContact OE1-NE2 3.07Å; E136-Q273 PolarHBondContact OE2-NE2 3.07Å; E136-Q273 VanDerWaalsContact OE2-NE2 3.11Å; K167-Q273 PolarHBondContact NZ-O 3.32Å; R269-Q273 WeakPolarHBondContact O-CB 3.41Å; R269-Q273 WeakPolarHBondContact O-CG 3.08Å; R269-Q273 PolarHBondContact O-N 2.83Å
274	L	95.2	Very high	92.2	Very high	18 Å²	18	54 Å²	54	9%	0.094	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-1.5	-178.8	-66.3	174.8	0	0	0	113.2	Q197 Y199 F229 V232 Y233 C236 C270 E271 E272 P276	Q197-L274 HydrophobicContact CG-CD2 4.27Å; Y199-L274 WeakPolarHBondContact OH-CA 3.48Å; Y199-L274 WeakPolarHBondContact OH-CB 3.21Å; Y199-L274 PolarHBondContact OH-O 2.68Å; F229-L274 HydrophobicContact CE2-CB 4.07Å; V232-L274 HydrophobicContact CG1-CD1 3.97Å; V232-L274 HydrophobicContact CG1-CD2 3.56Å; V232-L274 HydrophobicContact CG1-CG 4.43Å; Y233-L274 HydrophobicContact CD2-CD1 4.31Å; C236-L274 HydrophobicContact CB-CD1 4.1Å; C270-L274 VanDerWaalsContact O-CB 3.27Å; C270-L274 WeakPolarHBondContact O-CB 3.27Å; C270-L274 WeakPolarHBondContact O-CD1 3.49Å; C270-L274 WeakPolarHBondContact O-CG 3.43Å; C270-L274 PolarHBondContact O-N 3.48Å; C270-L274 VanDerWaalsContact O-N 3.1Å; E271-L274 PolarHBondContact O-N 3.41Å; E272-L274 PolarHBondContact O-N 3.13Å; L274-P276 WeakPolarHBondContact O-CD 3.43Å
275	T	94.6	Very high	92.2	Very high	27 Å²	27	57.9 Å²	57.9	17%	0.166	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-71	121.5	176.6	-65.4	0	0	0	0	109.5	E271 E272 F282 V283 F286	E271-T275 PolarHBondContact O-N 3.36Å; E271-T275 VanDerWaalsContact O-N 3.16Å; E271-T275 PolarHBondContact O-OG1 3.26Å; E272-T275 PolarHBondContact O-N 3.11Å; T275-F282 HydrophobicContact CG2-CB 4.22Å; T275-F282 HydrophobicContact CG2-CD1 4.3Å; T275-V283 VanDerWaalsContact CG2-O 3.29Å; T275-V283 WeakPolarHBondContact CG2-O 3.43Å; T275-F286 HydrophobicContact CG2-CB 4.32Å
276	P	93.4	Very high	92.3	Very high	6 Å²	6	55.2 Å²	55.2	4%	0.039	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-75.7	151.1	-176.2	29.9	-33.9	0	0	0	112.2	E200 L274 V283 F286	E200-P276 HydrophobicContact CG-CB 3.98Å; L274-P276 WeakPolarHBondContact O-CD 3.43Å; P276-V283 HydrophobicContact CG-CG2 4.14Å; P276-V283 PolarHBondContact O-N 3.47Å; P276-V283 VanDerWaalsContact O-N 3.11Å; P276-F286 HydrophobicContact CG-CD2 3.9Å; P276-F286 HydrophobicContact CG-CE1 4.14Å; P276-F286 HydrophobicContact CG-CE2 3.47Å; P276-F286 VanDerWaalsContact CG-CE2 3.47Å; P276-F286 HydrophobicContact CG-CG 4.42Å; P276-F286 HydrophobicContact CG-CZ 3.61Å
277	S	91.9	Very high	92.4	Very high	5 Å²	5	54.2 Å²	54.2	4%	0.035	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	120.5	168.9	-179.4	0	0	0	0	111	K166 F281	K166-S277 PolarHBondContact NZ-O 3.22Å; K166-S277 WeakPolarHBondContact O-CB 3.5Å; S277-F281 CarbonylContact C-O 3.53Å; S277-F281 WeakPolarHBondContact CA-O 2.98Å
278	V	87.1	Confident	92.5	Very high	53 Å²	53	52.6 Å²	52.6	32%	0.321	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	119.3	-178.8	-176.1	0	0	0	0	108.7	L204 G280 F281 V283	L204-V278 HydrophobicContact CD2-CB 4.22Å; L204-V278 HydrophobicContact CD2-CG1 3.57Å; L204-V278 HydrophobicContact CD2-CG2 3.59Å; V278-G280 PolarHBondContact O-N 3.47Å; V278-F281 PolarHBondContact N-O 2.9Å; V278-F281 PolarHBondContact O-N 2.85Å; V278-F281 VanDerWaalsContact O-N 3.13Å; V278-V283 HydrophobicContact CB-CG2 4.41Å; V278-V283 HydrophobicContact CG2-CG2 3.74Å
279	G	82.7	Confident	92.5	Very high	72 Å²	72	52.7 Å²	52.7	74%	0.742	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	22.4	-178.9	0	0	0	0	0	114.5
280	G	85	Confident	92.6	Very high	34 Å²	34	49.1 Å²	49.1	35%	0.351	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.6	6.6	-177.4	0	0	0	0	0	114.7	P169 V278	P169-G280 WeakPolarHBondContact CB-O 3.46Å; V278-G280 PolarHBondContact O-N 3.47Å
281	F	89.4	Confident	92.8	Very high	160 Å²	160	49.1 Å²	49.1	70%	0.702	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.4	136.8	177.9	-59.9	-84.4	0	0	0	110.8	S277 V278	S277-F281 CarbonylContact C-O 3.53Å; S277-F281 WeakPolarHBondContact CA-O 2.98Å; V278-F281 PolarHBondContact N-O 2.9Å; V278-F281 PolarHBondContact O-N 2.85Å; V278-F281 VanDerWaalsContact O-N 3.13Å
282	F	92.8	Very high	92.9	Very high	84 Å²	84	49.8 Å²	49.8	37%	0.368	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	137.4	172.3	-71	-70.8	0	0	0	110.5	P169 T275 E284	P169-F282 HydrophobicContact CG-CD2 4.15Å; P169-F282 HydrophobicContact CG-CE2 3.58Å; P169-F282 HydrophobicContact CG-CZ 4.11Å; T275-F282 HydrophobicContact CG2-CB 4.22Å; T275-F282 HydrophobicContact CG2-CD1 4.3Å; F282-E284 PolarHBondContact O-N 3.27Å; F282-E284 VanDerWaalsContact O-N 3.15Å
283	V	92.6	Very high	93.1	Very high	26 Å²	26	45.2 Å²	45.2	16%	0.158	24%	0.244	C	C	.	.			trans	-72.4	110.4	177.4	-175.7	0	0	0	0	109.5	F203 T275 P276 V278 F286 T289	F203-V283 HydrophobicContact CE1-CG2 4.28Å; F203-V283 HydrophobicContact CZ-CG1 4.48Å; T275-V283 VanDerWaalsContact CG2-O 3.29Å; T275-V283 WeakPolarHBondContact CG2-O 3.43Å; P276-V283 HydrophobicContact CG-CG2 4.14Å; P276-V283 PolarHBondContact O-N 3.47Å; P276-V283 VanDerWaalsContact O-N 3.11Å; V278-V283 HydrophobicContact CB-CG2 4.41Å; V278-V283 HydrophobicContact CG2-CG2 3.74Å; V283-F286 HydrophobicContact CB-CD2 3.91Å; V283-F286 HydrophobicContact CG1-CD2 3.81Å; V283-F286 HydrophobicContact CG2-CD2 4.5Å; V283-T289 HydrophobicContact CG1-CG2 3.97Å
284	E	91.3	Very high	93.3	Very high	159 Å²	159	42.7 Å²	42.7	74%	0.743	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	141.5	175.9	-65.7	-174.2	-174.8	0	0	111.6	F282 F286 T289	F282-E284 PolarHBondContact O-N 3.27Å; F282-E284 VanDerWaalsContact O-N 3.15Å; E284-F286 PolarHBondContact O-N 3.36Å; E284-T289 PolarHBondContact O-OG1 3.01Å
285	K	92.8	Very high	93.4	Very high	109 Å²	109	42 Å²	42	47%	0.474	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.1	48.5	177.4	-52.3	-176.6	-169.6	-178.8	0	111.6	V287 A288 T289 D318	K285-V287 VanDerWaalsContact C-N 3.3Å; K285-V287 PolarHBondContact O-N 2.81Å; K285-V287 VanDerWaalsContact O-N 3.08Å; K285-A288 HydrophobicContact CB-CB 3.96Å; K285-A288 WeakPolarHBondContact O-CA 2.89Å; K285-A288 VanDerWaalsContact O-CB 3.28Å; K285-A288 WeakPolarHBondContact O-CB 3.44Å; K285-A288 PolarHBondContact O-N 2.98Å; K285-T289 PolarHBondContact O-N 3.37Å; K285-T289 PolarHBondContact O-OG1 3.39Å; K285-D318 HydrophobicContact CD-CB 4.03Å; K285-D318 WeakPolarHBondContact CD-OD2 3.02Å; K285-D318 IonicContact NZ-OD1 3.24Å; K285-D318 PolarHBondContact NZ-OD1 3.42Å; K285-D318 IonicContact NZ-OD2 2.6Å; K285-D318 PolarHBondContact NZ-OD2 2.93Å
286	F	95.6	Very high	93.4	Very high	5 Å²	5	43.4 Å²	43.4	2%	0.022	23%	0.233	C	C	.	.	H	α-helix	trans	-47.8	-45.9	-165.3	-178.3	-129.5	0	0	0	114.6	Y199 F203 F229 T275 P276 V283 E284 T289 M290	Y199-F286 AromaticContact CD2-CE1 3.93Å; Y199-F286 HydrophobicContact CD2-CE1 3.93Å; Y199-F286 AromaticContact CD2-CZ 3.85Å; Y199-F286 HydrophobicContact CD2-CZ 3.85Å; Y199-F286 AromaticContact CE2-CE1 3.61Å; Y199-F286 HydrophobicContact CE2-CE1 3.61Å; Y199-F286 AromaticContact CE2-CZ 3.83Å; Y199-F286 HydrophobicContact CE2-CZ 3.83Å; F203-F286 AromaticContact CD1-CE2 3.98Å; F203-F286 HydrophobicContact CD1-CE2 3.98Å; F203-F286 AromaticContact CD2-CE2 3.89Å; F203-F286 HydrophobicContact CD2-CE2 3.89Å; F203-F286 HydrophobicContact CD2-CZ 4.34Å; F203-F286 AromaticContact CE1-CE2 3.9Å; F203-F286 HydrophobicContact CE1-CE2 3.9Å; F203-F286 AromaticContact CE2-CE2 3.81Å; F203-F286 HydrophobicContact CE2-CE2 3.81Å; F203-F286 AromaticContact CG-CE2 3.98Å; F203-F286 HydrophobicContact CG-CE2 3.98Å; F203-F286 HydrophobicContact CG-CZ 4.27Å; F203-F286 HydrophobicContact CZ-CD2 4.39Å; F203-F286 AromaticContact CZ-CE2 3.81Å; F203-F286 HydrophobicContact CZ-CE2 3.81Å; F229-F286 HydrophobicContact CD2-CD1 4.05Å; F229-F286 AromaticContact CD2-CE1 3.57Å; F229-F286 HydrophobicContact CD2-CE1 3.57Å; F229-F286 AromaticContact CE2-CD1 3.75Å; F229-F286 HydrophobicContact CE2-CD1 3.75Å; F229-F286 AromaticContact CE2-CE1 3.75Å; F229-F286 HydrophobicContact CE2-CE1 3.75Å; F229-F286 HydrophobicContact CG-CE1 4.21Å; F229-F286 HydrophobicContact CZ-CD1 4.23Å; T275-F286 HydrophobicContact CG2-CB 4.32Å; P276-F286 HydrophobicContact CG-CD2 3.9Å; P276-F286 HydrophobicContact CG-CE1 4.14Å; P276-F286 HydrophobicContact CG-CE2 3.47Å; P276-F286 VanDerWaalsContact CG-CE2 3.47Å; P276-F286 HydrophobicContact CG-CG 4.42Å; P276-F286 HydrophobicContact CG-CZ 3.61Å; V283-F286 HydrophobicContact CB-CD2 3.91Å; V283-F286 HydrophobicContact CG1-CD2 3.81Å; V283-F286 HydrophobicContact CG2-CD2 4.5Å; E284-F286 PolarHBondContact O-N 3.36Å; F286-T289 WeakPolarHBondContact O-CB 2.99Å; F286-T289 PolarHBondContact O-N 2.73Å; F286-M290 HydrophobicContact CD1-CE 4.12Å; F286-M290 HydrophobicContact CE1-CE 3.92Å; F286-M290 HydrophobicContact CE1-SD 4.23Å; F286-M290 HydrophobicContact CE2-CG 4.25Å; F286-M290 HydrophobicContact CE2-SD 4.42Å; F286-M290 HydrophobicContact CZ-CE 4.25Å; F286-M290 HydrophobicContact CZ-CG 4.4Å; F286-M290 HydrophobicContact CZ-SD 3.98Å; F286-M290 PolarHBondContact O-N 3.41Å
287	V	96.6	Very high	93.6	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.006	23%	0.231	C	C	.	.	H	α-helix	trans	-65.6	-42.1	178.4	-174.1	0	0	0	0	112.2	F229 F230 K285 T289 M290 Y291 F317 Y354	F229-V287 HydrophobicContact CD1-CG2 4.22Å; F229-V287 HydrophobicContact CE1-CG2 3.39Å; F229-V287 HydrophobicContact CZ-CG2 3.79Å; F230-V287 HydrophobicContact CE1-CG1 4.11Å; F230-V287 HydrophobicContact CZ-CG1 4.13Å; K285-V287 VanDerWaalsContact C-N 3.3Å; K285-V287 PolarHBondContact O-N 2.81Å; K285-V287 VanDerWaalsContact O-N 3.08Å; V287-T289 VanDerWaalsContact C-N 3.33Å; V287-M290 HydrophobicContact CB-CE 4.38Å; V287-M290 HydrophobicContact CG1-CE 4.5Å; V287-M290 HydrophobicContact CG2-CE 4.23Å; V287-M290 PolarHBondContact O-N 2.95Å; V287-Y291 HydrophobicContact CG1-CD2 4.16Å; V287-Y291 HydrophobicContact CG1-CE2 3.94Å; V287-Y291 VanDerWaalsContact O-CD2 3.29Å; V287-Y291 WeakPolarHBondContact O-CD2 3.34Å; V287-Y291 PolarHBondContact O-N 3.44Å; V287-F317 HydrophobicContact CB-CE2 4.45Å; V287-F317 HydrophobicContact CB-CZ 4.49Å; V287-F317 HydrophobicContact CG1-CD2 4.06Å; V287-F317 HydrophobicContact CG1-CE1 4.15Å; V287-F317 HydrophobicContact CG1-CE2 3.57Å; V287-F317 HydrophobicContact CG1-CZ 3.63Å; V287-Y354 HydrophobicContact CB-CE1 4.4Å; V287-Y354 HydrophobicContact CG1-CD1 4.38Å; V287-Y354 HydrophobicContact CG1-CE1 4.27Å; V287-Y354 HydrophobicContact CG2-CE1 3.78Å
288	A	96.4	Very high	93.9	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.008	24%	0.235	C	C	.	.	H	α-helix	trans	-60.5	-46.4	173.9	0	0	0	0	0	110.2	K285 M290 Y291 H292 Y314 F317	K285-A288 HydrophobicContact CB-CB 3.96Å; K285-A288 WeakPolarHBondContact O-CA 2.89Å; K285-A288 VanDerWaalsContact O-CB 3.28Å; K285-A288 WeakPolarHBondContact O-CB 3.44Å; K285-A288 PolarHBondContact O-N 2.98Å; A288-M290 VanDerWaalsContact C-N 3.32Å; A288-M290 PolarHBondContact O-N 2.87Å; A288-Y291 CarbonylContact O-C 3.59Å; A288-Y291 PolarHBondContact O-N 3.35Å; A288-H292 PolarHBondContact O-N 3.17Å; A288-Y314 HydrophobicContact CB-CD2 3.89Å; A288-Y314 HydrophobicContact CB-CE2 3.72Å; A288-Y314 HydrophobicContact CB-CG 4.46Å; A288-Y314 WeakPolarHBondContact O-CD2 3.34Å; A288-Y314 WeakPolarHBondContact O-CE2 3.47Å; A288-F317 HydrophobicContact CB-CB 3.8Å
289	T	96.3	Very high	94.3	Very high	33 Å²	33	45.5 Å²	45.5	20%	0.202	23%	0.234	C	C	.	.	H	α-helix	trans	-56.7	-41.8	178.5	-64.8	0	0	0	0	112.3	F203 V283 E284 K285 F286 V287 Y291 H292 Y293	F203-T289 HydrophobicContact CZ-CG2 4.42Å; V283-T289 HydrophobicContact CG1-CG2 3.97Å; E284-T289 PolarHBondContact O-OG1 3.01Å; K285-T289 PolarHBondContact O-N 3.37Å; K285-T289 PolarHBondContact O-OG1 3.39Å; F286-T289 WeakPolarHBondContact O-CB 2.99Å; F286-T289 PolarHBondContact O-N 2.73Å; V287-T289 VanDerWaalsContact C-N 3.33Å; T289-Y291 PolarHBondContact O-N 3Å; T289-H292 WeakPolarHBondContact O-CB 3.19Å; T289-H292 PolarHBondContact O-N 3.38Å; T289-Y293 HydrophobicContact CG2-CD2 3.91Å; T289-Y293 HydrophobicContact CG2-CE2 3.56Å; T289-Y293 WeakPolarHBondContact O-CD2 3.37Å; T289-Y293 PolarHBondContact O-N 3.22Å; T289-Y293 VanDerWaalsContact O-N 3.15Å
290	M	97.6	Very high	94.9	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.4	-44.3	173.6	-69.2	-171.1	-75.7	0	0	112.4	F203 M222 I226 F229 F286 V287 A288 H292 Y293 L294	F203-M290 HydrophobicContact CD2-CG 3.89Å; F203-M290 HydrophobicContact CE2-CG 3.93Å; M222-M290 WeakPolarHBondContact CG-O 3.12Å; M222-M290 HydrophobicContact SD-CB 3.78Å; M222-M290 HydrophobicContact SD-CG 3.79Å; I226-M290 HydrophobicContact CD1-CB 4.03Å; I226-M290 HydrophobicContact CG1-CB 3.73Å; I226-M290 HydrophobicContact CG1-CE 4.34Å; I226-M290 HydrophobicContact CG1-CG 4.32Å; I226-M290 HydrophobicContact CG1-SD 3.76Å; F229-M290 HydrophobicContact CB-CE 4.12Å; F229-M290 HydrophobicContact CD1-CE 3.75Å; F229-M290 HydrophobicContact CE1-CE 4.34Å; F229-M290 HydrophobicContact CG-CE 3.87Å; F286-M290 HydrophobicContact CD1-CE 4.12Å; F286-M290 HydrophobicContact CE1-CE 3.92Å; F286-M290 HydrophobicContact CE1-SD 4.23Å; F286-M290 HydrophobicContact CE2-CG 4.25Å; F286-M290 HydrophobicContact CE2-SD 4.42Å; F286-M290 HydrophobicContact CZ-CE 4.25Å; F286-M290 HydrophobicContact CZ-CG 4.4Å; F286-M290 HydrophobicContact CZ-SD 3.98Å; F286-M290 PolarHBondContact O-N 3.41Å; V287-M290 HydrophobicContact CB-CE 4.38Å; V287-M290 HydrophobicContact CG1-CE 4.5Å; V287-M290 HydrophobicContact CG2-CE 4.23Å; V287-M290 PolarHBondContact O-N 2.95Å; A288-M290 VanDerWaalsContact C-N 3.32Å; A288-M290 PolarHBondContact O-N 2.87Å; M290-H292 VanDerWaalsContact C-N 3.33Å; M290-H292 PolarHBondContact O-N 3.34Å; M290-Y293 PolarHBondContact O-N 2.99Å; M290-L294 WeakPolarHBondContact O-CB 3.26Å; M290-L294 PolarHBondContact O-N 3.17Å
291	Y	98.2	Very high	95.5	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-68.1	-30.3	176.7	-78.1	-65.2	0	0	0	113.3	I226 F230 V287 A288 T289 L294 Q295 C310 F317 A351	I226-Y291 HydrophobicContact CD1-CD1 4.27Å; I226-Y291 HydrophobicContact CD1-CE1 4.01Å; F230-Y291 HydrophobicContact CZ-CE2 4.36Å; V287-Y291 HydrophobicContact CG1-CD2 4.16Å; V287-Y291 HydrophobicContact CG1-CE2 3.94Å; V287-Y291 VanDerWaalsContact O-CD2 3.29Å; V287-Y291 WeakPolarHBondContact O-CD2 3.34Å; V287-Y291 PolarHBondContact O-N 3.44Å; A288-Y291 CarbonylContact O-C 3.59Å; A288-Y291 PolarHBondContact O-N 3.35Å; T289-Y291 PolarHBondContact O-N 3Å; Y291-L294 HydrophobicContact CD1-CD2 4.41Å; Y291-Q295 WeakPolarHBondContact O-CB 3.03Å; Y291-Q295 PolarHBondContact O-N 3.33Å; Y291-C310 HydrophobicContact CD1-CB 4.3Å; Y291-F317 HydrophobicContact CD2-CD2 4.44Å; Y291-F317 HydrophobicContact CD2-CE2 4.01Å; Y291-F317 AromaticContact CE2-CE2 3.98Å; Y291-F317 HydrophobicContact CE2-CE2 3.98Å; Y291-A351 HydrophobicContact CE2-CB 3.76Å; Y291-A351 WeakPolarHBondContact OH-CB 3.35Å
292	H	96.4	Very high	95.8	Very high	56 Å²	56	47 Å²	47	26%	0.259	22%	0.219	S	C	.	.	H	α-helix	trans	-61.9	-54.4	173	176.3	90.3	0	0	0	111.4	A288 T289 M290 L294 Q295 F296 Y314 M324	A288-H292 PolarHBondContact O-N 3.17Å; T289-H292 WeakPolarHBondContact O-CB 3.19Å; T289-H292 PolarHBondContact O-N 3.38Å; M290-H292 VanDerWaalsContact C-N 3.33Å; M290-H292 PolarHBondContact O-N 3.34Å; H292-L294 VanDerWaalsContact C-N 3.27Å; H292-L294 PolarHBondContact O-N 3.49Å; H292-Q295 PolarHBondContact O-N 2.98Å; H292-F296 PolarHBondContact O-N 3.15Å; H292-Y314 HydrophobicContact CB-CD2 3.87Å; H292-Y314 HydrophobicContact CB-CE2 3.85Å; H292-M324 HydrophobicContact CB-CE 4.46Å
293	Y	96.2	Very high	96	Very high	48 Å²	48	45.6 Å²	45.6	19%	0.188	22%	0.215	C	C	.	.	H	α-helix	trans	-58.9	-41.5	178	-77.8	-66	0	0	0	111.9	F203 V207 Y210 M222 T289 M290 S297	F203-Y293 HydrophobicContact CE2-CD2 4.42Å; V207-Y293 HydrophobicContact CG1-CE1 4.23Å; V207-Y293 HydrophobicContact CG2-CD2 4.06Å; V207-Y293 HydrophobicContact CG2-CE1 4.31Å; V207-Y293 HydrophobicContact CG2-CE2 3.68Å; Y210-Y293 AromaticContact CD1-CD1 3.75Å; Y210-Y293 HydrophobicContact CD1-CD1 3.75Å; Y210-Y293 AromaticContact CD1-CE1 3.62Å; Y210-Y293 HydrophobicContact CD1-CE1 3.62Å; Y210-Y293 AromaticContact CD2-CD1 3.75Å; Y210-Y293 HydrophobicContact CD2-CD1 3.75Å; Y210-Y293 HydrophobicContact CD2-CE1 4.47Å; Y210-Y293 AromaticContact CE1-CD1 3.97Å; Y210-Y293 HydrophobicContact CE1-CD1 3.97Å; Y210-Y293 AromaticContact CE1-CE1 3.84Å; Y210-Y293 HydrophobicContact CE1-CE1 3.84Å; Y210-Y293 AromaticContact CE2-CD1 3.93Å; Y210-Y293 HydrophobicContact CE2-CD1 3.93Å; Y210-Y293 AromaticContact CG-CD1 3.63Å; Y210-Y293 HydrophobicContact CG-CD1 3.63Å; Y210-Y293 AromaticContact CG-CE1 3.97Å; Y210-Y293 HydrophobicContact CG-CE1 3.97Å; M222-Y293 HydrophobicContact CE-CD2 3.83Å; M222-Y293 HydrophobicContact CE-CG 3.87Å; T289-Y293 HydrophobicContact CG2-CD2 3.91Å; T289-Y293 HydrophobicContact CG2-CE2 3.56Å; T289-Y293 WeakPolarHBondContact O-CD2 3.37Å; T289-Y293 PolarHBondContact O-N 3.22Å; T289-Y293 VanDerWaalsContact O-N 3.15Å; M290-Y293 PolarHBondContact O-N 2.99Å; Y293-S297 VanDerWaalsContact O-CB 3.28Å; Y293-S297 WeakPolarHBondContact O-CB 3.49Å; Y293-S297 PolarHBondContact O-N 3.1Å; Y293-S297 PolarHBondContact O-OG 3.35Å
294	L	97.3	Very high	96.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-67	-45.8	179.5	-171.6	62	0	0	0	112.1	A219 M222 E223 I226 M290 Y291 H292 F296 S297 Y298 C310	A219-L294 HydrophobicContact CB-CD1 4.2Å; M222-L294 HydrophobicContact CB-CB 4.5Å; M222-L294 HydrophobicContact CB-CD1 4.12Å; M222-L294 HydrophobicContact CG-CB 3.96Å; M222-L294 HydrophobicContact CG-CD1 4.44Å; E223-L294 HydrophobicContact CG-CD1 3.82Å; E223-L294 HydrophobicContact CG-CD2 4.43Å; E223-L294 WeakPolarHBondContact OE1-CD2 3.3Å; I226-L294 HydrophobicContact CD1-CD2 3.69Å; M290-L294 WeakPolarHBondContact O-CB 3.26Å; M290-L294 PolarHBondContact O-N 3.17Å; Y291-L294 HydrophobicContact CD1-CD2 4.41Å; H292-L294 VanDerWaalsContact C-N 3.27Å; H292-L294 PolarHBondContact O-N 3.49Å; L294-F296 PolarHBondContact O-N 2.97Å; L294-S297 PolarHBondContact O-N 2.84Å; L294-Y298 HydrophobicContact CD1-CD2 3.89Å; L294-Y298 HydrophobicContact CD1-CE2 3.34Å; L294-Y298 HydrophobicContact CD2-CE2 4.24Å; L294-Y298 HydrophobicContact CG-CD2 3.87Å; L294-Y298 HydrophobicContact CG-CE2 3.6Å; L294-Y298 VanDerWaalsContact O-CD2 3.23Å; L294-Y298 WeakPolarHBondContact O-CD2 3.4Å; L294-Y298 PolarHBondContact O-N 2.96Å; L294-C310 VanDerWaalsContact CD2-SG 3.57Å
295	Q	96.9	Very high	96.3	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.009	20%	0.196	C	C	.	.	H	α-helix	trans	-56.3	-48.9	176.1	177.2	-87	-77.8	0	0	111.4	Y291 H292 Y299 A307 C310 A311 M324 N327 Y331	Y291-Q295 WeakPolarHBondContact O-CB 3.03Å; Y291-Q295 PolarHBondContact O-N 3.33Å; H292-Q295 PolarHBondContact O-N 2.98Å; Q295-Y299 WeakPolarHBondContact O-CB 3.46Å; Q295-Y299 PolarHBondContact O-N 2.97Å; Q295-A307 WeakPolarHBondContact CG-O 3.44Å; Q295-A307 WeakPolarHBondContact O-CB 3.39Å; Q295-C310 HydrophobicContact CB-CB 3.64Å; Q295-C310 HydrophobicContact CG-CB 4.37Å; Q295-A311 HydrophobicContact CG-CB 3.88Å; Q295-M324 HydrophobicContact CG-SD 4.47Å; Q295-N327 PolarHBondContact OE1-ND2 2.95Å; Q295-Y331 HydrophobicContact CG-CE2 4.41Å; Q295-Y331 PolarHBondContact NE2-OH 3.48Å
296	F	94.8	Very high	96.5	Very high	58 Å²	58	40.1 Å²	40.1	25%	0.254	19%	0.19	S	C	.	.	H	α-helix	trans	-71.1	-38.7	-177.5	-173.6	-80.8	0	0	0	111.8	Y210 F215 H292 L294 Y298 Y299 K300	Y210-F296 HydrophobicContact CD2-CD1 4.4Å; Y210-F296 HydrophobicContact CE2-CB 3.9Å; Y210-F296 AromaticContact CE2-CD1 3.26Å; Y210-F296 HydrophobicContact CE2-CD1 3.26Å; Y210-F296 AromaticContact CE2-CE1 3.94Å; Y210-F296 HydrophobicContact CE2-CE1 3.94Å; Y210-F296 AromaticContact CE2-CG 3.86Å; Y210-F296 HydrophobicContact CE2-CG 3.86Å; Y210-F296 AromaticContact CZ-CD1 3.48Å; Y210-F296 VanDerWaalsContact CZ-CD1 3.48Å; Y210-F296 AromaticContact CZ-CE1 3.79Å; Y210-F296 AromaticContact CZ-CG 3.96Å; Y210-F296 WeakPolarHBondContact OH-CD1 3.4Å; Y210-F296 VanDerWaalsContact OH-CE1 3.31Å; Y210-F296 WeakPolarHBondContact OH-CE1 3.34Å; Y210-F296 WeakPolarHBondContact OH-CG 3.27Å; F215-F296 HydrophobicContact CE1-CD1 4.07Å; F215-F296 AromaticContact CE1-CE1 3.83Å; F215-F296 HydrophobicContact CE1-CE1 3.83Å; F215-F296 HydrophobicContact CZ-CE1 4.17Å; H292-F296 PolarHBondContact O-N 3.15Å; L294-F296 PolarHBondContact O-N 2.97Å; F296-Y298 PolarHBondContact O-N 3.28Å; F296-Y299 WeakPolarHBondContact O-CB 3.45Å; F296-Y299 PolarHBondContact O-N 3.45Å; F296-K300 HydrophobicContact CD1-CG 3.66Å; F296-K300 HydrophobicContact CE1-CD 3.97Å; F296-K300 HydrophobicContact CE1-CG 3.46Å; F296-K300 VanDerWaalsContact CE1-CG 3.46Å; F296-K300 HydrophobicContact CZ-CD 4.26Å; F296-K300 HydrophobicContact CZ-CG 4.18Å; F296-K300 WeakPolarHBondContact O-CG 3.38Å; F296-K300 PolarHBondContact O-N 3.26Å
297	S	96.9	Very high	96.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58.6	-48.1	175.7	-61.1	0	0	0	0	111.3	Y293 L294 Y299 K300 L301	Y293-S297 VanDerWaalsContact O-CB 3.28Å; Y293-S297 WeakPolarHBondContact O-CB 3.49Å; Y293-S297 PolarHBondContact O-N 3.1Å; Y293-S297 PolarHBondContact O-OG 3.35Å; L294-S297 PolarHBondContact O-N 2.84Å; S297-Y299 PolarHBondContact O-N 3.35Å; S297-K300 PolarHBondContact O-N 2.57Å; S297-L301 VanDerWaalsContact O-CG 3.31Å; S297-L301 WeakPolarHBondContact O-CG 3.49Å; S297-L301 PolarHBondContact O-N 3.48Å; S297-L301 VanDerWaalsContact O-N 3.12Å
298	Y	98.2	Very high	96.6	Very high	31 Å²	31	39.9 Å²	39.9	12%	0.122	19%	0.189	C	C	.	.	H	α-helix	trans	-62.6	-40.5	175.8	-80	-53.6	0	0	0	113.3	A219 E223 L294 F296 K300 L301 N302 D303 N306 R348	A219-Y298 HydrophobicContact CB-CE1 4.36Å; E223-Y298 WeakPolarHBondContact OE1-CE2 3.37Å; E223-Y298 PolarHBondContact OE1-OH 2.62Å; L294-Y298 HydrophobicContact CD1-CD2 3.89Å; L294-Y298 HydrophobicContact CD1-CE2 3.34Å; L294-Y298 HydrophobicContact CD2-CE2 4.24Å; L294-Y298 HydrophobicContact CG-CD2 3.87Å; L294-Y298 HydrophobicContact CG-CE2 3.6Å; L294-Y298 VanDerWaalsContact O-CD2 3.23Å; L294-Y298 WeakPolarHBondContact O-CD2 3.4Å; L294-Y298 PolarHBondContact O-N 2.96Å; F296-Y298 PolarHBondContact O-N 3.28Å; Y298-K300 VanDerWaalsContact C-N 3.33Å; Y298-K300 PolarHBondContact O-N 2.91Å; Y298-L301 CarbonylContact O-C 3.38Å; Y298-L301 PolarHBondContact O-N 2.94Å; Y298-L301 VanDerWaalsContact O-N 3.16Å; Y298-N302 PolarHBondContact O-N 3.33Å; Y298-D303 HydrophobicContact CD1-CB 3.98Å; Y298-D303 PolarHBondContact O-N 3.28Å; Y298-N306 HydrophobicContact CD1-CB 3.72Å; Y298-N306 HydrophobicContact CD2-CB 3.68Å; Y298-N306 HydrophobicContact CE1-CB 3.85Å; Y298-N306 HydrophobicContact CE2-CB 3.8Å; Y298-N306 HydrophobicContact CG-CB 3.65Å; Y298-R348 VanDerWaalsContact CE2-NH2 3.35Å
299	Y	96.3	Very high	96.7	Very high	77 Å²	77	40.7 Å²	40.7	30%	0.302	19%	0.194	S	C	.	.	H	α-helix	trans	-58.6	-45	175.1	172.8	-104.1	0	0	0	112.1	Q295 F296 S297 L301 N302 V304 Y330 Y331	Q295-Y299 WeakPolarHBondContact O-CB 3.46Å; Q295-Y299 PolarHBondContact O-N 2.97Å; F296-Y299 WeakPolarHBondContact O-CB 3.45Å; F296-Y299 PolarHBondContact O-N 3.45Å; S297-Y299 PolarHBondContact O-N 3.35Å; Y299-L301 PolarHBondContact O-N 3.46Å; Y299-N302 PolarHBondContact O-N 3.01Å; Y299-V304 HydrophobicContact CD2-CG2 4.24Å; Y299-Y330 AromaticContact CE2-CE1 3.97Å; Y299-Y330 HydrophobicContact CE2-CE1 3.97Å; Y299-Y331 AromaticContact CD2-CE1 3.91Å; Y299-Y331 HydrophobicContact CD2-CE1 3.91Å; Y299-Y331 HydrophobicContact CE2-CE1 4.41Å
300	K	96.2	Very high	96.7	Very high	106 Å²	106	39.1 Å²	39.1	46%	0.461	18%	0.184	S	C	.	.	H	α-helix	trans	-66.4	-25.3	177.8	-69.8	-65.9	-176.4	-177.3	0	113.6	F215 F296 S297 Y298 N302	F215-K300 HydrophobicContact CB-CB 4.19Å; F215-K300 HydrophobicContact CD1-CB 4.02Å; F215-K300 HydrophobicContact CD1-CG 4.1Å; F215-K300 HydrophobicContact CD2-CB 3.42Å; F215-K300 VanDerWaalsContact CD2-CB 3.42Å; F215-K300 HydrophobicContact CD2-CG 3.98Å; F215-K300 HydrophobicContact CE1-CB 4.3Å; F215-K300 HydrophobicContact CE1-CG 3.92Å; F215-K300 HydrophobicContact CE2-CB 3.72Å; F215-K300 HydrophobicContact CE2-CD 4.19Å; F215-K300 HydrophobicContact CE2-CG 3.78Å; F215-K300 HydrophobicContact CG-CB 3.59Å; F215-K300 HydrophobicContact CG-CG 4.14Å; F215-K300 HydrophobicContact CZ-CB 4.16Å; F215-K300 HydrophobicContact CZ-CD 4.26Å; F215-K300 HydrophobicContact CZ-CG 3.75Å; F296-K300 HydrophobicContact CD1-CG 3.66Å; F296-K300 HydrophobicContact CE1-CD 3.97Å; F296-K300 HydrophobicContact CE1-CG 3.46Å; F296-K300 VanDerWaalsContact CE1-CG 3.46Å; F296-K300 HydrophobicContact CZ-CD 4.26Å; F296-K300 HydrophobicContact CZ-CG 4.18Å; F296-K300 WeakPolarHBondContact O-CG 3.38Å; F296-K300 PolarHBondContact O-N 3.26Å; S297-K300 PolarHBondContact O-N 2.57Å; Y298-K300 VanDerWaalsContact C-N 3.33Å; Y298-K300 PolarHBondContact O-N 2.91Å; K300-N302 PolarHBondContact O-N 3.41Å
301	L	96.8	Very high	96.7	Very high	76 Å²	76	39.1 Å²	39.1	40%	0.398	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	5.7	172.1	-62.1	172	0	0	0	113.3	F215 S297 Y298 Y299 D303	F215-L301 HydrophobicContact CB-CD1 4.46Å; F215-L301 HydrophobicContact CB-CD2 4.05Å; F215-L301 HydrophobicContact CB-CG 4Å; S297-L301 VanDerWaalsContact O-CG 3.31Å; S297-L301 WeakPolarHBondContact O-CG 3.49Å; S297-L301 PolarHBondContact O-N 3.48Å; S297-L301 VanDerWaalsContact O-N 3.12Å; Y298-L301 CarbonylContact O-C 3.38Å; Y298-L301 PolarHBondContact O-N 2.94Å; Y298-L301 VanDerWaalsContact O-N 3.16Å; Y299-L301 PolarHBondContact O-N 3.46Å; L301-D303 PolarHBondContact O-N 3.23Å
302	N	95.3	Very high	96.7	Very high	116 Å²	116	39.7 Å²	39.7	62%	0.62	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.8	21.7	-175.9	-158.5	69.6	0	0	0	113.2	Y298 Y299 K300 V304 W338	Y298-N302 PolarHBondContact O-N 3.33Å; Y299-N302 PolarHBondContact O-N 3.01Å; K300-N302 PolarHBondContact O-N 3.41Å; N302-V304 PolarHBondContact O-N 3.49Å; N302-W338 WeakPolarHBondContact OD1-CH2 3.48Å; N302-W338 WeakPolarHBondContact OD1-CZ3 2.96Å
303	D	96.4	Very high	96.8	Very high	53 Å²	53	37 Å²	37	28%	0.283	18%	0.176	S	C	.	.			trans	-100.1	66.5	179.7	-171.9	-2.2	0	0	0	110.5	Y298 L301 K305 N306 A307	Y298-D303 HydrophobicContact CD1-CB 3.98Å; Y298-D303 PolarHBondContact O-N 3.28Å; L301-D303 PolarHBondContact O-N 3.23Å; D303-K305 PolarHBondContact O-N 3.43Å; D303-N306 VanDerWaalsContact CG-ND2 3.32Å; D303-N306 PolarHBondContact O-N 2.95Å; D303-N306 PolarHBondContact OD1-N 3.48Å; D303-N306 PolarHBondContact OD1-ND2 2.92Å; D303-N306 PolarHBondContact OD2-ND2 2.94Å; D303-A307 PolarHBondContact O-N 3.32Å
304	V	95.8	Very high	96.9	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.018	17%	0.171	C	C	.	.	H	α-helix	trans	-69.3	-21.3	-174.9	178.7	0	0	0	0	112.5	Y299 N302 N306 A307 A308 Y331 W338 L340	Y299-V304 HydrophobicContact CD2-CG2 4.24Å; N302-V304 PolarHBondContact O-N 3.49Å; V304-N306 VanDerWaalsContact C-N 3.29Å; V304-N306 PolarHBondContact O-N 3.41Å; V304-A307 PolarHBondContact O-N 3.12Å; V304-A308 PolarHBondContact O-N 3.34Å; V304-Y331 HydrophobicContact CG1-CD1 3.5Å; V304-Y331 HydrophobicContact CG1-CE1 3.78Å; V304-Y331 HydrophobicContact CG1-CG 4.32Å; V304-Y331 HydrophobicContact CG2-CE1 4.38Å; V304-W338 HydrophobicContact CB-CD2 4.01Å; V304-W338 HydrophobicContact CB-CE3 3.55Å; V304-W338 HydrophobicContact CB-CG 4.46Å; V304-W338 HydrophobicContact CB-CZ3 3.97Å; V304-W338 HydrophobicContact CG1-CB 4.48Å; V304-W338 HydrophobicContact CG1-CD2 4.35Å; V304-W338 HydrophobicContact CG1-CE3 4.37Å; V304-W338 HydrophobicContact CG1-CG 4.41Å; V304-W338 HydrophobicContact CG2-CD2 3.73Å; V304-W338 HydrophobicContact CG2-CE3 3.23Å; V304-W338 HydrophobicContact CG2-CH2 3.6Å; V304-W338 HydrophobicContact CG2-CZ2 4.11Å; V304-W338 HydrophobicContact CG2-CZ3 3.16Å; V304-L340 HydrophobicContact CG1-CD1 3.79Å; V304-L340 HydrophobicContact CG1-CD2 4.17Å; V304-L340 HydrophobicContact CG1-CG 4.41Å
305	K	95.7	Very high	96.9	Very high	113 Å²	113	37.6 Å²	37.6	49%	0.491	18%	0.181	S	C	.	.	H	α-helix	trans	-62.9	-35.7	173.4	-77.1	-166.5	172.9	-171.5	0	112.6	D303 P309 L340	D303-K305 PolarHBondContact O-N 3.43Å; K305-P309 WeakPolarHBondContact O-CD 3.14Å; K305-P309 VanDerWaalsContact O-CG 3.31Å; K305-P309 WeakPolarHBondContact O-CG 3.36Å; K305-L340 HydrophobicContact CG-CD2 4Å
306	N	96.5	Very high	96.9	Very high	64 Å²	64	39 Å²	39	34%	0.342	19%	0.188	S	C	.	.	H	α-helix	trans	-87.9	-26.3	173	-72.8	-49.6	0	0	0	112.5	Y298 D303 V304 C310	Y298-N306 HydrophobicContact CD1-CB 3.72Å; Y298-N306 HydrophobicContact CD2-CB 3.68Å; Y298-N306 HydrophobicContact CE1-CB 3.85Å; Y298-N306 HydrophobicContact CE2-CB 3.8Å; Y298-N306 HydrophobicContact CG-CB 3.65Å; D303-N306 VanDerWaalsContact CG-ND2 3.32Å; D303-N306 PolarHBondContact O-N 2.95Å; D303-N306 PolarHBondContact OD1-N 3.48Å; D303-N306 PolarHBondContact OD1-ND2 2.92Å; D303-N306 PolarHBondContact OD2-ND2 2.94Å; V304-N306 VanDerWaalsContact C-N 3.29Å; V304-N306 PolarHBondContact O-N 3.41Å; N306-C310 PolarHBondContact O-SG 2.82Å
307	A	97.3	Very high	96.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-69.2	-43.5	178.1	0	0	0	0	0	113.5	Q295 D303 V304 C310 A311	Q295-A307 WeakPolarHBondContact CG-O 3.44Å; Q295-A307 WeakPolarHBondContact O-CB 3.39Å; D303-A307 PolarHBondContact O-N 3.32Å; V304-A307 PolarHBondContact O-N 3.12Å; A307-C310 WeakPolarHBondContact O-CB 3.36Å; A307-C310 PolarHBondContact O-N 2.05Å; A307-A311 PolarHBondContact O-N 3.41Å
308	A	97.2	Very high	96.9	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.008	19%	0.188	C	C	.	.	H	α-helix	trans	-63.6	-43.8	-175.6	0	0	0	0	0	113.4	V304 C310 A311 A312 Y331 L340 D344 F345	V304-A308 PolarHBondContact O-N 3.34Å; A308-C310 VanDerWaalsContact C-N 3.3Å; A308-C310 PolarHBondContact O-N 3.07Å; A308-A311 WeakPolarHBondContact O-CB 3.38Å; A308-A311 PolarHBondContact O-N 3.44Å; A308-A312 PolarHBondContact O-N 3.43Å; A308-Y331 HydrophobicContact CB-CD2 4.19Å; A308-Y331 HydrophobicContact CB-CG 4.28Å; A308-L340 HydrophobicContact CB-CD1 4.44Å; A308-D344 CarbonylContact C-O 3.37Å; A308-D344 WeakPolarHBondContact CB-O 3.48Å; A308-F345 HydrophobicContact CB-CE1 4.41Å
309	P	97.9	Very high	96.8	Very high	18 Å²	18	41.2 Å²	41.2	12%	0.117	21%	0.207	C	C	.	.	H	α-helix	trans	-63.6	-32.2	172.7	-24.2	34	0	0	0	113.5	K305 A312 S313 D344 R348	K305-P309 WeakPolarHBondContact O-CD 3.14Å; K305-P309 VanDerWaalsContact O-CG 3.31Å; K305-P309 WeakPolarHBondContact O-CG 3.36Å; P309-A312 PolarHBondContact O-N 2.96Å; P309-S313 WeakPolarHBondContact O-CB 3.34Å; P309-S313 PolarHBondContact O-N 3.43Å; P309-S313 PolarHBondContact O-OG 3.05Å; P309-D344 WeakPolarHBondContact CD-O 3.47Å; P309-D344 WeakPolarHBondContact CG-O 3.39Å; P309-R348 HydrophobicContact CB-CG 3.89Å
310	C	98	Very high	96.8	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-66.9	-41.5	174	-66.1	0	0	0	0	111.5	Y291 L294 Q295 N306 A307 A308 S313 Y314 R348	Y291-C310 HydrophobicContact CD1-CB 4.3Å; L294-C310 VanDerWaalsContact CD2-SG 3.57Å; Q295-C310 HydrophobicContact CB-CB 3.64Å; Q295-C310 HydrophobicContact CG-CB 4.37Å; N306-C310 PolarHBondContact O-SG 2.82Å; A307-C310 WeakPolarHBondContact O-CB 3.36Å; A307-C310 PolarHBondContact O-N 2.05Å; A308-C310 VanDerWaalsContact C-N 3.3Å; A308-C310 PolarHBondContact O-N 3.07Å; C310-S313 WeakPolarHBondContact O-CB 3.47Å; C310-S313 PolarHBondContact O-N 3.41Å; C310-Y314 PolarHBondContact O-N 2.9Å; C310-R348 PolarHBondContact SG-NE 3.34Å; C310-R348 VanDerWaalsContact SG-NE 3.39Å; C310-R348 PolarHBondContact SG-NH2 3.29Å
311	A	97.6	Very high	96.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.7	-45.3	173.4	0	0	0	0	0	111.1	Q295 A307 A308 S313 Y314 M315 M324 V328 Y331	Q295-A311 HydrophobicContact CG-CB 3.88Å; A307-A311 PolarHBondContact O-N 3.41Å; A308-A311 WeakPolarHBondContact O-CB 3.38Å; A308-A311 PolarHBondContact O-N 3.44Å; A311-S313 VanDerWaalsContact C-N 3.3Å; A311-S313 PolarHBondContact O-N 2.04Å; A311-Y314 WeakPolarHBondContact O-CB 3.33Å; A311-Y314 PolarHBondContact O-N 3.41Å; A311-M315 WeakPolarHBondContact O-CG 3.5Å; A311-M315 PolarHBondContact O-N 2.66Å; A311-M315 VanDerWaalsContact O-N 3.1Å; A311-M324 HydrophobicContact CB-SD 3.77Å; A311-V328 HydrophobicContact CB-CG2 3.75Å; A311-Y331 HydrophobicContact CB-CD2 4.23Å; A311-Y331 HydrophobicContact CB-CE2 4.01Å
312	A	97.6	Very high	96.7	Very high	11 Å²	11	41.1 Å²	41.1	9%	0.091	22%	0.219	C	C	.	.	H	α-helix	trans	-62.3	-36.6	175.2	0	0	0	0	0	112.6	A308 P309 M315 F345 P347	A308-A312 PolarHBondContact O-N 3.43Å; P309-A312 PolarHBondContact O-N 2.96Å; A312-M315 PolarHBondContact O-N 3.45Å; A312-F345 WeakPolarHBondContact CB-O 3.27Å; A312-P347 HydrophobicContact CB-CG 4.25Å
313	S	98.3	Very high	96.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-66.7	-41.1	175.6	-55	0	0	0	0	112.2	P309 C310 A311 M315 L316 F317 R348	P309-S313 WeakPolarHBondContact O-CB 3.34Å; P309-S313 PolarHBondContact O-N 3.43Å; P309-S313 PolarHBondContact O-OG 3.05Å; C310-S313 WeakPolarHBondContact O-CB 3.47Å; C310-S313 PolarHBondContact O-N 3.41Å; A311-S313 VanDerWaalsContact C-N 3.3Å; A311-S313 PolarHBondContact O-N 2.04Å; S313-M315 VanDerWaalsContact C-N 3.31Å; S313-M315 PolarHBondContact O-N 2.95Å; S313-L316 WeakPolarHBondContact O-CB 3.21Å; S313-L316 PolarHBondContact O-N 3.36Å; S313-F317 WeakPolarHBondContact O-CD2 3.42Å; S313-F317 WeakPolarHBondContact O-CE2 3.44Å; S313-R348 PolarHBondContact OG-N 2.83Å
314	Y	98.3	Very high	96.5	Very high	18 Å²	18	36.9 Å²	36.9	7%	0.071	20%	0.2	C	C	.	.	H	α-helix	trans	-57.3	-46.1	172.9	-178.4	-75.1	0	0	0	111.3	A288 H292 C310 A311 L316 F317 D318 D321 M324	A288-Y314 HydrophobicContact CB-CD2 3.89Å; A288-Y314 HydrophobicContact CB-CE2 3.72Å; A288-Y314 HydrophobicContact CB-CG 4.46Å; A288-Y314 WeakPolarHBondContact O-CD2 3.34Å; A288-Y314 WeakPolarHBondContact O-CE2 3.47Å; H292-Y314 HydrophobicContact CB-CD2 3.87Å; H292-Y314 HydrophobicContact CB-CE2 3.85Å; C310-Y314 PolarHBondContact O-N 2.9Å; A311-Y314 WeakPolarHBondContact O-CB 3.33Å; A311-Y314 PolarHBondContact O-N 3.41Å; Y314-L316 PolarHBondContact O-N 3.21Å; Y314-L316 VanDerWaalsContact O-N 3.07Å; Y314-F317 PolarHBondContact O-N 3.1Å; Y314-D318 HydrophobicContact CD1-CB 4.43Å; Y314-D318 HydrophobicContact CE1-CB 3.69Å; Y314-D318 PolarHBondContact O-N 3.28Å; Y314-D318 VanDerWaalsContact O-N 3.09Å; Y314-D318 PolarHBondContact OH-OD2 2.96Å; Y314-D321 HydrophobicContact CE1-CB 3.74Å; Y314-D321 WeakPolarHBondContact CE1-OD2 3.48Å; Y314-D321 PolarHBondContact OH-OD2 3.11Å; Y314-M324 HydrophobicContact CD1-CB 3.64Å; Y314-M324 HydrophobicContact CD1-CE 4.09Å; Y314-M324 HydrophobicContact CD1-CG 3.42Å; Y314-M324 VanDerWaalsContact CD1-CG 3.42Å; Y314-M324 HydrophobicContact CD2-CE 3.81Å; Y314-M324 HydrophobicContact CE1-CB 3.73Å; Y314-M324 HydrophobicContact CE1-CE 4.48Å; Y314-M324 HydrophobicContact CE1-CG 4.06Å; Y314-M324 HydrophobicContact CE2-CE 4.26Å; Y314-M324 HydrophobicContact CG-CB 4.43Å; Y314-M324 HydrophobicContact CG-CE 3.74Å; Y314-M324 HydrophobicContact CG-CG 3.86Å; Y314-M324 HydrophobicContact CG-SD 4.41Å
315	M	97.5	Very high	96.5	Very high	43 Å²	43	41.1 Å²	41.1	21%	0.212	22%	0.219	C	C	.	.	H	α-helix	trans	-61.8	-17.6	-177.8	-68.7	-54.5	-63.1	0	0	114.1	A311 A312 S313 P319 M324 Q325 V328	A311-M315 WeakPolarHBondContact O-CG 3.5Å; A311-M315 PolarHBondContact O-N 2.66Å; A311-M315 VanDerWaalsContact O-N 3.1Å; A312-M315 PolarHBondContact O-N 3.45Å; S313-M315 VanDerWaalsContact C-N 3.31Å; S313-M315 PolarHBondContact O-N 2.95Å; M315-P319 WeakPolarHBondContact CE-O 3.45Å; M315-M324 HydrophobicContact CG-CG 4.1Å; M315-M324 HydrophobicContact SD-CB 3.73Å; M315-M324 HydrophobicContact SD-CG 3.6Å; M315-M324 VanDerWaalsContact SD-CG 3.6Å; M315-Q325 HydrophobicContact CE-CG 3.5Å; M315-Q325 HydrophobicContact SD-CG 4.3Å; M315-V328 HydrophobicContact CG-CG2 3.97Å
316	L	96.8	Very high	96.4	Very high	31 Å²	31	41.8 Å²	41.8	16%	0.162	22%	0.224	C	C	.	.	H	α-helix	trans	-66.1	-40.5	170.2	-68.7	176.6	0	0	0	111.6	S313 Y314 P347 A351 L352 Y355	S313-L316 WeakPolarHBondContact O-CB 3.21Å; S313-L316 PolarHBondContact O-N 3.36Å; Y314-L316 PolarHBondContact O-N 3.21Å; Y314-L316 VanDerWaalsContact O-N 3.07Å; L316-P347 HydrophobicContact CD1-CB 3.52Å; L316-P347 HydrophobicContact CD1-CG 3.85Å; L316-P347 HydrophobicContact CD2-CG 3.97Å; L316-P347 HydrophobicContact CG-CB 4.04Å; L316-P347 HydrophobicContact CG-CG 3.86Å; L316-A351 HydrophobicContact CD1-CB 4.35Å; L316-L352 HydrophobicContact CD1-CB 4.41Å; L316-L352 HydrophobicContact CD1-CD1 4.2Å; L316-L352 HydrophobicContact CD2-CD1 4.39Å; L316-Y355 HydrophobicContact CB-CD2 3.92Å; L316-Y355 HydrophobicContact CB-CE2 4.31Å; L316-Y355 HydrophobicContact CB-CG 4.05Å; L316-Y355 HydrophobicContact CD1-CG 4.33Å; L316-Y355 HydrophobicContact CD2-CD1 4.12Å; L316-Y355 HydrophobicContact CD2-CE1 4.29Å; L316-Y355 HydrophobicContact CD2-CG 4.41Å; L316-Y355 WeakPolarHBondContact O-CE2 3.4Å
317	F	95.4	Very high	96.3	Very high	44 Å²	44	40.8 Å²	40.8	19%	0.193	22%	0.219	C	C	.	.	H	α-helix	trans	-92.7	-29.9	-171.3	-56.5	-68.3	0	0	0	113	V287 A288 Y291 S313 Y314 A351 Y354 Y355	V287-F317 HydrophobicContact CB-CE2 4.45Å; V287-F317 HydrophobicContact CB-CZ 4.49Å; V287-F317 HydrophobicContact CG1-CD2 4.06Å; V287-F317 HydrophobicContact CG1-CE1 4.15Å; V287-F317 HydrophobicContact CG1-CE2 3.57Å; V287-F317 HydrophobicContact CG1-CZ 3.63Å; A288-F317 HydrophobicContact CB-CB 3.8Å; Y291-F317 HydrophobicContact CD2-CD2 4.44Å; Y291-F317 HydrophobicContact CD2-CE2 4.01Å; Y291-F317 AromaticContact CE2-CE2 3.98Å; Y291-F317 HydrophobicContact CE2-CE2 3.98Å; S313-F317 WeakPolarHBondContact O-CD2 3.42Å; S313-F317 WeakPolarHBondContact O-CE2 3.44Å; Y314-F317 PolarHBondContact O-N 3.1Å; F317-A351 HydrophobicContact CE2-CB 4.3Å; F317-A351 HydrophobicContact CZ-CB 4.45Å; F317-Y354 AromaticContact CE1-CD1 3.58Å; F317-Y354 HydrophobicContact CE1-CD1 3.58Å; F317-Y354 AromaticContact CE1-CE1 3.8Å; F317-Y354 HydrophobicContact CE1-CE1 3.8Å; F317-Y354 AromaticContact CZ-CD1 3.74Å; F317-Y354 HydrophobicContact CZ-CD1 3.74Å; F317-Y354 HydrophobicContact CZ-CE1 4.28Å; F317-Y355 HydrophobicContact CD1-CD2 4.12Å; F317-Y355 HydrophobicContact CE1-CD2 4.04Å
318	D	96	Very high	96.2	Very high	12 Å²	12	42 Å²	42	6%	0.064	23%	0.226	C	C	.	.			trans	-138.6	75.5	176.6	-170	6.9	0	0	0	111.6	K285 Y314 S320 D321	K285-D318 HydrophobicContact CD-CB 4.03Å; K285-D318 WeakPolarHBondContact CD-OD2 3.02Å; K285-D318 IonicContact NZ-OD1 3.24Å; K285-D318 PolarHBondContact NZ-OD1 3.42Å; K285-D318 IonicContact NZ-OD2 2.6Å; K285-D318 PolarHBondContact NZ-OD2 2.93Å; Y314-D318 HydrophobicContact CD1-CB 4.43Å; Y314-D318 HydrophobicContact CE1-CB 3.69Å; Y314-D318 PolarHBondContact O-N 3.28Å; Y314-D318 VanDerWaalsContact O-N 3.09Å; Y314-D318 PolarHBondContact OH-OD2 2.96Å; D318-S320 PolarHBondContact O-N 3.12Å; D318-S320 PolarHBondContact OD1-N 3.49Å; D318-S320 PolarHBondContact OD1-OG 3.43Å; D318-D321 PolarHBondContact O-N 2.93Å
319	P	95.9	Very high	96.2	Very high	80 Å²	80	44.7 Å²	44.7	52%	0.519	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-16.3	-179.6	26.9	-34.7	0	0	0	113.2	M315 Q325	M315-P319 WeakPolarHBondContact CE-O 3.45Å; P319-Q325 PolarHBondContact O-NE2 3.17Å
320	S	95.7	Very high	96	Very high	85 Å²	85	47.7 Å²	47.7	59%	0.594	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-12.6	-179.3	44.8	0	0	0	0	114.7	D318 Q322	D318-S320 PolarHBondContact O-N 3.12Å; D318-S320 PolarHBondContact OD1-N 3.49Å; D318-S320 PolarHBondContact OD1-OG 3.43Å; S320-Q322 PolarHBondContact O-N 3.47Å; S320-Q322 VanDerWaalsContact O-N 3.14Å
321	D	95.3	Very high	95.9	Very high	34 Å²	34	48 Å²	48	18%	0.182	26%	0.259	C	S	.	.			trans	-67.9	111	-179.5	-177.6	-1.2	0	0	0	111.7	Y314 D318 V323 M324 Q325	Y314-D321 HydrophobicContact CE1-CB 3.74Å; Y314-D321 WeakPolarHBondContact CE1-OD2 3.48Å; Y314-D321 PolarHBondContact OH-OD2 3.11Å; D318-D321 PolarHBondContact O-N 2.93Å; D321-V323 VanDerWaalsContact C-N 3.32Å; D321-V323 PolarHBondContact O-N 3.24Å; D321-V323 WeakPolarHBondContact OD1-CB 3.49Å; D321-V323 PolarHBondContact OD1-N 2.89Å; D321-M324 HydrophobicContact CB-CB 4.26Å; D321-M324 PolarHBondContact O-N 3.18Å; D321-Q325 VanDerWaalsContact O-CG 3.27Å; D321-Q325 WeakPolarHBondContact O-CG 3.5Å; D321-Q325 PolarHBondContact O-N 2.92Å
322	Q	95.6	Very high	95.7	Very high	137 Å²	137	54 Å²	54	64%	0.64	28%	0.281	S	S	*	.	H	α-helix	trans	-64.4	-33.8	179.2	-63.7	-176.1	0.6	0	0	113	S320 Q325 Q326	S320-Q322 PolarHBondContact O-N 3.47Å; S320-Q322 VanDerWaalsContact O-N 3.14Å; Q322-Q325 PolarHBondContact O-N 3.23Å; Q322-Q326 VanDerWaalsContact O-CG 3.27Å; Q322-Q326 WeakPolarHBondContact O-CG 3.34Å; Q322-Q326 PolarHBondContact O-N 3.43Å
323	V	92.9	Very high	95.6	Very high	81 Å²	81	61 Å²	61	49%	0.491	31%	0.31	S	S	.	.	H	α-helix	trans	-68	-45.4	-179.5	178.6	0	0	0	0	109.4	D321 Q326 N327	D321-V323 VanDerWaalsContact C-N 3.32Å; D321-V323 PolarHBondContact O-N 3.24Å; D321-V323 WeakPolarHBondContact OD1-CB 3.49Å; D321-V323 PolarHBondContact OD1-N 2.89Å; V323-Q326 WeakPolarHBondContact O-CB 3.07Å; V323-Q326 PolarHBondContact O-N 3.27Å; V323-N327 PolarHBondContact O-N 3.37Å; V323-N327 PolarHBondContact O-OD1 3.45Å
324	M	94.5	Very high	95.4	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-68.8	-36.6	177.4	-165.2	60.9	63.1	0	0	112.4	H292 Q295 A311 Y314 M315 D321 Q326 N327 V328	H292-M324 HydrophobicContact CB-CE 4.46Å; Q295-M324 HydrophobicContact CG-SD 4.47Å; A311-M324 HydrophobicContact CB-SD 3.77Å; Y314-M324 HydrophobicContact CD1-CB 3.64Å; Y314-M324 HydrophobicContact CD1-CE 4.09Å; Y314-M324 HydrophobicContact CD1-CG 3.42Å; Y314-M324 VanDerWaalsContact CD1-CG 3.42Å; Y314-M324 HydrophobicContact CD2-CE 3.81Å; Y314-M324 HydrophobicContact CE1-CB 3.73Å; Y314-M324 HydrophobicContact CE1-CE 4.48Å; Y314-M324 HydrophobicContact CE1-CG 4.06Å; Y314-M324 HydrophobicContact CE2-CE 4.26Å; Y314-M324 HydrophobicContact CG-CB 4.43Å; Y314-M324 HydrophobicContact CG-CE 3.74Å; Y314-M324 HydrophobicContact CG-CG 3.86Å; Y314-M324 HydrophobicContact CG-SD 4.41Å; M315-M324 HydrophobicContact CG-CG 4.1Å; M315-M324 HydrophobicContact SD-CB 3.73Å; M315-M324 HydrophobicContact SD-CG 3.6Å; M315-M324 VanDerWaalsContact SD-CG 3.6Å; D321-M324 HydrophobicContact CB-CB 4.26Å; D321-M324 PolarHBondContact O-N 3.18Å; M324-Q326 VanDerWaalsContact C-N 3.28Å; M324-Q326 PolarHBondContact O-N 3.37Å; M324-N327 WeakPolarHBondContact O-CB 3.05Å; M324-N327 PolarHBondContact O-N 2.9Å; M324-N327 VanDerWaalsContact O-N 3.13Å; M324-N327 HydrophobicContact SD-CB 4.02Å; M324-V328 WeakPolarHBondContact O-CG2 3.41Å; M324-V328 PolarHBondContact O-N 3.43Å
325	Q	95.7	Very high	95.2	Very high	92 Å²	92	70.3 Å²	70.3	43%	0.43	35%	0.346	S	S	.	.	H	α-helix	trans	-56.3	-43.7	171.9	-73.5	173.7	11.3	0	0	111.9	M315 P319 D321 Q322 V328 A329	M315-Q325 HydrophobicContact CE-CG 3.5Å; M315-Q325 HydrophobicContact SD-CG 4.3Å; P319-Q325 PolarHBondContact O-NE2 3.17Å; D321-Q325 VanDerWaalsContact O-CG 3.27Å; D321-Q325 WeakPolarHBondContact O-CG 3.5Å; D321-Q325 PolarHBondContact O-N 2.92Å; Q322-Q325 PolarHBondContact O-N 3.23Å; Q325-V328 PolarHBondContact O-N 3.31Å; Q325-A329 WeakPolarHBondContact O-CB 3.25Å; Q325-A329 PolarHBondContact O-N 3.01Å
326	Q	95.1	Very high	95	Very high	127 Å²	127	72.7 Å²	72.7	59%	0.593	37%	0.373	S	S	*	.	H	α-helix	trans	-64.4	-40.5	175.7	-71.4	171.6	12.7	0	0	112	Q322 V323 M324 A329 Y330	Q322-Q326 VanDerWaalsContact O-CG 3.27Å; Q322-Q326 WeakPolarHBondContact O-CG 3.34Å; Q322-Q326 PolarHBondContact O-N 3.43Å; V323-Q326 WeakPolarHBondContact O-CB 3.07Å; V323-Q326 PolarHBondContact O-N 3.27Å; M324-Q326 VanDerWaalsContact C-N 3.28Å; M324-Q326 PolarHBondContact O-N 3.37Å; Q326-A329 PolarHBondContact O-N 3.44Å; Q326-Y330 WeakPolarHBondContact O-CB 3.04Å; Q326-Y330 PolarHBondContact O-N 2.98Å
327	N	94.2	Very high	94.9	Very high	42 Å²	42	78.3 Å²	78.3	23%	0.225	40%	0.398	C	S	.	.	H	α-helix	trans	-62.1	-44.7	176.3	-69.6	-10.4	0	0	0	111.9	Q295 V323 M324 A329 Y330 Y331	Q295-N327 PolarHBondContact OE1-ND2 2.95Å; V323-N327 PolarHBondContact O-N 3.37Å; V323-N327 PolarHBondContact O-OD1 3.45Å; M324-N327 WeakPolarHBondContact O-CB 3.05Å; M324-N327 PolarHBondContact O-N 2.9Å; M324-N327 VanDerWaalsContact O-N 3.13Å; M324-N327 HydrophobicContact SD-CB 4.02Å; N327-A329 VanDerWaalsContact C-N 3.35Å; N327-A329 PolarHBondContact O-N 2.88Å; N327-Y330 WeakPolarHBondContact O-CB 3.45Å; N327-Y330 PolarHBondContact O-N 3.29Å; N327-Y331 HydrophobicContact CB-CE2 4.35Å; N327-Y331 WeakPolarHBondContact O-CD2 3.19Å; N327-Y331 PolarHBondContact O-N 2.84Å
328	V	95.1	Very high	94.7	Very high	27 Å²	27	79.1 Å²	79.1	16%	0.164	40%	0.4	C	S	.	.	H	α-helix	trans	-62.1	-44	175.3	174.5	0	0	0	0	110.8	A311 M315 M324 Q325 Y330 Y331 R332	A311-V328 HydrophobicContact CB-CG2 3.75Å; M315-V328 HydrophobicContact CG-CG2 3.97Å; M324-V328 WeakPolarHBondContact O-CG2 3.41Å; M324-V328 PolarHBondContact O-N 3.43Å; Q325-V328 PolarHBondContact O-N 3.31Å; V328-Y330 VanDerWaalsContact C-N 3.32Å; V328-Y330 PolarHBondContact O-N 3.09Å; V328-Y331 PolarHBondContact O-N 3.47Å; V328-R332 WeakPolarHBondContact O-CG 3.33Å; V328-R332 PolarHBondContact O-N 3Å
329	A	95.9	Very high	94.6	Very high	56 Å²	56	80.7 Å²	80.7	46%	0.463	42%	0.418	S	S	.	.	H	α-helix	trans	-61.5	-40.6	176.2	0	0	0	0	0	112	Q325 Q326 N327 R332 F333	Q325-A329 WeakPolarHBondContact O-CB 3.25Å; Q325-A329 PolarHBondContact O-N 3.01Å; Q326-A329 PolarHBondContact O-N 3.44Å; N327-A329 VanDerWaalsContact C-N 3.35Å; N327-A329 PolarHBondContact O-N 2.88Å; A329-R332 PolarHBondContact O-N 3.36Å; A329-F333 WeakPolarHBondContact O-CB 3.36Å; A329-F333 PolarHBondContact O-N 2.54Å
330	Y	94.8	Very high	94.6	Very high	82 Å²	82	77.6 Å²	77.6	32%	0.322	40%	0.397	S	S	.	.	H	α-helix	trans	-59.6	-49.1	174.9	173.1	-88.6	0	0	0	111.5	Y299 Q326 N327 V328 R332 F333 Y334	Y299-Y330 AromaticContact CE2-CE1 3.97Å; Y299-Y330 HydrophobicContact CE2-CE1 3.97Å; Q326-Y330 WeakPolarHBondContact O-CB 3.04Å; Q326-Y330 PolarHBondContact O-N 2.98Å; N327-Y330 WeakPolarHBondContact O-CB 3.45Å; N327-Y330 PolarHBondContact O-N 3.29Å; V328-Y330 VanDerWaalsContact C-N 3.32Å; V328-Y330 PolarHBondContact O-N 3.09Å; Y330-R332 VanDerWaalsContact C-N 3.32Å; Y330-R332 PolarHBondContact O-N 3.03Å; Y330-F333 PolarHBondContact O-N 3.39Å; Y330-Y334 HydrophobicContact CD1-CD2 4.44Å; Y330-Y334 AromaticContact CD2-CD2 3.78Å; Y330-Y334 HydrophobicContact CD2-CD2 3.78Å; Y330-Y334 AromaticContact CD2-CE2 3.62Å; Y330-Y334 HydrophobicContact CD2-CE2 3.62Å; Y330-Y334 HydrophobicContact CE1-CD2 4.2Å; Y330-Y334 AromaticContact CE2-CD2 3.53Å; Y330-Y334 HydrophobicContact CE2-CD2 3.53Å; Y330-Y334 AromaticContact CE2-CE2 3.28Å; Y330-Y334 HydrophobicContact CE2-CE2 3.28Å; Y330-Y334 HydrophobicContact CG-CD2 4.23Å; Y330-Y334 HydrophobicContact CG-CE2 4.49Å; Y330-Y334 AromaticContact CZ-CD2 3.74Å; Y330-Y334 AromaticContact CZ-CE2 3.91Å; Y330-Y334 WeakPolarHBondContact O-CD2 3.07Å; Y330-Y334 PolarHBondContact O-N 2.93Å; Y330-Y334 VanDerWaalsContact O-N 3.09Å
331	Y	95.1	Very high	94.6	Very high	5 Å²	5	79.8 Å²	79.8	2%	0.02	40%	0.396	C	S	.	.	H	α-helix	trans	-61.8	-40.2	177	-63.6	-43.4	0	0	0	112.3	Q295 Y299 V304 A308 A311 N327 V328 R335	Q295-Y331 HydrophobicContact CG-CE2 4.41Å; Q295-Y331 PolarHBondContact NE2-OH 3.48Å; Y299-Y331 AromaticContact CD2-CE1 3.91Å; Y299-Y331 HydrophobicContact CD2-CE1 3.91Å; Y299-Y331 HydrophobicContact CE2-CE1 4.41Å; V304-Y331 HydrophobicContact CG1-CD1 3.5Å; V304-Y331 HydrophobicContact CG1-CE1 3.78Å; V304-Y331 HydrophobicContact CG1-CG 4.32Å; V304-Y331 HydrophobicContact CG2-CE1 4.38Å; A308-Y331 HydrophobicContact CB-CD2 4.19Å; A308-Y331 HydrophobicContact CB-CG 4.28Å; A311-Y331 HydrophobicContact CB-CD2 4.23Å; A311-Y331 HydrophobicContact CB-CE2 4.01Å; N327-Y331 HydrophobicContact CB-CE2 4.35Å; N327-Y331 WeakPolarHBondContact O-CD2 3.19Å; N327-Y331 PolarHBondContact O-N 2.84Å; V328-Y331 PolarHBondContact O-N 3.47Å; Y331-R335 PolarHBondContact O-N 3.16Å; Y331-R335 VanDerWaalsContact O-N 3.1Å
332	R	94.8	Very high	94.5	Very high	126 Å²	126	82.9 Å²	82.9	48%	0.475	41%	0.41	S	S	.	.	H	α-helix	trans	-64.5	-42	176	-76.5	-173	170.5	-164	-4.2	112.3	V328 A329 Y330 R335 E342 F345	V328-R332 WeakPolarHBondContact O-CG 3.33Å; V328-R332 PolarHBondContact O-N 3Å; A329-R332 PolarHBondContact O-N 3.36Å; Y330-R332 VanDerWaalsContact C-N 3.32Å; Y330-R332 PolarHBondContact O-N 3.03Å; R332-R335 WeakPolarHBondContact O-CB 3.48Å; R332-R335 VanDerWaalsContact O-CG 3.27Å; R332-R335 WeakPolarHBondContact O-CG 3.33Å; R332-R335 PolarHBondContact O-N 3.46Å; R332-E342 IonicContact NH2-OE1 3.89Å; R332-F345 HydrophobicContact CB-CE1 4.17Å; R332-F345 HydrophobicContact CB-CZ 4.33Å; R332-F345 HydrophobicContact CG-CD1 3.63Å; R332-F345 HydrophobicContact CG-CE1 3.33Å; R332-F345 HydrophobicContact CG-CE2 4.36Å; R332-F345 HydrophobicContact CG-CG 4.27Å; R332-F345 HydrophobicContact CG-CZ 3.75Å
333	F	95.6	Very high	94.4	Very high	158 Å²	158	83.3 Å²	83.3	69%	0.693	41%	0.412	S	S	*	.	H	α-helix	trans	-62.2	-46	179.8	-177.8	-96.2	0	0	0	111.4	A329 Y330 R335	A329-F333 WeakPolarHBondContact O-CB 3.36Å; A329-F333 PolarHBondContact O-N 2.54Å; Y330-F333 PolarHBondContact O-N 3.39Å; F333-R335 VanDerWaalsContact C-N 3.32Å; F333-R335 PolarHBondContact O-N 3.33Å
334	Y	94.1	Very high	94.4	Very high	83 Å²	83	81 Å²	81	33%	0.325	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	11.1	-179.6	-66.1	-75	0	0	0	114.3	Y330 A336 Q337 W338	Y330-Y334 HydrophobicContact CD1-CD2 4.44Å; Y330-Y334 AromaticContact CD2-CD2 3.78Å; Y330-Y334 HydrophobicContact CD2-CD2 3.78Å; Y330-Y334 AromaticContact CD2-CE2 3.62Å; Y330-Y334 HydrophobicContact CD2-CE2 3.62Å; Y330-Y334 HydrophobicContact CE1-CD2 4.2Å; Y330-Y334 AromaticContact CE2-CD2 3.53Å; Y330-Y334 HydrophobicContact CE2-CD2 3.53Å; Y330-Y334 AromaticContact CE2-CE2 3.28Å; Y330-Y334 HydrophobicContact CE2-CE2 3.28Å; Y330-Y334 HydrophobicContact CG-CD2 4.23Å; Y330-Y334 HydrophobicContact CG-CE2 4.49Å; Y330-Y334 AromaticContact CZ-CD2 3.74Å; Y330-Y334 AromaticContact CZ-CE2 3.91Å; Y330-Y334 WeakPolarHBondContact O-CD2 3.07Å; Y330-Y334 PolarHBondContact O-N 2.93Å; Y330-Y334 VanDerWaalsContact O-N 3.09Å; Y334-A336 PolarHBondContact O-N 3.41Å; Y334-Q337 WeakPolarHBondContact O-CB 3.33Å; Y334-Q337 PolarHBondContact O-N 3.13Å; Y334-W338 VanDerWaalsContact CB-CD1 3.46Å; Y334-W338 VanDerWaalsContact O-CD1 3.31Å; Y334-W338 PolarHBondContact O-N 3.03Å; Y334-W338 VanDerWaalsContact O-N 3.12Å
335	R	94.3	Very high	94.5	Very high	131 Å²	131	81.7 Å²	81.7	49%	0.494	40%	0.4	S	S	.	.	H	α-helix	trans	-48.8	-40.9	-173.9	71.1	-177.6	-173.7	167.4	0.8	114.5	Y331 R332 F333 G339 L340 F345	Y331-R335 PolarHBondContact O-N 3.16Å; Y331-R335 VanDerWaalsContact O-N 3.1Å; R332-R335 WeakPolarHBondContact O-CB 3.48Å; R332-R335 VanDerWaalsContact O-CG 3.27Å; R332-R335 WeakPolarHBondContact O-CG 3.33Å; R332-R335 PolarHBondContact O-N 3.46Å; F333-R335 VanDerWaalsContact C-N 3.32Å; F333-R335 PolarHBondContact O-N 3.33Å; R335-G339 PolarHBondContact O-N 2.83Å; R335-L340 HydrophobicContact CB-CB 4.07Å; R335-L340 PolarHBondContact O-N 2.95Å; R335-F345 HydrophobicContact CB-CE2 4.35Å; R335-F345 HydrophobicContact CB-CZ 4.21Å
336	A	93.2	Very high	94.6	Very high	94 Å²	94	82.5 Å²	82.5	78%	0.777	40%	0.404	S	S	*	.	H	α-helix	trans	-70.1	-36.6	-178.5	0	0	0	0	0	112.1	Y334	Y334-A336 PolarHBondContact O-N 3.41Å
337	Q	93.6	Very high	94.7	Very high	148 Å²	148	77.8 Å²	77.8	69%	0.692	38%	0.384	S	S	*	.	H	α-helix	trans	-70.1	-37.8	178.3	-177.4	177.1	-2.2	0	0	111.8	Y334	Y334-Q337 WeakPolarHBondContact O-CB 3.33Å; Y334-Q337 PolarHBondContact O-N 3.13Å
338	W	91.7	Very high	94.9	Very high	62 Å²	62	77 Å²	77	24%	0.235	38%	0.378	C	S	.	.	H	α-helix	trans	-91.3	-0.9	-178.7	-66.7	86	0	0	0	113.8	N302 V304 Y334 L340	N302-W338 WeakPolarHBondContact OD1-CH2 3.48Å; N302-W338 WeakPolarHBondContact OD1-CZ3 2.96Å; V304-W338 HydrophobicContact CB-CD2 4.01Å; V304-W338 HydrophobicContact CB-CE3 3.55Å; V304-W338 HydrophobicContact CB-CG 4.46Å; V304-W338 HydrophobicContact CB-CZ3 3.97Å; V304-W338 HydrophobicContact CG1-CB 4.48Å; V304-W338 HydrophobicContact CG1-CD2 4.35Å; V304-W338 HydrophobicContact CG1-CE3 4.37Å; V304-W338 HydrophobicContact CG1-CG 4.41Å; V304-W338 HydrophobicContact CG2-CD2 3.73Å; V304-W338 HydrophobicContact CG2-CE3 3.23Å; V304-W338 HydrophobicContact CG2-CH2 3.6Å; V304-W338 HydrophobicContact CG2-CZ2 4.11Å; V304-W338 HydrophobicContact CG2-CZ3 3.16Å; Y334-W338 VanDerWaalsContact CB-CD1 3.46Å; Y334-W338 VanDerWaalsContact O-CD1 3.31Å; Y334-W338 PolarHBondContact O-N 3.03Å; Y334-W338 VanDerWaalsContact O-N 3.12Å; W338-L340 VanDerWaalsContact C-N 3.29Å; W338-L340 HydrophobicContact CB-CD1 4.28Å; W338-L340 HydrophobicContact CB-CG 3.95Å; W338-L340 PolarHBondContact O-N 2.88Å
339	G	94	Very high	95	Very high	44 Å²	44	80.7 Å²	80.7	45%	0.454	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.1	33.5	-178.7	0	0	0	0	0	113.5	R335	R335-G339 PolarHBondContact O-N 2.83Å
340	L	95.6	Very high	95	Very high	15 Å²	15	80.8 Å²	80.8	8%	0.079	39%	0.393	C	S	.	.			trans	-82.7	143.3	177.3	-58.7	175.2	0	0	0	111.2	V304 K305 A308 R335 W338 D344 F345	V304-L340 HydrophobicContact CG1-CD1 3.79Å; V304-L340 HydrophobicContact CG1-CD2 4.17Å; V304-L340 HydrophobicContact CG1-CG 4.41Å; K305-L340 HydrophobicContact CG-CD2 4Å; A308-L340 HydrophobicContact CB-CD1 4.44Å; R335-L340 HydrophobicContact CB-CB 4.07Å; R335-L340 PolarHBondContact O-N 2.95Å; W338-L340 VanDerWaalsContact C-N 3.29Å; W338-L340 HydrophobicContact CB-CD1 4.28Å; W338-L340 HydrophobicContact CB-CG 3.95Å; W338-L340 PolarHBondContact O-N 2.88Å; L340-D344 WeakPolarHBondContact CA-OD2 3.38Å; L340-D344 HydrophobicContact CB-CB 4.47Å; L340-D344 HydrophobicContact CD2-CB 4.15Å; L340-F345 HydrophobicContact CB-CE2 4.07Å; L340-F345 HydrophobicContact CB-CZ 4.17Å; L340-F345 HydrophobicContact CD1-CE1 4.4Å; L340-F345 HydrophobicContact CD1-CE2 4.47Å; L340-F345 HydrophobicContact CD1-CZ 3.77Å
341	K	95.1	Very high	95.2	Very high	131 Å²	131	76.9 Å²	76.9	57%	0.57	38%	0.378	S	S	*	.			trans	-107.6	168.5	174.5	-60.7	180	-177	178.2	0	110.4	E343 D344 F345	K341-E343 PolarHBondContact O-N 3.23Å; K341-D344 PolarHBondContact N-OD2 2.9Å; K341-D344 WeakPolarHBondContact O-CB 3.48Å; K341-D344 PolarHBondContact O-N 3.19Å; K341-F345 WeakPolarHBondContact O-CD2 3.41Å; K341-F345 WeakPolarHBondContact O-CE2 3.48Å
342	E	93.1	Very high	95.3	Very high	99 Å²	99	79.7 Å²	79.7	46%	0.463	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-60.2	-30.3	175.8	-159.3	60.1	-150.3	0	0	112.5	R332 D344 F345	R332-E342 IonicContact NH2-OE1 3.89Å; E342-D344 VanDerWaalsContact C-N 3.27Å; E342-D344 PolarHBondContact O-N 3.34Å; E342-F345 PolarHBondContact O-N 3Å
343	E	93.7	Very high	95.4	Very high	147 Å²	147	81.5 Å²	81.5	69%	0.687	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-61.8	-32.3	174.6	-65.3	168.1	-161	0	0	112.6	K341 F345 Q346	K341-E343 PolarHBondContact O-N 3.23Å; E343-F345 PolarHBondContact O-N 3.31Å; E343-Q346 WeakPolarHBondContact O-CB 3.39Å; E343-Q346 PolarHBondContact O-N 3.5Å; E343-Q346 VanDerWaalsContact O-N 3.16Å
344	D	94.4	Very high	95.5	Very high	32 Å²	32	74.3 Å²	74.3	17%	0.171	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-74.1	-8.2	-179.4	-58.1	-45.2	0	0	0	112.4	A308 P309 L340 K341 E342	A308-D344 CarbonylContact C-O 3.37Å; A308-D344 WeakPolarHBondContact CB-O 3.48Å; P309-D344 WeakPolarHBondContact CD-O 3.47Å; P309-D344 WeakPolarHBondContact CG-O 3.39Å; L340-D344 WeakPolarHBondContact CA-OD2 3.38Å; L340-D344 HydrophobicContact CB-CB 4.47Å; L340-D344 HydrophobicContact CD2-CB 4.15Å; K341-D344 PolarHBondContact N-OD2 2.9Å; K341-D344 WeakPolarHBondContact O-CB 3.48Å; K341-D344 PolarHBondContact O-N 3.19Å; E342-D344 VanDerWaalsContact C-N 3.27Å; E342-D344 PolarHBondContact O-N 3.34Å
345	F	96	Very high	95.6	Very high	15 Å²	15	73.6 Å²	73.6	7%	0.066	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-100.5	8.9	174.5	-61.1	-80	0	0	0	112.7	A308 A312 R332 R335 L340 K341 E342 E343	A308-F345 HydrophobicContact CB-CE1 4.41Å; A312-F345 WeakPolarHBondContact CB-O 3.27Å; R332-F345 HydrophobicContact CB-CE1 4.17Å; R332-F345 HydrophobicContact CB-CZ 4.33Å; R332-F345 HydrophobicContact CG-CD1 3.63Å; R332-F345 HydrophobicContact CG-CE1 3.33Å; R332-F345 HydrophobicContact CG-CE2 4.36Å; R332-F345 HydrophobicContact CG-CG 4.27Å; R332-F345 HydrophobicContact CG-CZ 3.75Å; R335-F345 HydrophobicContact CB-CE2 4.35Å; R335-F345 HydrophobicContact CB-CZ 4.21Å; L340-F345 HydrophobicContact CB-CE2 4.07Å; L340-F345 HydrophobicContact CB-CZ 4.17Å; L340-F345 HydrophobicContact CD1-CE1 4.4Å; L340-F345 HydrophobicContact CD1-CE2 4.47Å; L340-F345 HydrophobicContact CD1-CZ 3.77Å; K341-F345 WeakPolarHBondContact O-CD2 3.41Å; K341-F345 WeakPolarHBondContact O-CE2 3.48Å; E342-F345 PolarHBondContact O-N 3Å; E343-F345 PolarHBondContact O-N 3.31Å
346	Q	96.6	Very high	95.7	Very high	109 Å²	109	70.8 Å²	70.8	51%	0.509	36%	0.36	S	S	.	.	S	Bend	trans	-86.3	143.4	171.7	-60.9	-57.4	-44.2	0	0	110.4	E343	E343-Q346 WeakPolarHBondContact O-CB 3.39Å; E343-Q346 PolarHBondContact O-N 3.5Å; E343-Q346 VanDerWaalsContact O-N 3.16Å
347	P	97.8	Very high	95.8	Very high	27 Å²	27	69.8 Å²	69.8	18%	0.175	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-57	151.6	169.9	-22.6	33	0	0	0	111.3	A312 L316 L352	A312-P347 HydrophobicContact CB-CG 4.25Å; L316-P347 HydrophobicContact CD1-CB 3.52Å; L316-P347 HydrophobicContact CD1-CG 3.85Å; L316-P347 HydrophobicContact CD2-CG 3.97Å; L316-P347 HydrophobicContact CG-CB 4.04Å; L316-P347 HydrophobicContact CG-CG 3.86Å; P347-L352 HydrophobicContact CB-CB 4.49Å
348	R	98	Very high	95.9	Very high	26 Å²	26	63 Å²	63	10%	0.098	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-64.3	145.3	176.7	-66.1	-167.6	177.4	-171.2	-3.1	110.9	E223 Y298 P309 C310 S313 E350 A351 L352	E223-R348 IonicContact OE1-CZ 3.72Å; E223-R348 IonicContact OE1-NH1 2.89Å; E223-R348 PolarHBondContact OE1-NH1 3.06Å; E223-R348 IonicContact OE1-NH2 3.77Å; E223-R348 PolarHBondContact OE1-NH2 2.96Å; E223-R348 IonicContact OE2-NH1 3.21Å; E223-R348 PolarHBondContact OE2-NH1 3.11Å; Y298-R348 VanDerWaalsContact CE2-NH2 3.35Å; P309-R348 HydrophobicContact CB-CG 3.89Å; C310-R348 PolarHBondContact SG-NE 3.34Å; C310-R348 VanDerWaalsContact SG-NE 3.39Å; C310-R348 PolarHBondContact SG-NH2 3.29Å; S313-R348 PolarHBondContact OG-N 2.83Å; R348-E350 VanDerWaalsContact C-N 3.29Å; R348-E350 WeakPolarHBondContact CB-OE1 3.45Å; R348-E350 WeakPolarHBondContact CD-OE1 3.35Å; R348-E350 IonicContact NH1-OE1 2.75Å; R348-E350 PolarHBondContact O-N 3.29Å; R348-A351 HydrophobicContact CB-CB 4.47Å; R348-A351 WeakPolarHBondContact O-CB 3.48Å; R348-A351 PolarHBondContact O-N 3.43Å; R348-A351 VanDerWaalsContact O-N 3.13Å; R348-L352 PolarHBondContact O-N 3.13Å
349	P	97.4	Very high	96.1	Very high	105 Å²	105	62.3 Å²	62.3	68%	0.682	31%	0.308	S	S	*	.	H	α-helix	trans	-56.9	-39.3	-174.7	-26.4	35	0	0	0	114	R353	P349-R353 WeakPolarHBondContact O-CB 3.49Å; P349-R353 PolarHBondContact O-N 3.36Å
350	E	97.2	Very high	96.1	Very high	57 Å²	57	67 Å²	67	27%	0.266	32%	0.316	S	S	.	.	H	α-helix	trans	-67.3	-40.8	178.7	67	-78	-179.3	0	0	112.5	F230 R348 R353 Y354	F230-E350 HydrophobicContact CD2-CB 4.07Å; F230-E350 HydrophobicContact CD2-CG 4.05Å; F230-E350 HydrophobicContact CE2-CB 3.97Å; F230-E350 HydrophobicContact CE2-CG 3.64Å; R348-E350 VanDerWaalsContact C-N 3.29Å; R348-E350 WeakPolarHBondContact CB-OE1 3.45Å; R348-E350 WeakPolarHBondContact CD-OE1 3.35Å; R348-E350 IonicContact NH1-OE1 2.75Å; R348-E350 PolarHBondContact O-N 3.29Å; E350-R353 PolarHBondContact O-N 2.82Å; E350-Y354 WeakPolarHBondContact O-CB 3.45Å; E350-Y354 PolarHBondContact O-N 3.33Å
351	A	97.9	Very high	96.1	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-63.4	-47.7	175.1	0	0	0	0	0	110.8	Y291 L316 F317 R348 R353 Y354 Y355	Y291-A351 HydrophobicContact CE2-CB 3.76Å; Y291-A351 WeakPolarHBondContact OH-CB 3.35Å; L316-A351 HydrophobicContact CD1-CB 4.35Å; F317-A351 HydrophobicContact CE2-CB 4.3Å; F317-A351 HydrophobicContact CZ-CB 4.45Å; R348-A351 HydrophobicContact CB-CB 4.47Å; R348-A351 WeakPolarHBondContact O-CB 3.48Å; R348-A351 PolarHBondContact O-N 3.43Å; R348-A351 VanDerWaalsContact O-N 3.13Å; A351-R353 PolarHBondContact O-N 3.29Å; A351-Y354 PolarHBondContact O-N 3.42Å; A351-Y355 WeakPolarHBondContact O-CB 3.39Å; A351-Y355 PolarHBondContact O-N 3.3Å
352	L	97.6	Very high	96.1	Very high	65 Å²	65	65.3 Å²	65.3	34%	0.34	31%	0.309	S	S	.	.	H	α-helix	trans	-63.7	-41.6	-179.4	-176.1	62.2	0	0	0	111.5	L316 P347 R348 N356	L316-L352 HydrophobicContact CD1-CB 4.41Å; L316-L352 HydrophobicContact CD1-CD1 4.2Å; L316-L352 HydrophobicContact CD2-CD1 4.39Å; P347-L352 HydrophobicContact CB-CB 4.49Å; R348-L352 PolarHBondContact O-N 3.13Å; L352-N356 VanDerWaalsContact O-CB 3.28Å; L352-N356 WeakPolarHBondContact O-CB 3.35Å; L352-N356 PolarHBondContact O-N 2.89Å; L352-N356 PolarHBondContact O-ND2 2.88Å; L352-N356 VanDerWaalsContact O-ND2 3.14Å
353	R	96.6	Very high	96.2	Very high	164 Å²	164	66 Å²	66	62%	0.619	31%	0.312	S	S	*	.	H	α-helix	trans	-61.6	-46.8	175.4	-175.9	-178.2	70	168.3	2.3	111.2	P349 E350 A351 Q357	P349-R353 WeakPolarHBondContact O-CB 3.49Å; P349-R353 PolarHBondContact O-N 3.36Å; E350-R353 PolarHBondContact O-N 2.82Å; A351-R353 PolarHBondContact O-N 3.29Å; R353-Q357 WeakPolarHBondContact O-CB 3.5Å; R353-Q357 PolarHBondContact O-N 2.99Å; R353-Q357 VanDerWaalsContact O-N 3.11Å
354	Y	97.1	Very high	96.2	Very high	7 Å²	7	63.9 Å²	63.9	3%	0.027	30%	0.303	C	S	.	.	H	α-helix	trans	-61.3	-51.2	178.2	175	-100.2	0	0	0	111.3	F229 F230 Y233 E271 V287 F317 E350 A351 N356 Q357 T358	F229-Y354 HydrophobicContact CE1-CE2 4.23Å; F230-Y354 AromaticContact CD1-CD2 3.76Å; F230-Y354 HydrophobicContact CD1-CD2 3.76Å; F230-Y354 HydrophobicContact CD1-CE2 4.3Å; F230-Y354 AromaticContact CD1-CG 3.92Å; F230-Y354 HydrophobicContact CD1-CG 3.92Å; F230-Y354 AromaticContact CE1-CD1 3.78Å; F230-Y354 HydrophobicContact CE1-CD1 3.78Å; F230-Y354 AromaticContact CE1-CD2 3.75Å; F230-Y354 HydrophobicContact CE1-CD2 3.75Å; F230-Y354 HydrophobicContact CE1-CE1 4.34Å; F230-Y354 HydrophobicContact CE1-CE2 4.29Å; F230-Y354 AromaticContact CE1-CG 3.45Å; F230-Y354 HydrophobicContact CE1-CG 3.45Å; F230-Y354 VanDerWaalsContact CE1-CG 3.45Å; F230-Y354 HydrophobicContact CZ-CD1 4.45Å; F230-Y354 HydrophobicContact CZ-CG 4.23Å; Y233-Y354 AromaticContact CD1-CD2 3.83Å; Y233-Y354 HydrophobicContact CD1-CD2 3.83Å; Y233-Y354 AromaticContact CD1-CE2 3.53Å; Y233-Y354 HydrophobicContact CD1-CE2 3.53Å; Y233-Y354 AromaticContact CD2-CE2 3.71Å; Y233-Y354 HydrophobicContact CD2-CE2 3.71Å; Y233-Y354 AromaticContact CE1-CD2 3.93Å; Y233-Y354 HydrophobicContact CE1-CD2 3.93Å; Y233-Y354 AromaticContact CE1-CE2 3.59Å; Y233-Y354 HydrophobicContact CE1-CE2 3.59Å; Y233-Y354 AromaticContact CE2-CE2 3.75Å; Y233-Y354 HydrophobicContact CE2-CE2 3.75Å; Y233-Y354 HydrophobicContact CG-CD2 4.27Å; Y233-Y354 AromaticContact CG-CE2 3.6Å; Y233-Y354 HydrophobicContact CG-CE2 3.6Å; Y233-Y354 AromaticContact CZ-CE2 3.72Å; E271-Y354 WeakPolarHBondContact CG-OH 3.16Å; V287-Y354 HydrophobicContact CB-CE1 4.4Å; V287-Y354 HydrophobicContact CG1-CD1 4.38Å; V287-Y354 HydrophobicContact CG1-CE1 4.27Å; V287-Y354 HydrophobicContact CG2-CE1 3.78Å; F317-Y354 AromaticContact CE1-CD1 3.58Å; F317-Y354 HydrophobicContact CE1-CD1 3.58Å; F317-Y354 AromaticContact CE1-CE1 3.8Å; F317-Y354 HydrophobicContact CE1-CE1 3.8Å; F317-Y354 AromaticContact CZ-CD1 3.74Å; F317-Y354 HydrophobicContact CZ-CD1 3.74Å; F317-Y354 HydrophobicContact CZ-CE1 4.28Å; E350-Y354 WeakPolarHBondContact O-CB 3.45Å; E350-Y354 PolarHBondContact O-N 3.33Å; A351-Y354 PolarHBondContact O-N 3.42Å; Y354-N356 PolarHBondContact O-N 3.18Å; Y354-Q357 WeakPolarHBondContact O-CB 3.29Å; Y354-Q357 PolarHBondContact O-N 2.86Å; Y354-Q357 VanDerWaalsContact O-N 3.11Å; Y354-T358 HydrophobicContact CD1-CG2 4.33Å; Y354-T358 HydrophobicContact CD2-CG2 4.14Å; Y354-T358 HydrophobicContact CE1-CG2 3.91Å; Y354-T358 HydrophobicContact CE2-CG2 3.69Å; Y354-T358 HydrophobicContact CG-CG2 4.44Å; Y354-T358 PolarHBondContact O-N 3.47Å; Y354-T358 PolarHBondContact O-OG1 3.41Å; Y354-T358 VanDerWaalsContact O-OG1 3.14Å
355	Y	97.3	Very high	96.3	Very high	68 Å²	68	63.5 Å²	63.5	27%	0.267	30%	0.301	S	S	.	.	H	α-helix	trans	-56.6	-49.2	177.6	177.5	-98.8	0	0	0	112.6	L316 F317 A351 Q357 T358 I359	L316-Y355 HydrophobicContact CB-CD2 3.92Å; L316-Y355 HydrophobicContact CB-CE2 4.31Å; L316-Y355 HydrophobicContact CB-CG 4.05Å; L316-Y355 HydrophobicContact CD1-CG 4.33Å; L316-Y355 HydrophobicContact CD2-CD1 4.12Å; L316-Y355 HydrophobicContact CD2-CE1 4.29Å; L316-Y355 HydrophobicContact CD2-CG 4.41Å; L316-Y355 WeakPolarHBondContact O-CE2 3.4Å; F317-Y355 HydrophobicContact CD1-CD2 4.12Å; F317-Y355 HydrophobicContact CE1-CD2 4.04Å; A351-Y355 WeakPolarHBondContact O-CB 3.39Å; A351-Y355 PolarHBondContact O-N 3.3Å; Y355-Q357 PolarHBondContact O-N 3.48Å; Y355-T358 WeakPolarHBondContact CA-OG1 3.28Å; Y355-T358 PolarHBondContact O-N 3.12Å; Y355-T358 PolarHBondContact O-OG1 3.24Å; Y355-T358 VanDerWaalsContact O-OG1 3.1Å; Y355-I359 HydrophobicContact CD1-CG1 4.28Å; Y355-I359 HydrophobicContact CD2-CG1 3.86Å; Y355-I359 HydrophobicContact CE1-CG1 3.92Å; Y355-I359 HydrophobicContact CE2-CD1 3.84Å; Y355-I359 HydrophobicContact CE2-CG1 3.45Å; Y355-I359 VanDerWaalsContact CE2-CG1 3.45Å; Y355-I359 HydrophobicContact CG-CG1 4.26Å; Y355-I359 WeakPolarHBondContact O-CB 3.48Å; Y355-I359 WeakPolarHBondContact O-CG1 3.48Å; Y355-I359 PolarHBondContact O-N 3.1Å
356	N	96.5	Very high	96.2	Very high	72 Å²	72	68.4 Å²	68.4	39%	0.385	32%	0.324	S	S	.	.	H	α-helix	trans	-62.3	-31.4	178.9	-74.4	-26.9	0	0	0	112.5	L352 Y354 K360	L352-N356 VanDerWaalsContact O-CB 3.28Å; L352-N356 WeakPolarHBondContact O-CB 3.35Å; L352-N356 PolarHBondContact O-N 2.89Å; L352-N356 PolarHBondContact O-ND2 2.88Å; L352-N356 VanDerWaalsContact O-ND2 3.14Å; Y354-N356 PolarHBondContact O-N 3.18Å; N356-K360 WeakPolarHBondContact O-CB 3.38Å; N356-K360 WeakPolarHBondContact O-CD 3.5Å; N356-K360 WeakPolarHBondContact O-CG 3.4Å
357	Q	94.4	Very high	96	Very high	72 Å²	72	68.4 Å²	68.4	34%	0.336	32%	0.323	S	S	.	.	H	α-helix	trans	-74.4	-49.3	176.3	-179.4	177.5	-11	0	0	111.1	R353 Y354 Y355 Q361	R353-Q357 WeakPolarHBondContact O-CB 3.5Å; R353-Q357 PolarHBondContact O-N 2.99Å; R353-Q357 VanDerWaalsContact O-N 3.11Å; Y354-Q357 WeakPolarHBondContact O-CB 3.29Å; Y354-Q357 PolarHBondContact O-N 2.86Å; Y354-Q357 VanDerWaalsContact O-N 3.11Å; Y355-Q357 PolarHBondContact O-N 3.48Å; Q357-Q361 WeakPolarHBondContact O-CB 3.34Å; Q357-Q361 WeakPolarHBondContact O-CG 3.48Å; Q357-Q361 PolarHBondContact O-N 2.94Å
358	T	95.4	Very high	95.8	Very high	6 Å²	6	67.9 Å²	67.9	4%	0.037	32%	0.321	C	S	.	.	H	α-helix	trans	-67.5	-42.5	-176.3	51.5	0	0	0	0	112.2	Y233 Y354 Y355 Q361 K362	Y233-T358 HydrophobicContact CE1-CG2 4.37Å; Y233-T358 HydrophobicContact CE2-CG2 4.45Å; Y233-T358 WeakPolarHBondContact OH-CG2 3.47Å; Y354-T358 HydrophobicContact CD1-CG2 4.33Å; Y354-T358 HydrophobicContact CD2-CG2 4.14Å; Y354-T358 HydrophobicContact CE1-CG2 3.91Å; Y354-T358 HydrophobicContact CE2-CG2 3.69Å; Y354-T358 HydrophobicContact CG-CG2 4.44Å; Y354-T358 PolarHBondContact O-N 3.47Å; Y354-T358 PolarHBondContact O-OG1 3.41Å; Y354-T358 VanDerWaalsContact O-OG1 3.14Å; Y355-T358 WeakPolarHBondContact CA-OG1 3.28Å; Y355-T358 PolarHBondContact O-N 3.12Å; Y355-T358 PolarHBondContact O-OG1 3.24Å; Y355-T358 VanDerWaalsContact O-OG1 3.1Å; T358-Q361 PolarHBondContact O-N 3.49Å; T358-K362 WeakPolarHBondContact O-CG 3.34Å; T358-K362 PolarHBondContact O-N 3.23Å
359	I	95.4	Very high	95.4	Very high	48 Å²	48	69.2 Å²	69.2	25%	0.246	33%	0.329	C	S	.	.	H	α-helix	trans	-61.3	-49.5	176.9	-72.6	-66.7	0	0	0	110.8	Y355 Q361 K362 E363	Y355-I359 HydrophobicContact CD1-CG1 4.28Å; Y355-I359 HydrophobicContact CD2-CG1 3.86Å; Y355-I359 HydrophobicContact CE1-CG1 3.92Å; Y355-I359 HydrophobicContact CE2-CD1 3.84Å; Y355-I359 HydrophobicContact CE2-CG1 3.45Å; Y355-I359 VanDerWaalsContact CE2-CG1 3.45Å; Y355-I359 HydrophobicContact CG-CG1 4.26Å; Y355-I359 WeakPolarHBondContact O-CB 3.48Å; Y355-I359 WeakPolarHBondContact O-CG1 3.48Å; Y355-I359 PolarHBondContact O-N 3.1Å; I359-Q361 VanDerWaalsContact C-N 3.25Å; I359-Q361 PolarHBondContact O-N 3.45Å; I359-K362 PolarHBondContact O-N 3.31Å; I359-K362 VanDerWaalsContact O-N 3.09Å; I359-E363 HydrophobicContact CG2-CG 4.08Å; I359-E363 VanDerWaalsContact CG2-OE1 3.29Å; I359-E363 WeakPolarHBondContact CG2-OE1 3.36Å; I359-E363 WeakPolarHBondContact O-CB 3.44Å; I359-E363 WeakPolarHBondContact O-CG 3.27Å; I359-E363 PolarHBondContact O-N 3.45Å
360	K	94.8	Very high	95.1	Very high	141 Å²	141	69 Å²	69	61%	0.613	32%	0.322	S	S	*	.	H	α-helix	trans	-61.3	-35	178.2	-72.9	-179.4	-178.6	-173.5	0	112.8	N356 M364	N356-K360 WeakPolarHBondContact O-CB 3.38Å; N356-K360 WeakPolarHBondContact O-CD 3.5Å; N356-K360 WeakPolarHBondContact O-CG 3.4Å; K360-M364 WeakPolarHBondContact O-CB 3.06Å; K360-M364 PolarHBondContact O-N 3.09Å
361	Q	94.7	Very high	94.6	Very high	25 Å²	25	73.8 Å²	73.8	12%	0.117	34%	0.339	C	S	.	.	H	α-helix	trans	-66.6	-43.5	174.8	-74.5	170.6	-22.8	0	0	111.4	Y233 V268 Q357 T358 I359 L365	Y233-Q361 PolarHBondContact OH-OE1 2.96Å; Y233-Q361 VanDerWaalsContact OH-OE1 3.06Å; V268-Q361 HydrophobicContact CG2-CB 3.96Å; Q357-Q361 WeakPolarHBondContact O-CB 3.34Å; Q357-Q361 WeakPolarHBondContact O-CG 3.48Å; Q357-Q361 PolarHBondContact O-N 2.94Å; T358-Q361 PolarHBondContact O-N 3.49Å; I359-Q361 VanDerWaalsContact C-N 3.25Å; I359-Q361 PolarHBondContact O-N 3.45Å; Q361-L365 WeakPolarHBondContact O-CB 3.31Å; Q361-L365 PolarHBondContact O-N 3.26Å
362	K	95.7	Very high	93.8	Very high	86 Å²	86	77.7 Å²	77.7	37%	0.374	36%	0.36	S	S	.	.	H	α-helix	trans	-66.1	-47.8	177.1	-71.5	174.6	-175.8	175.9	0	111.8	V268 E271 T358 I359 M364 L365 E366	V268-K362 HydrophobicContact CG1-CG 3.99Å; V268-K362 HydrophobicContact CG2-CG 4.23Å; E271-K362 IonicContact OE2-NZ 2.78Å; E271-K362 PolarHBondContact OE2-NZ 3.11Å; T358-K362 WeakPolarHBondContact O-CG 3.34Å; T358-K362 PolarHBondContact O-N 3.23Å; I359-K362 PolarHBondContact O-N 3.31Å; I359-K362 VanDerWaalsContact O-N 3.09Å; K362-M364 VanDerWaalsContact C-N 3.34Å; K362-M364 PolarHBondContact O-N 3.32Å; K362-L365 PolarHBondContact O-N 3.23Å; K362-E366 PolarHBondContact O-N 3.18Å
363	E	95.6	Very high	92.4	Very high	114 Å²	114	81 Å²	81	53%	0.533	37%	0.373	S	S	.	.	H	α-helix	trans	-58.3	-43.9	175.8	-71.8	172.4	167	0	0	111.8	I359 E366 F367	I359-E363 HydrophobicContact CG2-CG 4.08Å; I359-E363 VanDerWaalsContact CG2-OE1 3.29Å; I359-E363 WeakPolarHBondContact CG2-OE1 3.36Å; I359-E363 WeakPolarHBondContact O-CB 3.44Å; I359-E363 WeakPolarHBondContact O-CG 3.27Å; I359-E363 PolarHBondContact O-N 3.45Å; E363-E366 PolarHBondContact O-N 3.17Å; E363-F367 VanDerWaalsContact O-CB 3.3Å; E363-F367 WeakPolarHBondContact O-CB 3.26Å; E363-F367 PolarHBondContact O-N 2.91Å
364	M	94.6	Very high	90.2	Very high	103 Å²	103	77.6 Å²	77.6	51%	0.507	37%	0.371	S	S	.	.	H	α-helix	trans	-69.9	-34.2	178	-175.3	63.6	65.9	0	0	112.3	L264 K360 K362 F367 A368	L264-M364 HydrophobicContact CD2-CB 3.58Å; L264-M364 HydrophobicContact CD2-CG 3.38Å; K360-M364 WeakPolarHBondContact O-CB 3.06Å; K360-M364 PolarHBondContact O-N 3.09Å; K362-M364 VanDerWaalsContact C-N 3.34Å; K362-M364 PolarHBondContact O-N 3.32Å; M364-F367 HydrophobicContact SD-CD1 4.08Å; M364-A368 WeakPolarHBondContact O-CB 3.47Å; M364-A368 PolarHBondContact O-N 2.96Å
365	L	95.1	Very high	88	Confident	23 Å²	23	84 Å²	84	12%	0.12	41%	0.405	C	S	.	.	H	α-helix	trans	-65.9	-47.4	173.8	176.7	60.8	0	0	0	110.6	L261 L264 K265 V268 Q361 K362 F367 A368 L369	L261-L365 HydrophobicContact CD1-CD1 3.5Å; L264-L365 HydrophobicContact CB-CD1 4.38Å; L264-L365 HydrophobicContact CD2-CB 4.24Å; K265-L365 HydrophobicContact CG-CD1 3.73Å; V268-L365 HydrophobicContact CB-CD2 3.99Å; V268-L365 HydrophobicContact CG1-CD2 4.08Å; V268-L365 HydrophobicContact CG2-CB 4.32Å; V268-L365 HydrophobicContact CG2-CD2 3.86Å; Q361-L365 WeakPolarHBondContact O-CB 3.31Å; Q361-L365 PolarHBondContact O-N 3.26Å; K362-L365 PolarHBondContact O-N 3.23Å; L365-F367 VanDerWaalsContact C-N 3.33Å; L365-F367 PolarHBondContact O-N 2.97Å; L365-A368 PolarHBondContact O-N 3.42Å; L365-L369 HydrophobicContact CD1-CD1 4.19Å; L365-L369 HydrophobicContact CD1-CG 4.15Å; L365-L369 HydrophobicContact CG-CD1 4.08Å; L365-L369 HydrophobicContact CG-CG 4.46Å; L365-L369 VanDerWaalsContact O-CG 3.28Å; L365-L369 WeakPolarHBondContact O-CG 3.45Å; L365-L369 PolarHBondContact O-N 3.18Å
366	E	94.4	Very high	85.6	Confident	119 Å²	119	88.5 Å²	88.5	56%	0.556	43%	0.434	S	S	*	.	H	α-helix	trans	-59.2	-45	175.6	-175.6	-179.3	178.8	0	0	111.3	K362 E363 A368 L369 N370	K362-E366 PolarHBondContact O-N 3.18Å; E363-E366 PolarHBondContact O-N 3.17Å; E366-A368 PolarHBondContact O-N 3.09Å; E366-L369 PolarHBondContact O-N 2.96Å; E366-N370 WeakPolarHBondContact O-CB 3.46Å; E366-N370 PolarHBondContact O-N 3.06Å; E366-N370 PolarHBondContact O-ND2 3.38Å
367	F	93.6	Very high	83.3	Confident	108 Å²	108	94.4 Å²	94.4	47%	0.474	46%	0.459	S	S	.	.	H	α-helix	trans	-55.5	-51.8	171.9	177.2	-92.1	0	0	0	111.2	E363 M364 L365 L369 N370 Y371	E363-F367 VanDerWaalsContact O-CB 3.3Å; E363-F367 WeakPolarHBondContact O-CB 3.26Å; E363-F367 PolarHBondContact O-N 2.91Å; M364-F367 HydrophobicContact SD-CD1 4.08Å; L365-F367 VanDerWaalsContact C-N 3.33Å; L365-F367 PolarHBondContact O-N 2.97Å; F367-L369 VanDerWaalsContact C-N 3.34Å; F367-L369 PolarHBondContact O-N 3.14Å; F367-N370 PolarHBondContact O-N 3.13Å; F367-Y371 HydrophobicContact CD1-CD2 4.47Å; F367-Y371 AromaticContact CD2-CD2 3.83Å; F367-Y371 HydrophobicContact CD2-CD2 3.83Å; F367-Y371 AromaticContact CD2-CE2 3.47Å; F367-Y371 HydrophobicContact CD2-CE2 3.47Å; F367-Y371 VanDerWaalsContact CD2-CE2 3.47Å; F367-Y371 HydrophobicContact CE1-CD2 4.3Å; F367-Y371 AromaticContact CE2-CD2 3.65Å; F367-Y371 HydrophobicContact CE2-CD2 3.65Å; F367-Y371 AromaticContact CE2-CE2 3.15Å; F367-Y371 HydrophobicContact CE2-CE2 3.15Å; F367-Y371 AromaticContact CE2-CZ 3.73Å; F367-Y371 HydrophobicContact CG-CD2 4.24Å; F367-Y371 HydrophobicContact CG-CE2 4.32Å; F367-Y371 AromaticContact CZ-CD2 3.89Å; F367-Y371 HydrophobicContact CZ-CD2 3.89Å; F367-Y371 AromaticContact CZ-CE2 3.77Å; F367-Y371 HydrophobicContact CZ-CE2 3.77Å; F367-Y371 HydrophobicContact CZ-CG 4.42Å; F367-Y371 VanDerWaalsContact O-CD2 3.25Å; F367-Y371 WeakPolarHBondContact O-CD2 3.38Å; F367-Y371 PolarHBondContact O-N 3.1Å
368	A	91.9	Very high	80.8	Confident	17 Å²	17	99 Å²	99	14%	0.14	48%	0.481	C	S	.	.	H	α-helix	trans	-61.1	-42.2	-179.3	0	0	0	0	0	112.2	L261 M364 L365 E366 Y371 L372	L261-A368 HydrophobicContact CD1-CB 3.82Å; M364-A368 WeakPolarHBondContact O-CB 3.47Å; M364-A368 PolarHBondContact O-N 2.96Å; L365-A368 PolarHBondContact O-N 3.42Å; E366-A368 PolarHBondContact O-N 3.09Å; A368-Y371 PolarHBondContact O-N 2.7Å; A368-L372 HydrophobicContact CB-CD1 4.25Å; A368-L372 WeakPolarHBondContact O-CB 3.35Å; A368-L372 VanDerWaalsContact O-CG 3.27Å; A368-L372 WeakPolarHBondContact O-CG 3.39Å; A368-L372 PolarHBondContact O-N 2.98Å
369	L	91.1	Very high	78.1	Confident	53 Å²	53	105.1 Å²	105.1	28%	0.277	52%	0.518	S	S	.	.	H	α-helix	trans	-63.2	-44.7	177.7	-66.1	171.9	0	0	0	111.2	L261 L365 E366 F367 Y371 H373	L261-L369 HydrophobicContact CD1-CD2 4.12Å; L261-L369 HydrophobicContact CD1-CG 4.5Å; L261-L369 HydrophobicContact CD2-CD2 4.49Å; L365-L369 HydrophobicContact CD1-CD1 4.19Å; L365-L369 HydrophobicContact CD1-CG 4.15Å; L365-L369 HydrophobicContact CG-CD1 4.08Å; L365-L369 HydrophobicContact CG-CG 4.46Å; L365-L369 VanDerWaalsContact O-CG 3.28Å; L365-L369 WeakPolarHBondContact O-CG 3.45Å; L365-L369 PolarHBondContact O-N 3.18Å; E366-L369 PolarHBondContact O-N 2.96Å; F367-L369 VanDerWaalsContact C-N 3.34Å; F367-L369 PolarHBondContact O-N 3.14Å; L369-Y371 VanDerWaalsContact C-N 3.27Å; L369-Y371 PolarHBondContact O-N 3.22Å; L369-H373 WeakPolarHBondContact CD2-CD2 3.08Å; L369-H373 WeakPolarHBondContact CD2-NE2 3.44Å; L369-H373 VanDerWaalsContact O-CB 3.23Å; L369-H373 WeakPolarHBondContact O-CB 3.48Å; L369-H373 PolarHBondContact O-N 3.21Å
370	N	90.1	Very high	75.4	Confident	100 Å²	100	108.3 Å²	108.3	54%	0.535	54%	0.539	S	S	.	.	H	α-helix	trans	-63.8	-28.5	-179	-71.8	-20.3	0	0	0	114	E366 F367 T374	E366-N370 WeakPolarHBondContact O-CB 3.46Å; E366-N370 PolarHBondContact O-N 3.06Å; E366-N370 PolarHBondContact O-ND2 3.38Å; F367-N370 PolarHBondContact O-N 3.13Å; N370-T374 WeakPolarHBondContact O-CG2 3.47Å
371	Y	86	Confident	72.5	Confident	158 Å²	158	104.5 Å²	104.5	62%	0.62	53%	0.53	S	S	*	.	H	α-helix	trans	-100.6	-21.6	-178	-77.2	-95	0	0	0	114.2	F367 A368 L369 T374	F367-Y371 HydrophobicContact CD1-CD2 4.47Å; F367-Y371 AromaticContact CD2-CD2 3.83Å; F367-Y371 HydrophobicContact CD2-CD2 3.83Å; F367-Y371 AromaticContact CD2-CE2 3.47Å; F367-Y371 HydrophobicContact CD2-CE2 3.47Å; F367-Y371 VanDerWaalsContact CD2-CE2 3.47Å; F367-Y371 HydrophobicContact CE1-CD2 4.3Å; F367-Y371 AromaticContact CE2-CD2 3.65Å; F367-Y371 HydrophobicContact CE2-CD2 3.65Å; F367-Y371 AromaticContact CE2-CE2 3.15Å; F367-Y371 HydrophobicContact CE2-CE2 3.15Å; F367-Y371 AromaticContact CE2-CZ 3.73Å; F367-Y371 HydrophobicContact CG-CD2 4.24Å; F367-Y371 HydrophobicContact CG-CE2 4.32Å; F367-Y371 AromaticContact CZ-CD2 3.89Å; F367-Y371 HydrophobicContact CZ-CD2 3.89Å; F367-Y371 AromaticContact CZ-CE2 3.77Å; F367-Y371 HydrophobicContact CZ-CE2 3.77Å; F367-Y371 HydrophobicContact CZ-CG 4.42Å; F367-Y371 VanDerWaalsContact O-CD2 3.25Å; F367-Y371 WeakPolarHBondContact O-CD2 3.38Å; F367-Y371 PolarHBondContact O-N 3.1Å; A368-Y371 PolarHBondContact O-N 2.7Å; L369-Y371 VanDerWaalsContact C-N 3.27Å; L369-Y371 PolarHBondContact O-N 3.22Å; Y371-T374 PolarHBondContact O-OG1 3.19Å
372	L	81.9	Confident	69.8	Low	82 Å²	82	108.8 Å²	108.8	43%	0.429	56%	0.56	S	S	.	*	H	α-helix	trans	-101.4	-19.7	-179	-61.2	171.2	0	0	0	113	A257 L261 A368	A257-L372 HydrophobicContact CB-CD1 3.96Å; A257-L372 HydrophobicContact CB-CD2 3.96Å; L261-L372 HydrophobicContact CD2-CD1 4.28Å; A368-L372 HydrophobicContact CB-CD1 4.25Å; A368-L372 WeakPolarHBondContact O-CB 3.35Å; A368-L372 VanDerWaalsContact O-CG 3.27Å; A368-L372 WeakPolarHBondContact O-CG 3.39Å; A368-L372 PolarHBondContact O-N 2.98Å
373	H	67.8	Low	67.2	Low	136 Å²	136	112.5 Å²	112.5	63%	0.63	58%	0.579	S	S	*	*	S	Bend	trans	-89.6	6.2	175.5	-82.9	-71.1	0	0	0	114.6	L369 D375	L369-H373 WeakPolarHBondContact CD2-CD2 3.08Å; L369-H373 WeakPolarHBondContact CD2-NE2 3.44Å; L369-H373 VanDerWaalsContact O-CB 3.23Å; L369-H373 WeakPolarHBondContact O-CB 3.48Å; L369-H373 PolarHBondContact O-N 3.21Å; H373-D375 PolarHBondContact O-N 2.78Å
374	T	51.4	Low	64.5	Low	91 Å²	91	116.4 Å²	116.4	56%	0.558	60%	0.597	S	S	*	*	S	Bend	trans	-84.1	115.5	176.1	49.9	0	0	0	0	111.3	N370 Y371	N370-T374 WeakPolarHBondContact O-CG2 3.47Å; Y371-T374 PolarHBondContact O-OG1 3.19Å
375	D	49.6	Very low	61.7	Low	141 Å²	141	115.8 Å²	115.8	75%	0.754	61%	0.609	S	S	*	*	S	Bend	trans	88.7	47.1	153.4	-51.3	-21.4	0	0	0	120.8	H373	H373-D375 PolarHBondContact O-N 2.78Å
376	D	46.9	Very low	58.6	Low	164 Å²	164	118.7 Å²	118.7	88%	0.877	64%	0.636	S	S	*	*	S	Bend	trans	-109.2	6.1	158.7	-81	-32.3	0	0	0	113.7
377	E	50	Low	55.6	Low	195 Å²	195	119.8 Å²	119.8	91%	0.911	65%	0.651	S	S	*	*	S	Bend	trans	-119.6	44	177.7	-76.2	-107.5	168.7	0	0	112.1
378	E	41.7	Very low	52.6	Low	170 Å²	170	119 Å²	119	79%	0.794	66%	0.659	S	S	*	*			trans	-139	51.3	159	-147.3	176.9	-156.6	0	0	110.9	V380	E378-V380 PolarHBondContact O-N 3.32Å
379	V	37.4	Very low	49.7	Very low	134 Å²	134	127 Å²	127	81%	0.812	69%	0.693	S	S	*	*			trans	-79.5	97.5	154.4	-177.6	0	0	0	0	106.3	S381	V379-S381 PolarHBondContact O-N 3.36Å
380	V	38.5	Very low	46.7	Very low	114 Å²	114	130 Å²	130	69%	0.691	72%	0.719	S	S	*	*			trans	-52.1	106.7	169.6	-179.9	0	0	0	0	108.3	E378	E378-V380 PolarHBondContact O-N 3.32Å
381	S	34	Very low	44	Very low	61 Å²	61	134.1 Å²	134.1	43%	0.427	74%	0.735	S	S	.	*			trans	-61.8	130.4	171.3	-180	0	0	0	0	108.4	V379 E383	V379-S381 PolarHBondContact O-N 3.36Å; S381-E383 PolarHBondContact O-N 3.26Å; S381-E383 PolarHBondContact OG-OE2 3.05Å
382	P	37.9	Very low	41.4	Very low	115 Å²	115	135 Å²	135	75%	0.747	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-64	3.3	175.6	-20.8	32.4	0	0	0	115.1	E384 A385	P382-E384 VanDerWaalsContact C-N 3.3Å; P382-E384 PolarHBondContact O-N 3.11Å; P382-A385 PolarHBondContact O-N 3.12Å
383	E	41.1	Very low	39.3	Very low	164 Å²	164	136.1 Å²	136.1	77%	0.766	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-79.3	-3.8	-171.6	-74.8	177.8	147.3	0	0	115.2	S381 A385	S381-E383 PolarHBondContact O-N 3.26Å; S381-E383 PolarHBondContact OG-OE2 3.05Å; E383-A385 PolarHBondContact O-N 3.19Å
384	E	39.4	Very low	37.6	Very low	196 Å²	196	136.9 Å²	136.9	92%	0.916	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-76.4	6.3	168.1	-68.5	-168.2	154.2	0	0	113.9	P382	P382-E384 VanDerWaalsContact C-N 3.3Å; P382-E384 PolarHBondContact O-N 3.11Å
385	A	36.7	Very low	37.3	Very low	90 Å²	90	137.3 Å²	137.3	74%	0.744	78%	0.778	S	S	*	*	G	3₁₀ helix	trans	-108.8	5.7	-179.2	0	0	0	0	0	116.2	P382 E383	P382-A385 PolarHBondContact O-N 3.12Å; E383-A385 PolarHBondContact O-N 3.19Å
386	A	28.8	Very low	36.8	Very low	85 Å²	85	139 Å²	139	70%	0.702	78%	0.781	S	S	*	*			trans	-139.2	64.6	-175.3	0	0	0	0	0	115.3	S388	A386-S388 PolarHBondContact O-N 3.44Å
387	T	32.3	Very low	36.2	Very low	141 Å²	141	140.7 Å²	140.7	87%	0.865	78%	0.781	S	S	*	*			trans	-68.8	106.6	148.3	42.5	0	0	0	0	110.1
388	S	31	Very low	35.9	Very low	93 Å²	93	141.1 Å²	141.1	65%	0.65	78%	0.783	S	S	*	*			trans	176.4	125.2	140.9	63.3	0	0	0	0	114.2	A386	A386-S388 PolarHBondContact O-N 3.44Å
389	H	29.4	Very low	35.5	Very low	184 Å²	184	135.7 Å²	135.7	85%	0.852	77%	0.773	S	S	*	*			trans	72.2	139.9	161.9	-55.8	-63.9	0	0	0	116.8
390	S	29.5	Very low	35.3	Very low	116 Å²	116	136.2 Å²	136.2	81%	0.811	77%	0.769	S	S	*	*			cis	-167.8	169.8	-1.2	50.1	0	0	0	0	108.1
391	E	33.9	Very low	35.1	Very low	187 Å²	187	132.7 Å²	132.7	87%	0.874	76%	0.757	S	S	*	*			trans	-50.7	150.7	-175.5	-60.8	168.3	152.7	0	0	118.1
392	H	31.3	Very low	34.9	Very low	177 Å²	177	134.6 Å²	134.6	82%	0.819	76%	0.762	S	S	*	*			trans	-3.5	163.1	155.6	-89.5	-65	0	0	0	121
393	P	36.9	Very low	34.9	Very low	104 Å²	104	139.1 Å²	139.1	68%	0.675	77%	0.766	S	S	*	*			cis	-141.1	163.1	29.7	39.5	-19.7	0	0	0	116
394	D	32.8	Very low	34.9	Very low	152 Å²	152	140 Å²	140	81%	0.813	77%	0.769	S	S	*	*			trans	171.5	70.4	144.9	-84.8	-9.7	0	0	0	108.4	E396	D394-E396 VanDerWaalsContact C-N 3.34Å; D394-E396 PolarHBondContact O-N 2.76Å
395	A	45.3	Very low	34.8	Very low	100 Å²	100	137.5 Å²	137.5	83%	0.826	76%	0.758	S	S	*	*			trans	-84.6	78.6	164.3	0	0	0	0	0	107.8
396	E	39.2	Very low	34.8	Very low	176 Å²	176	138.1 Å²	138.1	82%	0.822	76%	0.757	S	S	*	*			trans	-151.1	27	175	-137.3	177.5	-158.9	0	0	114.9	D394	D394-E396 VanDerWaalsContact C-N 3.34Å; D394-E396 PolarHBondContact O-N 2.76Å
397	F	34.3	Very low	35.2	Very low	200 Å²	200	138 Å²	138	88%	0.877	74%	0.741	S	S	*	*			trans	-143.6	50.3	170	-131.9	-92.6	0	0	0	113.4	G399	F397-G399 VanDerWaalsContact C-N 3.29Å; F397-G399 PolarHBondContact O-N 3.18Å
398	E	41.7	Very low	35.5	Very low	204 Å²	204	135.1 Å²	135.1	95%	0.953	72%	0.72	S	S	*	*			trans	-83.4	81.2	155.5	-74.5	-175.5	178.2	0	0	108.6
399	G	35.1	Very low	35.8	Very low	57 Å²	57	133.8 Å²	133.8	59%	0.588	71%	0.714	S	S	*	*			trans	-120.1	77.5	166.1	0	0	0	0	0	108.4	F397 G401	F397-G399 VanDerWaalsContact C-N 3.29Å; F397-G399 PolarHBondContact O-N 3.18Å; G399-G401 PolarHBondContact O-N 3.14Å
400	I	33.3	Very low	36.4	Very low	144 Å²	144	132.8 Å²	132.8	74%	0.738	71%	0.71	S	S	*	*			trans	-68.8	113.5	173.7	-119.9	149.8	0	0	0	107.8	D402	I400-D402 HydrophobicContact CG2-CB 4.4Å; I400-D402 VanDerWaalsContact CG2-OD2 3.26Å; I400-D402 WeakPolarHBondContact CG2-OD2 3.28Å; I400-D402 PolarHBondContact O-N 3.01Å
401	G	32.4	Very low	37.2	Very low	41 Å²	41	131 Å²	131	42%	0.423	69%	0.685	S	S	.	*			trans	-83.2	87.6	168.3	0	0	0	0	0	108.7	G399 Y403	G399-G401 PolarHBondContact O-N 3.14Å; G401-Y403 VanDerWaalsContact O-CD2 3.22Å; G401-Y403 WeakPolarHBondContact O-CD2 3.38Å; G401-Y403 WeakPolarHBondContact O-CE2 3.22Å; G401-Y403 PolarHBondContact O-N 3.13Å
402	D	31.6	Very low	37.4	Very low	100 Å²	100	130.1 Å²	130.1	54%	0.535	67%	0.674	S	S	.	*			trans	-84.3	88.9	168.9	-75.6	-24.2	0	0	0	109.3	I400 E404	I400-D402 HydrophobicContact CG2-CB 4.4Å; I400-D402 VanDerWaalsContact CG2-OD2 3.26Å; I400-D402 WeakPolarHBondContact CG2-OD2 3.28Å; I400-D402 PolarHBondContact O-N 3.01Å; D402-E404 PolarHBondContact O-N 3.22Å
403	Y	37.8	Very low	37.6	Very low	211 Å²	211	130 Å²	130	83%	0.827	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	36.3	174.1	-38.8	-86.4	0	0	0	112.5	G401	G401-Y403 VanDerWaalsContact O-CD2 3.22Å; G401-Y403 WeakPolarHBondContact O-CD2 3.38Å; G401-Y403 WeakPolarHBondContact O-CE2 3.22Å; G401-Y403 PolarHBondContact O-N 3.13Å
404	E	40	Very low	37.5	Very low	181 Å²	181	133.6 Å²	133.6	85%	0.846	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.6	-4.1	173.9	-73.1	-163	162.8	0	0	115.2	D402	D402-E404 PolarHBondContact O-N 3.22Å
405	E	38	Very low	37.7	Very low	144 Å²	144	132.3 Å²	132.3	67%	0.673	68%	0.682	S	S	*	*	S	Bend	trans	-100.1	-4.5	-176.7	-64.5	-154.8	151.1	0	0	115.3	F407	E405-F407 PolarHBondContact O-N 3.25Å
406	S	35.4	Very low	37.4	Very low	104 Å²	104	137.4 Å²	137.4	73%	0.727	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-11.6	-171.1	-55	0	0	0	0	115.2
407	F	37.1	Very low	37.2	Very low	83 Å²	83	133.7 Å²	133.7	36%	0.364	68%	0.678	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.4	-18.9	-177	-143	-87.1	0	0	0	114	Q53 W55 E405	Q53-F407 HydrophobicContact CG-CE2 4.49Å; Q53-F407 HydrophobicContact CG-CZ 3.78Å; W55-F407 HydrophobicContact CH2-CE1 4.09Å; W55-F407 HydrophobicContact CH2-CZ 4.39Å; E405-F407 PolarHBondContact O-N 3.25Å
408	L	38.6	Very low	37.4	Very low	80 Å²	80	133.4 Å²	133.4	42%	0.419	68%	0.677	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.1	-11.9	179.6	-76	161.8	0	0	0	113.2	Y173	Y173-L408 HydrophobicContact CE2-CD2 4.34Å
409	A	37.8	Very low	37.2	Very low	65 Å²	65	134.9 Å²	134.9	54%	0.537	67%	0.674	S	S	.	*	G	3₁₀ helix	trans	-79.7	-20.4	-176.2	0	0	0	0	0	114.2	W411	A409-W411 VanDerWaalsContact C-N 3.29Å; A409-W411 PolarHBondContact O-N 2.78Å
410	E	42.1	Very low	37.1	Very low	162 Å²	162	139.9 Å²	139.9	76%	0.757	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-76.7	-10	-177.1	-78.4	-171.9	157.1	0	0	114.5
411	W	46.8	Very low	37.5	Very low	78 Å²	78	137.9 Å²	137.9	30%	0.295	69%	0.692	S	S	.	*	G	3₁₀ helix	trans	-87.8	-5.6	-178	-169.8	41.1	0	0	0	114.5	Y173 N177 A409 Q413	Y173-W411 HydrophobicContact CD2-CZ3 4.28Å; Y173-W411 AromaticContact CE2-CE3 3.7Å; Y173-W411 HydrophobicContact CE2-CE3 3.7Å; Y173-W411 AromaticContact CE2-CZ3 3.48Å; Y173-W411 HydrophobicContact CE2-CZ3 3.48Å; Y173-W411 VanDerWaalsContact CE2-CZ3 3.48Å; Y173-W411 AromaticContact CZ-CE3 3.99Å; Y173-W411 AromaticContact CZ-CZ3 3.79Å; N177-W411 WeakPolarHBondContact OD1-CH2 3.28Å; N177-W411 WeakPolarHBondContact OD1-CZ3 3.37Å; A409-W411 VanDerWaalsContact C-N 3.29Å; A409-W411 PolarHBondContact O-N 2.78Å; W411-Q413 PolarHBondContact O-N 3.38Å
412	W	38.3	Very low	37.6	Very low	170 Å²	170	139.4 Å²	139.4	64%	0.644	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-89.5	7.9	-173.4	-69.5	93.6	0	0	0	115.4	K176	K176-W412 VanDerWaalsContact NZ-CH2 3.32Å
413	Q	34.3	Very low	37.8	Very low	174 Å²	174	143.7 Å²	143.7	81%	0.813	72%	0.724	S	S	*	*	S	Bend	trans	-98.5	110.3	173	-62.3	-161.6	0.9	0	0	110	W411	W411-Q413 PolarHBondContact O-N 3.38Å
414	E	35.7	Very low	37.9	Very low	180 Å²	180	143.3 Å²	143.3	84%	0.841	73%	0.73	S	S	*	*			trans	-47.3	133.1	164.9	-68.2	-180	162.2	0	0	109.3	K416	E414-K416 PolarHBondContact O-N 2.97Å; E414-K416 VanDerWaalsContact O-N 3.11Å
415	P	36.7	Very low	37.9	Very low	124 Å²	124	139 Å²	139	81%	0.805	73%	0.726	S	S	*	*			trans	-63.6	119.8	172.5	6.6	-0.5	0	0	0	107.9	S417	P415-S417 PolarHBondContact O-N 3.19Å
416	K	39.6	Very low	37.8	Very low	208 Å²	208	143.8 Å²	143.8	90%	0.904	76%	0.756	S	S	*	*			trans	-51.1	106	172.3	-71.4	-175.3	178.9	-179.3	0	108.8	E414 K418	E414-K416 PolarHBondContact O-N 2.97Å; E414-K416 VanDerWaalsContact O-N 3.11Å; K416-K418 PolarHBondContact O-N 3.2Å
417	S	34	Very low	38	Very low	97 Å²	97	145.8 Å²	145.8	68%	0.678	76%	0.757	S	S	*	*			trans	-64.7	129.1	171.1	54.2	0	0	0	0	107.8	P415 W419	P415-S417 PolarHBondContact O-N 3.19Å; S417-W419 PolarHBondContact O-N 3.36Å
418	K	39.2	Very low	38	Very low	194 Å²	194	149.1 Å²	149.1	84%	0.843	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	57.4	-172.7	-165.9	-174.6	-176.4	179.2	0	110.7	K416	K416-K418 PolarHBondContact O-N 3.2Å
419	W	36.8	Very low	38	Very low	235 Å²	235	152.9 Å²	152.9	89%	0.89	80%	0.798	S	S	*	*	T	Hydrogen-bonded Turn	trans	-150	13.5	178	-77.4	108.2	0	0	0	118.1	S417 A421	S417-W419 PolarHBondContact O-N 3.36Å; W419-A421 PolarHBondContact O-N 3.34Å
420	D	34.4	Very low	38	Very low	163 Å²	163	158.1 Å²	158.1	87%	0.872	81%	0.813	S	S	*	*			trans	-98.9	76.1	168.6	-75.6	-14.1	0	0	0	111.2	G422	D420-G422 PolarHBondContact O-N 3.48Å
421	A	40.1	Very low	37.7	Very low	102 Å²	102	157.8 Å²	157.8	84%	0.843	82%	0.817	S	S	*	*			trans	-87.3	86.1	153.2	0	0	0	0	0	107.1	W419	W419-A421 PolarHBondContact O-N 3.34Å
422	G	35.7	Very low	37.1	Very low	72 Å²	72	163.1 Å²	163.1	74%	0.742	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-84.6	123.7	170.7	0	0	0	0	0	110.2	D420	D420-G422 PolarHBondContact O-N 3.48Å
423	E	36.3	Very low	37.1	Very low	190 Å²	190	162.6 Å²	162.6	89%	0.888	87%	0.866	S	S	*	*	P	Polyproline II helix	trans	-52.5	138.3	-176.5	-66.7	163.7	142.3	0	0	114
424	E	38.8	Very low	37.3	Very low	203 Å²	203	161.8 Å²	161.8	95%	0.949	87%	0.87	S	S	*	*	P	Polyproline II helix	trans	-71.6	124.6	160.1	-72.5	-178.8	162.1	0	0	108.7
425	A	39.5	Very low	37.4	Very low	92 Å²	92	160.3 Å²	160.3	76%	0.76	87%	0.873	S	S	*	*			trans	-119.5	113.3	166.1	0	0	0	0	0	109
426	D	37.8	Very low	37.5	Very low	243 Å²	243	163.5 Å²	163.5	100%	1.299	88%	0.879	S	S	*	*			trans	54.3	0	164.8	-67.6	-19.3	0	0	0	121.3

Retrieved 426 of 426 residues in 195.9 ms (Link to these results)

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