A0A096NF31_PAPAN Loading...

Deoxyguanosine kinase

AlphaFold DB (H9Z107), UniProt , Accession A0A096NF31, Species PAPAN (Papio anubis, Olive baboon), Gene DGUOK, Length 277 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.4	Very low	38	Very low	250 Å²	250	169 Å²	169	100%	1.232	91%	0.905	S	S	*	*				0	100.6	0	-75	-165.4	-84.3	0	0	107.6
2	A	36.5	Very low	37.9	Very low	103 Å²	103	176.2 Å²	176.2	85%	0.851	91%	0.909	S	S	*	*			trans	-114.4	164.1	-172.5	0	0	0	0	0	110.2
3	A	33.8	Very low	37.8	Very low	107 Å²	107	169 Å²	169	88%	0.884	89%	0.892	S	S	*	*			trans	82.1	105.2	-176.9	0	0	0	0	0	113.6
4	G	31.8	Very low	37.4	Very low	72 Å²	72	165 Å²	165	74%	0.742	88%	0.881	S	S	*	*			cis	114.1	83.9	23.5	0	0	0	0	0	108.3	L6	G4-L6 PolarHBondContact O-N 2.69Å; G4-L6 VanDerWaalsContact O-N 3.11Å
5	R	44.8	Very low	37.4	Very low	253 Å²	253	168.9 Å²	168.9	96%	0.955	89%	0.888	S	S	*	*			trans	-49.7	107.4	175.1	-67.7	173.1	176.5	-171.3	-2.5	111
6	L	42.4	Very low	37.4	Very low	153 Å²	153	165.1 Å²	165.1	80%	0.801	88%	0.879	S	S	*	*			trans	-162.6	84.7	167.3	-101.6	162.3	0	0	0	107.3	G4	G4-L6 PolarHBondContact O-N 2.69Å; G4-L6 VanDerWaalsContact O-N 3.11Å
7	F	36.4	Very low	37.1	Very low	210 Å²	210	160.9 Å²	160.9	92%	0.921	87%	0.866	S	S	*	*			trans	179.3	79	156.4	-97.6	-67.8	0	0	0	107.7
8	L	36.9	Very low	37	Very low	180 Å²	180	161.4 Å²	161.4	94%	0.942	87%	0.865	S	S	*	*			trans	-175.6	62.9	161.7	-99.8	152	0	0	0	108.7
9	S	38	Very low	36.9	Very low	110 Å²	110	158.4 Å²	158.4	77%	0.769	86%	0.864	S	S	*	*			trans	-155.2	46.4	170.7	64.4	0	0	0	0	112.8
10	R	38	Very low	36.7	Very low	241 Å²	241	159.6 Å²	159.6	91%	0.909	86%	0.864	S	S	*	*			trans	-147.4	90.6	161.4	-73.4	-166.5	179.9	-169.7	-0.2	108.3
11	L	36.6	Very low	36.5	Very low	180 Å²	180	156.5 Å²	156.5	94%	0.942	85%	0.854	S	S	*	*			trans	177.6	65.6	157.1	-94.1	166.7	0	0	0	107.7
12	R	37.3	Very low	36.1	Very low	255 Å²	255	152.2 Å²	152.2	96%	0.962	84%	0.835	S	S	*	*			trans	-150.5	82.3	162.3	-112.9	-176.1	-178	-177.5	0.8	106.9
13	A	36.4	Very low	36.3	Very low	83 Å²	83	155.4 Å²	155.4	69%	0.686	84%	0.837	S	S	*	*			trans	-105.2	137.1	156.8	0	0	0	0	0	106.6	F15	A13-F15 PolarHBondContact O-N 2.7Å
14	P	31.8	Very low	36.3	Very low	113 Å²	113	159.5 Å²	159.5	73%	0.734	84%	0.838	S	S	*	*			trans	-69.5	122.7	177.7	-4.7	20.2	0	0	0	109.3	S16	P14-S16 PolarHBondContact O-N 3.5Å
15	F	38.3	Very low	36.5	Very low	224 Å²	224	159.6 Å²	159.6	98%	0.982	84%	0.838	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	77.6	164.9	-95.9	-94.9	0	0	0	108.9	A13	A13-F15 PolarHBondContact O-N 2.7Å
16	S	36.8	Very low	35.9	Very low	107 Å²	107	153.6 Å²	153.6	75%	0.748	83%	0.83	S	S	*	*	T	Hydrogen-bonded Turn	trans	-152.5	9.7	170.4	68.2	0	0	0	0	115.7	P14	P14-S16 PolarHBondContact O-N 3.5Å
17	S	32.8	Very low	35.4	Very low	95 Å²	95	152.1 Å²	152.1	66%	0.664	83%	0.829	S	S	*	*	S	Bend	trans	-128	-6.6	-173.3	168.8	0	0	0	0	116
18	M	34.3	Very low	35.4	Very low	170 Å²	170	151 Å²	151	84%	0.837	83%	0.825	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-12.2	-177.4	-75.8	-165.1	-157.2	0	0	115.1	Q20	M18-Q20 PolarHBondContact O-N 3.01Å
19	A	35.9	Very low	35.3	Very low	103 Å²	103	147.6 Å²	147.6	85%	0.851	82%	0.815	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-9.9	-174.9	0	0	0	0	0	114.5
20	Q	33.5	Very low	35.4	Very low	183 Å²	183	154.8 Å²	154.8	86%	0.855	83%	0.826	S	S	*	*	S	Bend	trans	-108.6	-6.1	-173.1	-81.1	179.9	-19.6	0	0	115.3	M18	M18-Q20 PolarHBondContact O-N 3.01Å
21	S	31.3	Very low	35.2	Very low	94 Å²	94	146.4 Å²	146.4	66%	0.657	81%	0.814	S	S	*	*	S	Bend	trans	-110	12.8	-173.5	73.7	0	0	0	0	115.8
22	L	33.9	Very low	35.2	Very low	160 Å²	160	145.9 Å²	145.9	84%	0.838	81%	0.812	S	S	*	*	S	Bend	trans	-95.6	11.8	-179.9	-76.6	169.5	0	0	0	114.2
23	L	41.2	Very low	35.5	Very low	170 Å²	170	141.1 Å²	141.1	89%	0.89	80%	0.8	S	S	*	*			trans	-106	11.7	-174.4	-81.4	168.1	0	0	0	115.5
24	E	33.3	Very low	35.7	Very low	194 Å²	194	141.7 Å²	141.7	91%	0.907	81%	0.805	S	S	*	*			trans	-109.4	108	177.8	-74.7	-173.4	165.6	0	0	113.1
25	G	36	Very low	36.7	Very low	73 Å²	73	139.3 Å²	139.3	75%	0.753	80%	0.801	S	S	*	*			trans	94.2	84.5	135.5	0	0	0	0	0	118
26	V	33.7	Very low	37.8	Very low	127 Å²	127	141.3 Å²	141.3	77%	0.77	80%	0.802	S	S	*	*			trans	-126.1	120	142.3	-174.8	0	0	0	0	107.5	F28	V26-F28 PolarHBondContact O-N 3.45Å; V26-F28 VanDerWaalsContact O-N 3.1Å
27	P	31.5	Very low	39.9	Very low	122 Å²	122	138.2 Å²	138.2	79%	0.792	79%	0.787	S	S	*	*			trans	-72.7	107.5	177.7	27.7	-28.7	0	0	0	108.8	S29	P27-S29 PolarHBondContact O-N 3.08Å
28	F	36.5	Very low	42.7	Very low	188 Å²	188	134.1 Å²	134.1	83%	0.825	76%	0.758	S	S	*	*			trans	-75.6	113.4	165.1	-120.7	-91	0	0	0	108.1	V26 R30	V26-F28 PolarHBondContact O-N 3.45Å; V26-F28 VanDerWaalsContact O-N 3.1Å; F28-R30 PolarHBondContact O-N 3.41Å
29	S	35.3	Very low	45.6	Very low	107 Å²	107	129.8 Å²	129.8	75%	0.748	73%	0.732	S	S	*	*			trans	-56.4	122.6	174.5	26.9	0	0	0	0	110.2	P27 G31	P27-S29 PolarHBondContact O-N 3.08Å; S29-G31 PolarHBondContact O-N 3.25Å; S29-G31 VanDerWaalsContact O-N 3.13Å
30	R	39.6	Very low	48.4	Very low	261 Å²	261	125.4 Å²	125.4	99%	0.985	69%	0.693	S	S	*	*			trans	-54.7	113.8	162.8	-83.4	179.3	169.8	-170.9	-2.9	108.8	F28	F28-R30 PolarHBondContact O-N 3.41Å
31	G	32.9	Very low	51.5	Low	65 Å²	65	116.7 Å²	116.7	67%	0.67	65%	0.653	S	S	*	*			trans	-173.3	119.2	172.9	0	0	0	0	0	110.8	S29	S29-G31 PolarHBondContact O-N 3.25Å; S29-G31 VanDerWaalsContact O-N 3.13Å
32	L	36.8	Very low	54.7	Low	170 Å²	170	112.2 Å²	112.2	89%	0.89	62%	0.621	S	S	*	*			trans	-33.7	141.2	174.8	-84.4	63.8	0	0	0	113.5	A34	L32-A34 PolarHBondContact O-N 3.32Å
33	H	44.1	Very low	57.7	Low	155 Å²	155	104.6 Å²	104.6	72%	0.718	58%	0.581	S	S	*	*			trans	-59	71.5	171	-68.7	-71.8	0	0	0	112.9	G35	H33-G35 VanDerWaalsContact C-N 3.29Å
34	A	40.8	Very low	60.5	Low	95 Å²	95	96.5 Å²	96.5	79%	0.785	54%	0.539	S	S	*	.			trans	-97.5	50.3	164	0	0	0	0	0	109.2	L32	L32-A34 PolarHBondContact O-N 3.32Å
35	G	52.3	Low	63.6	Low	63 Å²	63	87.2 Å²	87.2	65%	0.649	50%	0.496	S	S	*	.			trans	-86.2	122.4	172.4	0	0	0	0	0	110.2	H33 G37	H33-G35 VanDerWaalsContact C-N 3.29Å; G35-G37 PolarHBondContact O-N 3.47Å
36	R	61.8	Low	66.5	Low	266 Å²	266	83.9 Å²	83.9	100%	1.004	46%	0.461	S	S	*	.	S	Bend	trans	-66	19.1	177	-76.1	-175.5	173.6	-136.3	2.2	114.9
37	G	80.3	Confident	69.6	Low	42 Å²	42	78.2 Å²	78.2	43%	0.433	43%	0.426	S	S	.	.	S	Bend	trans	-103.4	169.9	-175.7	0	0	0	0	0	113.6	G35	G35-G37 PolarHBondContact O-N 3.47Å
38	P	91.6	Very high	72.6	Confident	8 Å²	8	73.3 Å²	73.3	5%	0.052	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-53.8	138.1	172.1	-25.5	35.3	0	0	0	113	R40 F126 L130 P136	P38-R40 WeakPolarHBondContact O-CG 3.41Å; P38-F126 HydrophobicContact CB-CD1 4.42Å; P38-F126 HydrophobicContact CB-CE1 4.16Å; P38-F126 HydrophobicContact CB-CZ 4.39Å; P38-F126 HydrophobicContact CG-CD1 3.91Å; P38-F126 HydrophobicContact CG-CD2 3.94Å; P38-F126 HydrophobicContact CG-CE1 3.93Å; P38-F126 HydrophobicContact CG-CE2 3.97Å; P38-F126 HydrophobicContact CG-CG 3.91Å; P38-F126 HydrophobicContact CG-CZ 3.97Å; P38-L130 HydrophobicContact CB-CD2 3.91Å; P38-L130 HydrophobicContact CB-CG 4.32Å; P38-L130 HydrophobicContact CG-CD2 3.85Å; P38-L130 HydrophobicContact CG-CG 4.12Å; P38-P136 CarbonylContact C-O 3.52Å; P38-P136 WeakPolarHBondContact CA-O 3.41Å; P38-P136 HydrophobicContact CB-CB 3.92Å; P38-P136 HydrophobicContact CB-CG 4.36Å; P38-P136 HydrophobicContact CG-CB 3.97Å; P38-P136 HydrophobicContact CG-CG 4.31Å
39	R	94.8	Very high	75.5	Confident	80 Å²	80	64.3 Å²	64.3	30%	0.302	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	128.9	166.8	-65.7	175.7	-176.5	-132.1	-22.5	107.7	L41 P136 V137 Q138 I274 L277	R39-L41 HydrophobicContact CB-CD1 4.27Å; R39-P136 PolarHBondContact N-O 2.9Å; R39-V137 HydrophobicContact CB-CG2 4.35Å; R39-V137 CarbonylContact O-C 3.55Å; R39-V137 VanDerWaalsContact O-CA 3.31Å; R39-V137 WeakPolarHBondContact O-CA 3.41Å; R39-Q138 PolarHBondContact O-N 3.16Å; R39-I274 PolarHBondContact NH1-O 3.23Å; R39-L277 PolarHBondContact NH1-O 3.33Å; R39-L277 PolarHBondContact NH2-O 3.11Å
40	R	96.2	Very high	78.4	Confident	10 Å²	10	59.9 Å²	59.9	4%	0.038	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	119	-173.3	-60.2	-178.1	75.7	-154.3	18.1	109.2	P38 Q122 Q138 F140 R183 T185 L186 H187	P38-R40 WeakPolarHBondContact O-CG 3.41Å; R40-Q122 PolarHBondContact NH2-O 3.29Å; R40-Q138 CarbonylContact C-O 3.48Å; R40-Q138 WeakPolarHBondContact CA-O 3.3Å; R40-Q138 HydrophobicContact CG-CB 4.33Å; R40-F140 HydrophobicContact CB-CE2 4.27Å; R40-R183 PolarHBondContact NH1-O 2.64Å; R40-R183 PolarHBondContact NH2-O 3.1Å; R40-T185 WeakPolarHBondContact CD-O 3.41Å; R40-T185 PolarHBondContact NH1-O 3Å; R40-T185 VanDerWaalsContact NH1-O 3.13Å; R40-L186 HydrophobicContact CB-CD2 4.12Å; R40-H187 PolarHBondContact N-ND1 2.71Å; R40-H187 PolarHBondContact O-N 2.93Å
41	L	97.6	Very high	81.1	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	154	-179.9	-60.5	90.8	0	0	0	110.6	R39 V137 Q138 I139 F140 G188 I190 F273 I274 L277	R39-L41 HydrophobicContact CB-CD1 4.27Å; L41-V137 HydrophobicContact CD1-CG1 3.71Å; L41-Q138 PolarHBondContact N-O 3.2Å; L41-I139 HydrophobicContact CB-CD1 3.84Å; L41-I139 HydrophobicContact CD1-CD1 4.05Å; L41-I139 HydrophobicContact CG-CD1 4.44Å; L41-I139 CarbonylContact O-C 3.58Å; L41-I139 WeakPolarHBondContact O-CA 3.47Å; L41-F140 WeakPolarHBondContact O-CD2 3.43Å; L41-F140 PolarHBondContact O-N 3.35Å; L41-G188 WeakPolarHBondContact CA-O 3.24Å; L41-G188 WeakPolarHBondContact CB-O 3.45Å; L41-I190 HydrophobicContact CD2-CD1 4.14Å; L41-I190 HydrophobicContact CD2-CG1 4.15Å; L41-F273 HydrophobicContact CD2-CD1 4.07Å; L41-F273 HydrophobicContact CD2-CE1 3.72Å; L41-I274 HydrophobicContact CD1-CD1 4.04Å; L41-I274 HydrophobicContact CD1-CG1 4.07Å; L41-I274 HydrophobicContact CD2-CD1 3.94Å; L41-I274 HydrophobicContact CD2-CG1 3.67Å; L41-L277 HydrophobicContact CD1-CD1 4.27Å; L41-L277 HydrophobicContact CD2-CD1 3.76Å; L41-L277 HydrophobicContact CG-CD1 4.09Å
42	S	97.9	Very high	84	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	136.7	171	-177.6	0	0	0	0	111	E44 F140 R142 S143 G188 F189 I190	S42-E44 PolarHBondContact OG-OE1 2.78Å; S42-F140 CarbonylContact C-O 3.54Å; S42-F140 WeakPolarHBondContact CA-O 3.25Å; S42-R142 WeakPolarHBondContact OG-CA 3.48Å; S42-R142 PolarHBondContact OG-O 3.15Å; S42-S143 PolarHBondContact OG-N 3.34Å; S42-G188 PolarHBondContact N-O 2.9Å; S42-F189 CarbonylContact O-C 3.58Å; S42-F189 WeakPolarHBondContact O-CA 3.26Å; S42-I190 PolarHBondContact O-N 3.25Å
43	I	98.5	Very high	86.8	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	117.3	171	-60.9	161.2	0	0	0	108	K51 F54 V55 L58 I139 F140 R142 I190 L192	I43-K51 HydrophobicContact CG2-CB 4.42Å; I43-K51 HydrophobicContact CG2-CD 4.39Å; I43-K51 HydrophobicContact CG2-CG 4.01Å; I43-F54 HydrophobicContact CD1-CD1 3.88Å; I43-F54 HydrophobicContact CD1-CE1 4.29Å; I43-F54 HydrophobicContact CG1-CD1 4.42Å; I43-F54 HydrophobicContact CG2-CD1 4.44Å; I43-V55 HydrophobicContact CD1-CG2 3.5Å; I43-L58 HydrophobicContact CD1-CD1 3.72Å; I43-I139 HydrophobicContact CD1-CG2 3.33Å; I43-I139 HydrophobicContact CG1-CG2 3.8Å; I43-F140 PolarHBondContact N-O 2.81Å; I43-R142 WeakPolarHBondContact O-CA 3.48Å; I43-R142 PolarHBondContact O-N 2.82Å; I43-I190 CarbonylContact C-O 3.6Å; I43-I190 VanDerWaalsContact CA-O 3.31Å; I43-I190 WeakPolarHBondContact CA-O 3.46Å; I43-I190 HydrophobicContact CG1-CB 4.31Å; I43-L192 HydrophobicContact CG2-CD1 3.83Å; I43-L192 HydrophobicContact CG2-CG 3.88Å
44	E	98.6	Very high	89.4	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	157.6	-178.9	-59.4	-65.5	-175.2	0	0	110.9	S42 S143 S146 F189 I190 L192 W229 L230	S42-E44 PolarHBondContact OG-OE1 2.78Å; E44-S143 VanDerWaalsContact OE1-CB 3.26Å; E44-S143 WeakPolarHBondContact OE1-CB 3.21Å; E44-S143 PolarHBondContact OE1-N 3.03Å; E44-S143 PolarHBondContact OE1-OG 3.43Å; E44-S146 VanDerWaalsContact OE2-CB 3.24Å; E44-S146 WeakPolarHBondContact OE2-CB 3.44Å; E44-S146 PolarHBondContact OE2-OG 2.88Å; E44-F189 HydrophobicContact CG-CD1 3.72Å; E44-F189 HydrophobicContact CG-CE1 4.36Å; E44-I190 PolarHBondContact N-O 3.27Å; E44-L192 PolarHBondContact O-N 2.92Å; E44-W229 HydrophobicContact CG-CH2 4.35Å; E44-W229 HydrophobicContact CG-CZ3 4.16Å; E44-L230 HydrophobicContact CB-CD1 3.51Å; E44-L230 HydrophobicContact CG-CD1 4.09Å
45	G	98.3	Very high	92	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.173	C	C	.	.			trans	151.3	166.3	176	0	0	0	0	0	113.6	K51 H226	G45-K51 PolarHBondContact O-NZ 3.21Å; G45-H226 WeakPolarHBondContact CA-NE2 3.11Å; G45-H226 PolarHBondContact N-NE2 2.91Å; G45-H226 PolarHBondContact O-NE2 3.45Å
46	N	98.3	Very high	94	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.011	17%	0.174	C	C	.	.			trans	-61.6	168.5	-172.3	-151.2	-14	0	0	0	112.8	A48 V49 K51 L219 L222	N46-A48 PolarHBondContact O-N 3.37Å; N46-V49 VanDerWaalsContact O-CG1 3.24Å; N46-V49 WeakPolarHBondContact O-CG1 3.48Å; N46-V49 PolarHBondContact O-N 3.07Å; N46-K51 PolarHBondContact O-NZ 3.4Å; N46-L219 PolarHBondContact ND2-O 3.25Å; N46-L222 WeakPolarHBondContact OD1-CB 3.35Å
47	I	97	Very high	95.7	Very high	8 Å²	8	23.1 Å²	23.1	4%	0.041	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	138.3	172	-59.9	173.4	0	0	0	108.7	V49 F151 C199 L203 I214 Y218 L219 L222	I47-V49 PolarHBondContact O-N 3Å; I47-F151 HydrophobicContact CG1-CE1 4.46Å; I47-C199 WeakPolarHBondContact O-CB 3.42Å; I47-L203 HydrophobicContact CG2-CD1 4Å; I47-I214 HydrophobicContact CD1-CD1 4.18Å; I47-Y218 HydrophobicContact CD1-CD1 4.46Å; I47-Y218 HydrophobicContact CD1-CE1 3.91Å; I47-L219 HydrophobicContact CB-CD2 3.87Å; I47-L219 HydrophobicContact CD1-CD2 4.28Å; I47-L219 HydrophobicContact CG1-CD2 4.45Å; I47-L222 HydrophobicContact CD1-CD1 3.58Å; I47-L222 HydrophobicContact CG1-CD1 3.94Å
48	A	95.8	Very high	96.4	Very high	19 Å²	19	21.1 Å²	21.1	16%	0.157	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	10.9	179.8	0	0	0	0	0	117.1	N46 G50 R202 L203	N46-A48 PolarHBondContact O-N 3.37Å; A48-G50 PolarHBondContact O-N 3.04Å; A48-G50 VanDerWaalsContact O-N 3.08Å; A48-R202 HydrophobicContact CB-CB 4.08Å; A48-R202 VanDerWaalsContact O-CB 3.24Å; A48-R202 WeakPolarHBondContact O-CB 3.23Å; A48-R202 VanDerWaalsContact O-CD 3.29Å; A48-R202 WeakPolarHBondContact O-CD 3.44Å; A48-L203 HydrophobicContact CB-CB 3.68Å; A48-L203 HydrophobicContact CB-CG 4.44Å
49	V	97.5	Very high	96.6	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.126	C	C	.	.	S	Bend	trans	-61.3	-21	178.2	73.2	0	0	0	0	113.8	N46 I47 K51 L192 A194 R202 V252	N46-V49 VanDerWaalsContact O-CG1 3.24Å; N46-V49 WeakPolarHBondContact O-CG1 3.48Å; N46-V49 PolarHBondContact O-N 3.07Å; I47-V49 PolarHBondContact O-N 3Å; V49-K51 HydrophobicContact CG1-CG 3.77Å; V49-L192 HydrophobicContact CG1-CB 4.13Å; V49-L192 HydrophobicContact CG2-CB 4.22Å; V49-L192 WeakPolarHBondContact CG2-O 3.17Å; V49-A194 HydrophobicContact CG2-CB 3.75Å; V49-R202 PolarHBondContact O-NH1 3.18Å; V49-V252 HydrophobicContact CG2-CG2 3.79Å
50	G	96.3	Very high	96.6	Very high	13 Å²	13	27 Å²	27	13%	0.134	15%	0.146	C	C	.	.	S	Bend	trans	116	15.1	179.5	0	0	0	0	0	115	A48 S52 T53 F54	A48-G50 PolarHBondContact O-N 3.04Å; A48-G50 VanDerWaalsContact O-N 3.08Å; G50-S52 PolarHBondContact O-N 2.74Å; G50-T53 WeakPolarHBondContact O-CB 3.42Å; G50-T53 PolarHBondContact O-N 3Å; G50-T53 VanDerWaalsContact O-N 3.09Å; G50-F54 WeakPolarHBondContact O-CB 3.26Å; G50-F54 PolarHBondContact O-N 3.42Å
51	K	96.6	Very high	96.5	Very high	11 Å²	11	29.2 Å²	29.2	5%	0.048	16%	0.161	C	C	.	.	H	α-helix	trans	-49.8	-52.9	179.2	-67.2	-173.3	-66.1	-70.9	0	113.3	I43 G45 N46 V49 T53 F54 V55 E141 R142 L192	I43-K51 HydrophobicContact CG2-CB 4.42Å; I43-K51 HydrophobicContact CG2-CD 4.39Å; I43-K51 HydrophobicContact CG2-CG 4.01Å; G45-K51 PolarHBondContact O-NZ 3.21Å; N46-K51 PolarHBondContact O-NZ 3.4Å; V49-K51 HydrophobicContact CG1-CG 3.77Å; K51-T53 VanDerWaalsContact C-N 3.28Å; K51-T53 PolarHBondContact O-N 3.37Å; K51-F54 WeakPolarHBondContact O-CB 3.17Å; K51-F54 PolarHBondContact O-N 3.14Å; K51-F54 VanDerWaalsContact O-N 3.15Å; K51-V55 WeakPolarHBondContact O-CB 3.41Å; K51-V55 WeakPolarHBondContact O-CG2 3.4Å; K51-V55 PolarHBondContact O-N 3.4Å; K51-E141 HydrophobicContact CB-CG 4.13Å; K51-E141 WeakPolarHBondContact CB-OE1 3.31Å; K51-E141 HydrophobicContact CD-CG 4.39Å; K51-R142 HydrophobicContact CD-CG 4.18Å; K51-L192 HydrophobicContact CG-CD1 4.17Å
52	S	93.6	Very high	96.4	Very high	46 Å²	46	30.6 Å²	30.6	32%	0.322	17%	0.166	S	C	.	.	H	α-helix	trans	-65.9	-31.2	-178.4	-35.2	0	0	0	0	112.5	G50 K56 E141	G50-S52 PolarHBondContact O-N 2.74Å; S52-K56 VanDerWaalsContact O-CG 3.31Å; S52-K56 WeakPolarHBondContact O-CG 3.36Å; S52-K56 PolarHBondContact O-N 3.05Å; S52-K56 VanDerWaalsContact O-N 3.15Å; S52-E141 PolarHBondContact N-OE1 3.3Å; S52-E141 PolarHBondContact OG-OE1 3.3Å
53	T	95.4	Very high	96.2	Very high	64 Å²	64	34.2 Å²	34.2	39%	0.393	19%	0.19	S	C	.	.	H	α-helix	trans	-67.2	-45.8	172.4	-54.5	0	0	0	0	110.9	G50 K51 V55 K56 L57 F256	G50-T53 WeakPolarHBondContact O-CB 3.42Å; G50-T53 PolarHBondContact O-N 3Å; G50-T53 VanDerWaalsContact O-N 3.09Å; K51-T53 VanDerWaalsContact C-N 3.28Å; K51-T53 PolarHBondContact O-N 3.37Å; T53-V55 PolarHBondContact O-N 3.4Å; T53-K56 WeakPolarHBondContact O-CB 3.15Å; T53-K56 PolarHBondContact O-N 2.99Å; T53-L57 PolarHBondContact O-N 3.49Å; T53-F256 HydrophobicContact CG2-CE2 3.89Å; T53-F256 HydrophobicContact CG2-CZ 4.4Å
54	F	97.4	Very high	95.9	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64	-39.7	177.5	-171.1	-100.9	0	0	0	112.5	I43 G50 K51 K56 L57 L58 I190 L192 L250 F256 L266 M267 V270	I43-F54 HydrophobicContact CD1-CD1 3.88Å; I43-F54 HydrophobicContact CD1-CE1 4.29Å; I43-F54 HydrophobicContact CG1-CD1 4.42Å; I43-F54 HydrophobicContact CG2-CD1 4.44Å; G50-F54 WeakPolarHBondContact O-CB 3.26Å; G50-F54 PolarHBondContact O-N 3.42Å; K51-F54 WeakPolarHBondContact O-CB 3.17Å; K51-F54 PolarHBondContact O-N 3.14Å; K51-F54 VanDerWaalsContact O-N 3.15Å; F54-K56 PolarHBondContact O-N 3.17Å; F54-L57 WeakPolarHBondContact O-CB 3.42Å; F54-L57 PolarHBondContact O-N 2.97Å; F54-L58 HydrophobicContact CD1-CD1 3.79Å; F54-L58 HydrophobicContact CD1-CG 4.2Å; F54-L58 HydrophobicContact CE1-CD1 3.61Å; F54-L58 HydrophobicContact CE1-CD2 4.42Å; F54-L58 HydrophobicContact CE1-CG 4.02Å; F54-L58 PolarHBondContact O-N 3.12Å; F54-I190 HydrophobicContact CE1-CG2 4.08Å; F54-I190 HydrophobicContact CZ-CG2 4.3Å; F54-L192 HydrophobicContact CB-CD1 3.68Å; F54-L192 HydrophobicContact CD1-CD1 4.12Å; F54-L192 HydrophobicContact CD1-CD2 4.17Å; F54-L192 HydrophobicContact CD2-CD1 4.43Å; F54-L192 HydrophobicContact CD2-CD2 4.09Å; F54-L192 HydrophobicContact CE1-CD2 4.16Å; F54-L192 HydrophobicContact CE2-CD2 4.09Å; F54-L192 HydrophobicContact CG-CD1 3.85Å; F54-L192 HydrophobicContact CG-CD2 4.11Å; F54-L192 HydrophobicContact CZ-CD2 4.1Å; F54-L250 HydrophobicContact CE2-CD1 3.91Å; F54-L250 HydrophobicContact CZ-CD1 3.56Å; F54-F256 HydrophobicContact CB-CE2 4.15Å; F54-F256 HydrophobicContact CB-CZ 4Å; F54-F256 HydrophobicContact CD2-CE2 4.22Å; F54-F256 HydrophobicContact CD2-CZ 4.35Å; F54-L266 HydrophobicContact CE2-CB 4.2Å; F54-L266 HydrophobicContact CE2-CD1 4.37Å; F54-M267 HydrophobicContact CD2-CE 4.15Å; F54-M267 HydrophobicContact CE2-CE 3.51Å; F54-M267 HydrophobicContact CZ-CE 3.78Å; F54-V270 HydrophobicContact CE1-CG2 4.38Å; F54-V270 HydrophobicContact CZ-CG2 3.66Å
55	V	95.8	Very high	95.7	Very high	9 Å²	9	38.9 Å²	38.9	6%	0.055	21%	0.211	C	C	.	.	H	α-helix	trans	-58.8	-44.8	172.8	158.2	0	0	0	0	111.5	I43 K51 T53 L57 L58 A59 V67 T69	I43-V55 HydrophobicContact CD1-CG2 3.5Å; K51-V55 WeakPolarHBondContact O-CB 3.41Å; K51-V55 WeakPolarHBondContact O-CG2 3.4Å; K51-V55 PolarHBondContact O-N 3.4Å; T53-V55 PolarHBondContact O-N 3.4Å; V55-L57 VanDerWaalsContact C-N 3.29Å; V55-L57 PolarHBondContact O-N 2.82Å; V55-L58 PolarHBondContact O-N 2.75Å; V55-A59 PolarHBondContact O-N 2.93Å; V55-V67 HydrophobicContact CB-CG1 4.31Å; V55-V67 HydrophobicContact CG1-CB 4.28Å; V55-V67 HydrophobicContact CG1-CG1 3.32Å; V55-V67 HydrophobicContact CG2-CG1 4.11Å; V55-T69 HydrophobicContact CG1-CG2 4.35Å
56	K	95.2	Very high	95.5	Very high	155 Å²	155	41.3 Å²	41.3	67%	0.674	22%	0.222	S	C	*	.	H	α-helix	trans	-61.6	-40.3	175.8	-71.5	172.8	-176	-176.9	0	111.5	S52 T53 F54 A59 K60	S52-K56 VanDerWaalsContact O-CG 3.31Å; S52-K56 WeakPolarHBondContact O-CG 3.36Å; S52-K56 PolarHBondContact O-N 3.05Å; S52-K56 VanDerWaalsContact O-N 3.15Å; T53-K56 WeakPolarHBondContact O-CB 3.15Å; T53-K56 PolarHBondContact O-N 2.99Å; F54-K56 PolarHBondContact O-N 3.17Å; K56-A59 PolarHBondContact O-N 3.42Å; K56-K60 WeakPolarHBondContact O-CB 3.21Å; K56-K60 PolarHBondContact O-N 3.25Å
57	L	96.5	Very high	95.3	Very high	18 Å²	18	42.7 Å²	42.7	9%	0.094	23%	0.23	C	C	.	.	H	α-helix	trans	-63.7	-43.8	175.8	-179.1	61.3	0	0	0	111.8	T53 F54 V55 K60 T61 Q263 M267	T53-L57 PolarHBondContact O-N 3.49Å; F54-L57 WeakPolarHBondContact O-CB 3.42Å; F54-L57 PolarHBondContact O-N 2.97Å; V55-L57 VanDerWaalsContact C-N 3.29Å; V55-L57 PolarHBondContact O-N 2.82Å; L57-K60 PolarHBondContact O-N 3.34Å; L57-T61 WeakPolarHBondContact O-CB 3.47Å; L57-T61 PolarHBondContact O-N 2.86Å; L57-T61 PolarHBondContact O-OG1 3.32Å; L57-Q263 HydrophobicContact CD1-CB 4.13Å; L57-Q263 HydrophobicContact CD1-CG 4.3Å; L57-Q263 HydrophobicContact CD2-CB 3.73Å; L57-Q263 HydrophobicContact CD2-CG 3.73Å; L57-M267 HydrophobicContact CD2-CE 3.62Å; L57-M267 HydrophobicContact CD2-CG 4.32Å; L57-M267 HydrophobicContact CD2-SD 4.24Å; L57-M267 HydrophobicContact CG-CE 3.86Å; L57-M267 HydrophobicContact CG-CG 4.23Å; L57-M267 HydrophobicContact CG-SD 3.9Å
58	L	96.3	Very high	95.2	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-61.1	-45.9	174.5	-75.1	171.8	0	0	0	112.4	I43 F54 V55 K60 T61 Y62 W65 I139 M267 V270	I43-L58 HydrophobicContact CD1-CD1 3.72Å; F54-L58 HydrophobicContact CD1-CD1 3.79Å; F54-L58 HydrophobicContact CD1-CG 4.2Å; F54-L58 HydrophobicContact CE1-CD1 3.61Å; F54-L58 HydrophobicContact CE1-CD2 4.42Å; F54-L58 HydrophobicContact CE1-CG 4.02Å; F54-L58 PolarHBondContact O-N 3.12Å; V55-L58 PolarHBondContact O-N 2.75Å; L58-K60 PolarHBondContact O-N 3.01Å; L58-T61 PolarHBondContact O-N 3.28Å; L58-Y62 HydrophobicContact CD2-CD2 3.97Å; L58-Y62 HydrophobicContact CD2-CE2 4.04Å; L58-Y62 PolarHBondContact O-N 3.3Å; L58-W65 HydrophobicContact CD2-CE3 4.47Å; L58-W65 HydrophobicContact CD2-CZ3 3.94Å; L58-I139 HydrophobicContact CD1-CG2 4.31Å; L58-M267 HydrophobicContact CD2-CE 3.94Å; L58-M267 HydrophobicContact CD2-SD 3.68Å; L58-M267 HydrophobicContact CG-CE 4.3Å; L58-M267 HydrophobicContact CG-SD 4.32Å; L58-V270 HydrophobicContact CD2-CG1 3.93Å
59	A	94.1	Very high	94.8	Very high	46 Å²	46	46 Å²	46	38%	0.38	25%	0.25	S	C	.	.	H	α-helix	trans	-63.2	-32.3	179.2	0	0	0	0	0	112.4	V55 K56 V67	V55-A59 PolarHBondContact O-N 2.93Å; K56-A59 PolarHBondContact O-N 3.42Å; A59-V67 HydrophobicContact CB-CG2 4.45Å
60	K	95.1	Very high	94.3	Very high	164 Å²	164	47.1 Å²	47.1	71%	0.713	26%	0.255	S	S	*	.	H	α-helix	trans	-71.9	-44	173.7	-176.7	-176.3	175.5	-171.9	0	112	K56 L57 L58	K56-K60 WeakPolarHBondContact O-CB 3.21Å; K56-K60 PolarHBondContact O-N 3.25Å; L57-K60 PolarHBondContact O-N 3.34Å; L58-K60 PolarHBondContact O-N 3.01Å
61	T	95.8	Very high	93.9	Very high	58 Å²	58	47.6 Å²	47.6	36%	0.356	26%	0.256	S	S	.	.	H	α-helix	trans	-77.5	-34.7	-175.3	-53.6	0	0	0	0	112.7	L57 L58 M267	L57-T61 WeakPolarHBondContact O-CB 3.47Å; L57-T61 PolarHBondContact O-N 2.86Å; L57-T61 PolarHBondContact O-OG1 3.32Å; L58-T61 PolarHBondContact O-N 3.28Å; T61-M267 HydrophobicContact CG2-CB 4.18Å; T61-M267 HydrophobicContact CG2-CG 3.97Å; T61-M267 HydrophobicContact CG2-SD 4.25Å
62	Y	94.8	Very high	93.5	Very high	29 Å²	29	47.9 Å²	47.9	11%	0.114	26%	0.258	C	S	.	.			trans	-127.3	75.1	-178.6	-52.2	-68.2	0	0	0	110.9	L58 E64 W65 M267	L58-Y62 HydrophobicContact CD2-CD2 3.97Å; L58-Y62 HydrophobicContact CD2-CE2 4.04Å; L58-Y62 PolarHBondContact O-N 3.3Å; Y62-E64 WeakPolarHBondContact CA-OE2 3.34Å; Y62-E64 PolarHBondContact O-N 3.33Å; Y62-E64 VanDerWaalsContact O-N 3.08Å; Y62-W65 HydrophobicContact CD1-CH2 4.47Å; Y62-W65 AromaticContact CD1-CZ2 3.94Å; Y62-W65 HydrophobicContact CD1-CZ2 3.94Å; Y62-W65 HydrophobicContact CD2-CD2 4.12Å; Y62-W65 AromaticContact CD2-CE3 3.97Å; Y62-W65 HydrophobicContact CD2-CE3 3.97Å; Y62-W65 AromaticContact CD2-CH2 3.62Å; Y62-W65 HydrophobicContact CD2-CH2 3.62Å; Y62-W65 AromaticContact CD2-CZ2 3.85Å; Y62-W65 HydrophobicContact CD2-CZ2 3.85Å; Y62-W65 AromaticContact CD2-CZ3 3.73Å; Y62-W65 HydrophobicContact CD2-CZ3 3.73Å; Y62-W65 HydrophobicContact CE1-CZ2 4.33Å; Y62-W65 AromaticContact CE2-CH2 3.81Å; Y62-W65 HydrophobicContact CE2-CH2 3.81Å; Y62-W65 HydrophobicContact CE2-CZ2 4.23Å; Y62-W65 HydrophobicContact CE2-CZ3 4.19Å; Y62-W65 AromaticContact CG-CD2 3.91Å; Y62-W65 HydrophobicContact CG-CD2 3.91Å; Y62-W65 AromaticContact CG-CE2 3.65Å; Y62-W65 HydrophobicContact CG-CE3 4.24Å; Y62-W65 HydrophobicContact CG-CG 4.44Å; Y62-W65 AromaticContact CG-CH2 3.99Å; Y62-W65 HydrophobicContact CG-CH2 3.99Å; Y62-W65 AromaticContact CG-CZ2 3.71Å; Y62-W65 HydrophobicContact CG-CZ2 3.71Å; Y62-W65 HydrophobicContact CG-CZ3 4.29Å; Y62-W65 WeakPolarHBondContact O-CB 3.22Å; Y62-W65 PolarHBondContact O-N 3.12Å; Y62-M267 HydrophobicContact CE2-SD 4.05Å; Y62-M267 PolarHBondContact OH-O 3.31Å
63	P	93	Very high	93.3	Very high	75 Å²	75	49 Å²	49	49%	0.487	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-19.8	-176.1	-23	34.5	0	0	0	114.2	W65 K129	P63-W65 VanDerWaalsContact C-N 3.32Å; P63-K129 WeakPolarHBondContact O-CE 3.4Å; P63-K129 PolarHBondContact O-NZ 3.32Å
64	E	92	Very high	93	Very high	76 Å²	76	49.1 Å²	49.1	36%	0.355	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-12.7	176.9	78.5	-70.6	-175.5	0	0	113.6	Y62 A133	Y62-E64 WeakPolarHBondContact CA-OE2 3.34Å; Y62-E64 PolarHBondContact O-N 3.33Å; Y62-E64 VanDerWaalsContact O-N 3.08Å; E64-A133 HydrophobicContact CB-CB 4.43Å
65	W	94.4	Very high	92.8	Very high	23 Å²	23	49.5 Å²	49.5	9%	0.087	27%	0.273	C	S	.	.	S	Bend	trans	-81.3	145.6	177.6	-64.8	11.9	0	0	0	110.5	L58 Y62 P63 V137 I139 V270 I274	L58-W65 HydrophobicContact CD2-CE3 4.47Å; L58-W65 HydrophobicContact CD2-CZ3 3.94Å; Y62-W65 HydrophobicContact CD1-CH2 4.47Å; Y62-W65 AromaticContact CD1-CZ2 3.94Å; Y62-W65 HydrophobicContact CD1-CZ2 3.94Å; Y62-W65 HydrophobicContact CD2-CD2 4.12Å; Y62-W65 AromaticContact CD2-CE3 3.97Å; Y62-W65 HydrophobicContact CD2-CE3 3.97Å; Y62-W65 AromaticContact CD2-CH2 3.62Å; Y62-W65 HydrophobicContact CD2-CH2 3.62Å; Y62-W65 AromaticContact CD2-CZ2 3.85Å; Y62-W65 HydrophobicContact CD2-CZ2 3.85Å; Y62-W65 AromaticContact CD2-CZ3 3.73Å; Y62-W65 HydrophobicContact CD2-CZ3 3.73Å; Y62-W65 HydrophobicContact CE1-CZ2 4.33Å; Y62-W65 AromaticContact CE2-CH2 3.81Å; Y62-W65 HydrophobicContact CE2-CH2 3.81Å; Y62-W65 HydrophobicContact CE2-CZ2 4.23Å; Y62-W65 HydrophobicContact CE2-CZ3 4.19Å; Y62-W65 AromaticContact CG-CD2 3.91Å; Y62-W65 HydrophobicContact CG-CD2 3.91Å; Y62-W65 AromaticContact CG-CE2 3.65Å; Y62-W65 HydrophobicContact CG-CE3 4.24Å; Y62-W65 HydrophobicContact CG-CG 4.44Å; Y62-W65 AromaticContact CG-CH2 3.99Å; Y62-W65 HydrophobicContact CG-CH2 3.99Å; Y62-W65 AromaticContact CG-CZ2 3.71Å; Y62-W65 HydrophobicContact CG-CZ2 3.71Å; Y62-W65 HydrophobicContact CG-CZ3 4.29Å; Y62-W65 WeakPolarHBondContact O-CB 3.22Å; Y62-W65 PolarHBondContact O-N 3.12Å; P63-W65 VanDerWaalsContact C-N 3.32Å; W65-V137 WeakPolarHBondContact CA-O 3.44Å; W65-V137 HydrophobicContact CB-CB 4.36Å; W65-V137 HydrophobicContact CD2-CB 3.58Å; W65-V137 HydrophobicContact CD2-CG1 3.76Å; W65-V137 HydrophobicContact CD2-CG2 4.03Å; W65-V137 HydrophobicContact CE3-CB 4.11Å; W65-V137 HydrophobicContact CE3-CG1 3.73Å; W65-V137 HydrophobicContact CG-CB 3.66Å; W65-V137 HydrophobicContact CG-CG1 4.23Å; W65-V137 HydrophobicContact CG-CG2 4.34Å; W65-V137 HydrophobicContact CZ2-CB 4.47Å; W65-V137 HydrophobicContact CZ2-CG2 4.05Å; W65-V137 HydrophobicContact CZ3-CG1 4.17Å; W65-I139 HydrophobicContact CE3-CD1 4.09Å; W65-I139 HydrophobicContact CE3-CG1 3.89Å; W65-I139 HydrophobicContact CZ3-CD1 4.26Å; W65-I139 HydrophobicContact CZ3-CG1 4.48Å; W65-V270 HydrophobicContact CH2-CG1 3.95Å; W65-V270 HydrophobicContact CZ3-CG1 3.99Å; W65-I274 HydrophobicContact CE3-CD1 4.35Å; W65-I274 HydrophobicContact CH2-CB 4.48Å; W65-I274 HydrophobicContact CH2-CD1 3.13Å; W65-I274 HydrophobicContact CH2-CG1 4.35Å; W65-I274 HydrophobicContact CH2-CG2 4.43Å; W65-I274 HydrophobicContact CZ2-CD1 4.01Å; W65-I274 HydrophobicContact CZ2-CG2 4.33Å; W65-I274 HydrophobicContact CZ3-CD1 3.31Å
66	H	95.3	Very high	92.6	Very high	51 Å²	51	51.9 Å²	51.9	24%	0.236	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	129.4	173	177.9	-121.1	0	0	0	109.6	L130 V137 Q138 I139	H66-L130 HydrophobicContact CB-CB 4.35Å; H66-L130 HydrophobicContact CB-CD1 4.11Å; H66-L130 HydrophobicContact CB-CD2 3.91Å; H66-L130 HydrophobicContact CB-CG 4.36Å; H66-V137 PolarHBondContact N-O 3.37Å; H66-Q138 PolarHBondContact ND1-NE2 2.68Å; H66-Q138 CarbonylContact O-C 3.58Å; H66-Q138 WeakPolarHBondContact O-CA 3.34Å; H66-I139 PolarHBondContact O-N 3.4Å
67	V	94.5	Very high	92.5	Very high	30 Å²	30	47 Å²	47	18%	0.182	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	118.8	174.7	-173.4	0	0	0	0	110	V55 A59 T69 I139	V55-V67 HydrophobicContact CB-CG1 4.31Å; V55-V67 HydrophobicContact CG1-CB 4.28Å; V55-V67 HydrophobicContact CG1-CG1 3.32Å; V55-V67 HydrophobicContact CG2-CG1 4.11Å; A59-V67 HydrophobicContact CB-CG2 4.45Å; V67-T69 HydrophobicContact CG1-CG2 4.39Å; V67-I139 WeakPolarHBondContact CA-O 3.38Å; V67-I139 HydrophobicContact CG1-CB 4.47Å; V67-I139 HydrophobicContact CG1-CG2 4.42Å; V67-I139 HydrophobicContact CG2-CB 4.31Å
68	A	92.9	Very high	92.2	Very high	10 Å²	10	48.1 Å²	48.1	8%	0.083	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	106.3	169.9	0	0	0	0	0	109.4	V121 I139 F140 E141	A68-V121 HydrophobicContact CB-CG1 3.59Å; A68-I139 PolarHBondContact N-O 3.01Å; A68-F140 HydrophobicContact CB-CD1 3.53Å; A68-F140 HydrophobicContact CB-CE1 3.77Å; A68-E141 PolarHBondContact O-N 3.29Å
69	T	88.6	Confident	91.7	Very high	86 Å²	86	53.5 Å²	53.5	53%	0.528	30%	0.295	S	S	.	.			trans	-79	157.5	-178.1	56.1	0	0	0	0	112.4	V55 V67	V55-T69 HydrophobicContact CG1-CG2 4.35Å; V67-T69 HydrophobicContact CG1-CG2 4.39Å
70	E	86.1	Confident	90.9	Very high	24 Å²	24	53 Å²	53	11%	0.112	29%	0.291	C	S	.	.			trans	-67.6	131.4	176.7	-170.9	171.4	-136.4	0	0	110.6	V72 W75 R118 E141 R142	E70-V72 HydrophobicContact CB-CG2 4.11Å; E70-V72 HydrophobicContact CG-CG2 3.74Å; E70-V72 PolarHBondContact O-N 2.9Å; E70-W75 HydrophobicContact CG-CH2 3.34Å; E70-W75 HydrophobicContact CG-CZ2 4.11Å; E70-W75 HydrophobicContact CG-CZ3 3.84Å; E70-W75 VanDerWaalsContact OE1-CH2 3.32Å; E70-W75 WeakPolarHBondContact OE1-CH2 3.36Å; E70-R118 IonicContact OE1-CZ 2.86Å; E70-R118 IonicContact OE1-NH2 2.79Å; E70-R118 PolarHBondContact OE1-NH2 2.84Å; E70-E141 HydrophobicContact CB-CB 4.2Å; E70-E141 HydrophobicContact CB-CG 4.04Å; E70-E141 PolarHBondContact N-OE2 3.1Å; E70-E141 VanDerWaalsContact N-OE2 3.16Å; E70-R142 WeakPolarHBondContact OE1-CD 3.45Å; E70-R142 IonicContact OE1-CZ 2.91Å; E70-R142 IonicContact OE1-NE 3.16Å; E70-R142 IonicContact OE1-NH1 3.72Å; E70-R142 PolarHBondContact OE1-NH1 2.92Å; E70-R142 IonicContact OE2-NH1 2.65Å; E70-R142 PolarHBondContact OE2-NH1 3.04Å; E70-R142 VanDerWaalsContact OE2-NH1 3.16Å
71	P	89	Confident	89.5	Confident	24 Å²	24	50.1 Å²	50.1	16%	0.156	30%	0.298	C	S	.	.			trans	-80.5	44.9	-171.8	34.1	-36.7	0	0	0	112.8	A73 T74 W75 S117	P71-A73 VanDerWaalsContact C-N 3.28Å; P71-A73 PolarHBondContact O-N 3.29Å; P71-T74 HydrophobicContact CB-CG2 4.25Å; P71-T74 WeakPolarHBondContact O-CB 3.29Å; P71-T74 PolarHBondContact O-N 2.88Å; P71-T74 PolarHBondContact O-OG1 2.88Å; P71-W75 HydrophobicContact CG-CZ2 3.78Å; P71-S117 WeakPolarHBondContact CG-OG 3.41Å
72	V	88.4	Confident	87.7	Confident	16 Å²	16	50.2 Å²	50.2	10%	0.097	31%	0.311	C	S	.	.	H	α-helix	trans	-58	-38.7	-173.3	-178.2	0	0	0	0	112.9	E70 T74 W75 Q76 L96	E70-V72 HydrophobicContact CB-CG2 4.11Å; E70-V72 HydrophobicContact CG-CG2 3.74Å; E70-V72 PolarHBondContact O-N 2.9Å; V72-T74 PolarHBondContact O-N 2.85Å; V72-W75 HydrophobicContact CB-CE3 4.32Å; V72-W75 HydrophobicContact CG1-CE3 4.38Å; V72-W75 HydrophobicContact CG2-CE3 4.14Å; V72-W75 HydrophobicContact CG2-CZ3 3.92Å; V72-W75 WeakPolarHBondContact O-CA 3.4Å; V72-W75 WeakPolarHBondContact O-CB 3.45Å; V72-W75 PolarHBondContact O-N 3.37Å; V72-Q76 HydrophobicContact CG1-CG 4.24Å; V72-Q76 WeakPolarHBondContact O-CG 3.41Å; V72-Q76 PolarHBondContact O-N 2.87Å; V72-L96 HydrophobicContact CG1-CD2 4.2Å
73	A	89.1	Confident	85.6	Confident	69 Å²	69	54.2 Å²	54.2	57%	0.57	34%	0.338	S	S	*	.	H	α-helix	trans	-58.1	-35.8	177.6	0	0	0	0	0	111.9	P71 W75 Q76 D77	P71-A73 VanDerWaalsContact C-N 3.28Å; P71-A73 PolarHBondContact O-N 3.29Å; A73-W75 PolarHBondContact O-N 3.43Å; A73-Q76 PolarHBondContact O-N 2.91Å; A73-D77 PolarHBondContact O-N 3.4Å; A73-D77 VanDerWaalsContact O-N 3.08Å
74	T	89.6	Confident	83.6	Confident	68 Å²	68	60.6 Å²	60.6	42%	0.417	36%	0.362	S	S	.	.	H	α-helix	trans	-71.1	-19.3	176.4	72.4	0	0	0	0	113	P71 V72 I78	P71-T74 HydrophobicContact CB-CG2 4.25Å; P71-T74 WeakPolarHBondContact O-CB 3.29Å; P71-T74 PolarHBondContact O-N 2.88Å; P71-T74 PolarHBondContact O-OG1 2.88Å; V72-T74 PolarHBondContact O-N 2.85Å; T74-I78 WeakPolarHBondContact O-CD1 3.15Å
75	W	92.8	Very high	81.7	Confident	8 Å²	8	66.4 Å²	66.4	3%	0.03	39%	0.386	C	S	.	.	H	α-helix	trans	-88.1	-26.9	175.1	-50.7	-20.2	0	0	0	111.9	E70 P71 V72 A73 L95 L96 F110 F113 S117	E70-W75 HydrophobicContact CG-CH2 3.34Å; E70-W75 HydrophobicContact CG-CZ2 4.11Å; E70-W75 HydrophobicContact CG-CZ3 3.84Å; E70-W75 VanDerWaalsContact OE1-CH2 3.32Å; E70-W75 WeakPolarHBondContact OE1-CH2 3.36Å; P71-W75 HydrophobicContact CG-CZ2 3.78Å; V72-W75 HydrophobicContact CB-CE3 4.32Å; V72-W75 HydrophobicContact CG1-CE3 4.38Å; V72-W75 HydrophobicContact CG2-CE3 4.14Å; V72-W75 HydrophobicContact CG2-CZ3 3.92Å; V72-W75 WeakPolarHBondContact O-CA 3.4Å; V72-W75 WeakPolarHBondContact O-CB 3.45Å; V72-W75 PolarHBondContact O-N 3.37Å; A73-W75 PolarHBondContact O-N 3.43Å; W75-L95 PolarHBondContact O-N 3.35Å; W75-L96 HydrophobicContact CB-CB 4.49Å; W75-L96 PolarHBondContact O-N 3.13Å; W75-F110 HydrophobicContact CB-CE2 4.2Å; W75-F110 HydrophobicContact CD2-CE2 4.31Å; W75-F110 HydrophobicContact CD2-CZ 4.33Å; W75-F110 HydrophobicContact CE3-CE2 4.14Å; W75-F110 AromaticContact CE3-CZ 3.85Å; W75-F110 HydrophobicContact CE3-CZ 3.85Å; W75-F110 HydrophobicContact CG-CE2 4.37Å; W75-F110 HydrophobicContact CZ3-CZ 4.24Å; W75-F113 AromaticContact CD1-CD1 3.72Å; W75-F113 AromaticContact CD1-CE1 3.57Å; W75-S117 PolarHBondContact NE1-OG 3.19Å
76	Q	92.1	Very high	79.7	Confident	59 Å²	59	68.3 Å²	68.3	28%	0.276	41%	0.406	S	S	.	.	H	α-helix	trans	-77.4	-25.9	174.9	-66.5	178.9	-65.9	0	0	112.5	V72 A73 N94 L96 E210	V72-Q76 HydrophobicContact CG1-CG 4.24Å; V72-Q76 WeakPolarHBondContact O-CG 3.41Å; V72-Q76 PolarHBondContact O-N 2.87Å; A73-Q76 PolarHBondContact O-N 2.91Å; Q76-N94 WeakPolarHBondContact CA-OD1 3.47Å; Q76-N94 VanDerWaalsContact O-CA 3.24Å; Q76-N94 WeakPolarHBondContact O-CA 3.24Å; Q76-N94 WeakPolarHBondContact O-CB 3.49Å; Q76-N94 VanDerWaalsContact O-CG 3.31Å; Q76-N94 PolarHBondContact O-ND2 2.83Å; Q76-L96 HydrophobicContact CG-CD2 4.24Å; Q76-E210 WeakPolarHBondContact CG-OE1 3.39Å; Q76-E210 PolarHBondContact NE2-OE1 3.42Å; Q76-E210 PolarHBondContact NE2-OE2 2.95Å
77	D	92.4	Very high	77.7	Confident	51 Å²	51	72.4 Å²	72.4	27%	0.273	44%	0.439	S	S	.	.			trans	-133.4	93	177.4	-179	28.6	0	0	0	111	A73 Q79 S91	A73-D77 PolarHBondContact O-N 3.4Å; A73-D77 VanDerWaalsContact O-N 3.08Å; D77-Q79 PolarHBondContact O-N 3.02Å; D77-Q79 PolarHBondContact OD2-NE2 2.73Å; D77-S91 WeakPolarHBondContact OD1-CA 3.38Å; D77-S91 WeakPolarHBondContact OD1-CB 3.47Å; D77-S91 PolarHBondContact OD1-OG 2.93Å
78	I	90.5	Very high	76	Confident	43 Å²	43	76.6 Å²	76.6	22%	0.221	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	114.6	170.8	-54.2	-61.2	0	0	0	108.1	T74 L92 G93 L95 F113	T74-I78 WeakPolarHBondContact O-CD1 3.15Å; I78-L92 WeakPolarHBondContact O-CA 3.48Å; I78-L92 VanDerWaalsContact O-CB 3.26Å; I78-L92 WeakPolarHBondContact O-CB 3.42Å; I78-L92 PolarHBondContact O-N 2.96Å; I78-G93 WeakPolarHBondContact CB-O 3.44Å; I78-G93 WeakPolarHBondContact CG1-O 3.25Å; I78-G93 PolarHBondContact N-O 3.24Å; I78-L95 HydrophobicContact CD1-CB 3.95Å; I78-L95 HydrophobicContact CD1-CD2 4.3Å; I78-L95 HydrophobicContact CG1-CB 3.89Å; I78-F113 HydrophobicContact CD1-CD1 3.91Å; I78-F113 HydrophobicContact CD1-CE1 3.29Å; I78-F113 HydrophobicContact CD1-CZ 3.75Å
79	Q	86.1	Confident	74.5	Confident	114 Å²	114	79.4 Å²	79.4	53%	0.533	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	141.8	-179.1	-64	179.7	2.4	0	0	111.5	D77 A89	D77-Q79 PolarHBondContact O-N 3.02Å; D77-Q79 PolarHBondContact OD2-NE2 2.73Å; Q79-A89 HydrophobicContact CB-CB 4.49Å; Q79-A89 HydrophobicContact CG-CB 4.47Å
80	A	75.5	Confident	74.1	Confident	34 Å²	34	82 Å²	82	28%	0.281	49%	0.494	S	S	.	.			trans	-63	138.3	171.2	0	0	0	0	0	110.7	G82 Q90 L92	A80-G82 PolarHBondContact O-N 2.79Å; A80-Q90 PolarHBondContact N-O 3.3Å; A80-Q90 VanDerWaalsContact N-O 3.08Å; A80-L92 HydrophobicContact CB-CD1 3.81Å; A80-L92 HydrophobicContact CB-CD2 4.02Å; A80-L92 HydrophobicContact CB-CG 3.9Å
81	A	66.1	Low	74	Confident	104 Å²	104	84.1 Å²	84.1	86%	0.86	51%	0.512	S	S	*	.			trans	-63.6	104.9	165.5	0	0	0	0	0	107.8	T83	A81-T83 PolarHBondContact O-N 2.75Å
82	G	58.5	Low	74	Confident	61 Å²	61	88.3 Å²	88.3	63%	0.629	53%	0.532	S	S	*	.			trans	-59	134.6	179.3	0	0	0	0	0	110.5	A80	A80-G82 PolarHBondContact O-N 2.79Å
83	T	50.8	Low	74.1	Confident	112 Å²	112	88.7 Å²	88.7	69%	0.687	54%	0.539	S	S	*	.			trans	-68.8	142.5	152.9	49.3	0	0	0	0	106.8	A81 K85 A86	A81-T83 PolarHBondContact O-N 2.75Å; T83-K85 PolarHBondContact O-N 2.98Å; T83-A86 PolarHBondContact O-N 3.23Å
84	Q	52	Low	74.4	Confident	210 Å²	210	87 Å²	87	98%	0.981	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	5.4	-173.5	-67.6	179.8	-13.7	0	0	116.1
85	K	51.8	Low	74.8	Confident	198 Å²	198	84.4 Å²	84.4	86%	0.861	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.6	-3.9	-177.3	-70.8	-174.7	175.4	-178.4	0	115.3	T83	T83-K85 PolarHBondContact O-N 2.98Å
86	A	52.2	Low	74.9	Confident	63 Å²	63	84.3 Å²	84.3	52%	0.521	50%	0.504	S	S	.	.			trans	-107.8	112.7	177.5	0	0	0	0	0	110.9	T83 T88	T83-A86 PolarHBondContact O-N 3.23Å; A86-T88 PolarHBondContact O-N 2.58Å; A86-T88 VanDerWaalsContact O-N 3.16Å
87	C	53.3	Low	75.1	Confident	136 Å²	136	83 Å²	83	92%	0.919	50%	0.499	S	S	*	.	S	Bend	trans	-75.8	10.1	-175.1	-66.5	0	0	0	0	115.1
88	T	57.4	Low	75.4	Confident	118 Å²	118	83.3 Å²	83.3	72%	0.724	50%	0.5	S	S	*	.	S	Bend	trans	-138.3	122.4	176.3	50.1	0	0	0	0	110.5	A86 Q90	A86-T88 PolarHBondContact O-N 2.58Å; A86-T88 VanDerWaalsContact O-N 3.16Å; T88-Q90 PolarHBondContact O-N 2.91Å
89	A	63.3	Low	75.7	Confident	69 Å²	69	81.5 Å²	81.5	57%	0.57	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-64	119.6	170.3	0	0	0	0	0	108.5	Q79	Q79-A89 HydrophobicContact CB-CB 4.49Å; Q79-A89 HydrophobicContact CG-CB 4.47Å
90	Q	78.9	Confident	76.1	Confident	140 Å²	140	78.9 Å²	78.9	65%	0.654	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-87.6	124.6	177.2	-174.3	175.7	-4.1	0	0	109.3	A80 T88 L92	A80-Q90 PolarHBondContact N-O 3.3Å; A80-Q90 VanDerWaalsContact N-O 3.08Å; T88-Q90 PolarHBondContact O-N 2.91Å; Q90-L92 PolarHBondContact O-N 2.8Å
91	S	85.1	Confident	77.1	Confident	70 Å²	70	85.8 Å²	85.8	49%	0.49	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	123.5	170.1	-174.4	0	0	0	0	109.7	D77	D77-S91 WeakPolarHBondContact OD1-CA 3.38Å; D77-S91 WeakPolarHBondContact OD1-CB 3.47Å; D77-S91 PolarHBondContact OD1-OG 2.93Å
92	L	87.3	Confident	78.6	Confident	112 Å²	112	86.4 Å²	86.4	59%	0.586	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.8	-24.7	178.8	-65.4	177.2	0	0	0	112.5	I78 A80 Q90	I78-L92 WeakPolarHBondContact O-CA 3.48Å; I78-L92 VanDerWaalsContact O-CB 3.26Å; I78-L92 WeakPolarHBondContact O-CB 3.42Å; I78-L92 PolarHBondContact O-N 2.96Å; A80-L92 HydrophobicContact CB-CD1 3.81Å; A80-L92 HydrophobicContact CB-CD2 4.02Å; A80-L92 HydrophobicContact CB-CG 3.9Å; Q90-L92 PolarHBondContact O-N 2.8Å
93	G	92.1	Very high	80.4	Confident	23 Å²	23	85.7 Å²	85.7	24%	0.237	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.9	172.8	177.8	0	0	0	0	0	114.5	I78	I78-G93 WeakPolarHBondContact CB-O 3.44Å; I78-G93 WeakPolarHBondContact CG1-O 3.25Å; I78-G93 PolarHBondContact N-O 3.24Å
94	N	95.8	Very high	82.7	Confident	35 Å²	35	83.8 Å²	83.8	19%	0.187	46%	0.459	C	S	.	.			trans	-105.6	98.3	178.8	-175.4	-31.1	0	0	0	109.5	Q76 L96 D97 M98 E210	Q76-N94 WeakPolarHBondContact CA-OD1 3.47Å; Q76-N94 VanDerWaalsContact O-CA 3.24Å; Q76-N94 WeakPolarHBondContact O-CA 3.24Å; Q76-N94 WeakPolarHBondContact O-CB 3.49Å; Q76-N94 VanDerWaalsContact O-CG 3.31Å; Q76-N94 PolarHBondContact O-ND2 2.83Å; N94-L96 VanDerWaalsContact C-N 3.25Å; N94-L96 PolarHBondContact O-N 2.93Å; N94-L96 WeakPolarHBondContact OD1-CB 3.37Å; N94-L96 PolarHBondContact OD1-N 3.5Å; N94-D97 HydrophobicContact CB-CB 3.92Å; N94-D97 PolarHBondContact O-N 2.86Å; N94-D97 PolarHBondContact OD1-N 2.92Å; N94-M98 WeakPolarHBondContact O-CG 3.32Å; N94-M98 PolarHBondContact O-N 2.57Å; N94-E210 PolarHBondContact ND2-OE1 3.34Å
95	L	96.4	Very high	84.9	Confident	12 Å²	12	80 Å²	80	6%	0.063	44%	0.436	C	S	.	.	H	α-helix	trans	-69.4	-26.8	-175.2	-167.9	63.5	0	0	0	112.2	W75 I78 M98 M99 W106 T109 F110 F113	W75-L95 PolarHBondContact O-N 3.35Å; I78-L95 HydrophobicContact CD1-CB 3.95Å; I78-L95 HydrophobicContact CD1-CD2 4.3Å; I78-L95 HydrophobicContact CG1-CB 3.89Å; L95-M98 HydrophobicContact CD1-SD 4.41Å; L95-M99 WeakPolarHBondContact O-CB 3.4Å; L95-M99 PolarHBondContact O-N 3.21Å; L95-W106 HydrophobicContact CD1-CE3 4.13Å; L95-T109 HydrophobicContact CD1-CG2 3.98Å; L95-T109 HydrophobicContact CD2-CG2 4.32Å; L95-F110 HydrophobicContact CD2-CD2 4.39Å; L95-F110 HydrophobicContact CG-CB 4.33Å; L95-F110 HydrophobicContact CG-CD2 4.07Å; L95-F113 HydrophobicContact CD2-CB 3.87Å; L95-F113 HydrophobicContact CD2-CD1 3.84Å; L95-F113 HydrophobicContact CD2-CG 4.09Å
96	L	96.2	Very high	87.1	Confident	7 Å²	7	73.2 Å²	73.2	4%	0.037	41%	0.405	C	S	.	.	H	α-helix	trans	-65.9	-46.9	174.1	-177.1	65.7	0	0	0	111.3	V72 W75 Q76 N94 M99 Y100 F110 E210	V72-L96 HydrophobicContact CG1-CD2 4.2Å; W75-L96 HydrophobicContact CB-CB 4.49Å; W75-L96 PolarHBondContact O-N 3.13Å; Q76-L96 HydrophobicContact CG-CD2 4.24Å; N94-L96 VanDerWaalsContact C-N 3.25Å; N94-L96 PolarHBondContact O-N 2.93Å; N94-L96 WeakPolarHBondContact OD1-CB 3.37Å; N94-L96 PolarHBondContact OD1-N 3.5Å; L96-M99 HydrophobicContact CD1-CE 3.99Å; L96-M99 PolarHBondContact O-N 2.99Å; L96-Y100 HydrophobicContact CD1-CD2 4.12Å; L96-Y100 HydrophobicContact CD1-CE2 3.54Å; L96-Y100 HydrophobicContact CG-CD2 4.14Å; L96-Y100 HydrophobicContact CG-CE2 3.9Å; L96-Y100 WeakPolarHBondContact O-CD2 3.46Å; L96-Y100 PolarHBondContact O-N 2.76Å; L96-Y100 VanDerWaalsContact O-N 3.14Å; L96-F110 HydrophobicContact CB-CE2 4.09Å; L96-F110 HydrophobicContact CD1-CE2 3.63Å; L96-F110 HydrophobicContact CD1-CZ 3.61Å; L96-E210 HydrophobicContact CD2-CB 4.3Å; L96-E210 HydrophobicContact CD2-CG 4.49Å; L96-E210 HydrophobicContact CG-CB 4.26Å
97	D	96.3	Very high	89.3	Confident	31 Å²	31	70.2 Å²	70.2	17%	0.166	38%	0.38	C	S	.	.	H	α-helix	trans	-62.6	-44.9	175.6	-173.9	43.3	0	0	0	111.2	N94 M99 Y100 R101 E210	N94-D97 HydrophobicContact CB-CB 3.92Å; N94-D97 PolarHBondContact O-N 2.86Å; N94-D97 PolarHBondContact OD1-N 2.92Å; D97-M99 VanDerWaalsContact C-N 3.28Å; D97-M99 PolarHBondContact O-N 2.65Å; D97-Y100 PolarHBondContact O-N 3.31Å; D97-R101 WeakPolarHBondContact O-CB 3.43Å; D97-R101 WeakPolarHBondContact O-CG 3.31Å; D97-R101 PolarHBondContact O-N 2.99Å; D97-R101 IonicContact OD1-CZ 2.96Å; D97-R101 IonicContact OD1-NE 3.01Å; D97-R101 PolarHBondContact OD1-NE 2.74Å; D97-R101 IonicContact OD1-NH2 2.88Å; D97-R101 PolarHBondContact OD1-NH2 3.47Å; D97-R101 IonicContact OD2-CZ 2.71Å; D97-R101 IonicContact OD2-NE 2.75Å; D97-R101 PolarHBondContact OD2-NE 3.14Å; D97-R101 IonicContact OD2-NH1 3.82Å; D97-R101 IonicContact OD2-NH2 3.69Å; D97-R101 PolarHBondContact OD2-NH2 3.37Å; D97-E210 HydrophobicContact CB-CB 4.33Å; D97-E210 HydrophobicContact CB-CG 3.67Å
98	M	97.3	Very high	91.5	Very high	58 Å²	58	66.3 Å²	66.3	29%	0.286	35%	0.347	S	S	.	.	H	α-helix	trans	-58.3	-40.7	176.9	-67.6	167.5	75.8	0	0	112	N94 L95 E102 W106	N94-M98 WeakPolarHBondContact O-CG 3.32Å; N94-M98 PolarHBondContact O-N 2.57Å; L95-M98 HydrophobicContact CD1-SD 4.41Å; M98-E102 PolarHBondContact O-N 2.91Å; M98-W106 HydrophobicContact CB-CB 4.36Å; M98-W106 HydrophobicContact CB-CD2 4.23Å; M98-W106 HydrophobicContact CB-CG 3.9Å; M98-W106 HydrophobicContact CE-CD2 3.73Å; M98-W106 HydrophobicContact CE-CE3 3.87Å; M98-W106 HydrophobicContact CE-CH2 3.38Å; M98-W106 HydrophobicContact CE-CZ2 3.2Å; M98-W106 HydrophobicContact CE-CZ3 3.7Å; M98-W106 VanDerWaalsContact O-CD1 3.26Å
99	M	97.3	Very high	93.4	Very high	5 Å²	5	62.9 Å²	62.9	3%	0.025	33%	0.326	C	S	.	.	H	α-helix	trans	-64.7	-43.9	175.9	-176.8	-84.4	-61.8	0	0	112.5	L95 L96 D97 P103 W106 F110	L95-M99 WeakPolarHBondContact O-CB 3.4Å; L95-M99 PolarHBondContact O-N 3.21Å; L96-M99 HydrophobicContact CD1-CE 3.99Å; L96-M99 PolarHBondContact O-N 2.99Å; D97-M99 VanDerWaalsContact C-N 3.28Å; D97-M99 PolarHBondContact O-N 2.65Å; M99-P103 WeakPolarHBondContact O-CA 3.42Å; M99-P103 WeakPolarHBondContact O-CB 3.48Å; M99-W106 HydrophobicContact CB-CB 4.45Å; M99-F110 HydrophobicContact CB-CB 3.86Å; M99-F110 HydrophobicContact CB-CD2 4.15Å; M99-F110 HydrophobicContact CB-CG 3.91Å; M99-F110 HydrophobicContact CE-CD1 4.09Å; M99-F110 HydrophobicContact CE-CE1 4.01Å; M99-F110 HydrophobicContact CE-CG 4.47Å; M99-F110 HydrophobicContact CE-CZ 4.32Å; M99-F110 HydrophobicContact CG-CB 3.84Å; M99-F110 HydrophobicContact CG-CD1 4.05Å; M99-F110 HydrophobicContact CG-CG 3.89Å
100	Y	95.7	Very high	95.1	Very high	58 Å²	58	60.3 Å²	60.3	23%	0.227	30%	0.302	C	S	.	.	H	α-helix	trans	-72.5	-29.9	178.9	-74.5	-56.5	0	0	0	113.7	L96 D97 E210 E211 I214 Y218	L96-Y100 HydrophobicContact CD1-CD2 4.12Å; L96-Y100 HydrophobicContact CD1-CE2 3.54Å; L96-Y100 HydrophobicContact CG-CD2 4.14Å; L96-Y100 HydrophobicContact CG-CE2 3.9Å; L96-Y100 WeakPolarHBondContact O-CD2 3.46Å; L96-Y100 PolarHBondContact O-N 2.76Å; L96-Y100 VanDerWaalsContact O-N 3.14Å; D97-Y100 PolarHBondContact O-N 3.31Å; Y100-E210 HydrophobicContact CD2-CB 4.26Å; Y100-E210 VanDerWaalsContact CD2-O 3.22Å; Y100-E210 WeakPolarHBondContact CD2-O 3.33Å; Y100-E211 HydrophobicContact CE2-CG 4.16Å; Y100-I214 HydrophobicContact CD1-CD1 4.24Å; Y100-I214 HydrophobicContact CD1-CG1 4.11Å; Y100-I214 HydrophobicContact CE1-CD1 3.56Å; Y100-I214 HydrophobicContact CE1-CG1 3.84Å; Y100-I214 HydrophobicContact CE2-CD1 4.1Å; Y100-I214 VanDerWaalsContact CZ-CD1 3.48Å; Y100-Y218 HydrophobicContact CE1-CE1 4.21Å
101	R	95.9	Very high	96	Very high	179 Å²	179	53.8 Å²	53.8	68%	0.675	27%	0.271	S	S	*	.	H	α-helix	trans	-77.4	-43.1	178.4	-70.2	-177.2	-171.2	-167.9	5.6	113.6	D97	D97-R101 WeakPolarHBondContact O-CB 3.43Å; D97-R101 WeakPolarHBondContact O-CG 3.31Å; D97-R101 PolarHBondContact O-N 2.99Å; D97-R101 IonicContact OD1-CZ 2.96Å; D97-R101 IonicContact OD1-NE 3.01Å; D97-R101 PolarHBondContact OD1-NE 2.74Å; D97-R101 IonicContact OD1-NH2 2.88Å; D97-R101 PolarHBondContact OD1-NH2 3.47Å; D97-R101 IonicContact OD2-CZ 2.71Å; D97-R101 IonicContact OD2-NE 2.75Å; D97-R101 PolarHBondContact OD2-NE 3.14Å; D97-R101 IonicContact OD2-NH1 3.82Å; D97-R101 IonicContact OD2-NH2 3.69Å; D97-R101 PolarHBondContact OD2-NH2 3.37Å
102	E	97.1	Very high	96.6	Very high	118 Å²	118	52.5 Å²	52.5	55%	0.551	26%	0.26	S	S	*	.	S	Bend	trans	-133.4	70.1	-178	-67.9	179.3	-96.6	0	0	110.1	M98 A104 R105 W106	M98-E102 PolarHBondContact O-N 2.91Å; E102-A104 VanDerWaalsContact C-N 3.32Å; E102-A104 PolarHBondContact O-N 2.83Å; E102-R105 HydrophobicContact CB-CB 4.17Å; E102-R105 PolarHBondContact O-N 3.48Å; E102-W106 PolarHBondContact O-N 3Å
103	P	97.2	Very high	97.1	Very high	46 Å²	46	50.5 Å²	50.5	30%	0.299	25%	0.247	S	C	.	.	H	α-helix	trans	-60.8	-39.1	-171.7	22.6	-33.7	0	0	0	112.4	M99 R105 W106 S107	M99-P103 WeakPolarHBondContact O-CA 3.42Å; M99-P103 WeakPolarHBondContact O-CB 3.48Å; P103-R105 PolarHBondContact O-N 2.83Å; P103-R105 VanDerWaalsContact O-N 3.14Å; P103-W106 PolarHBondContact O-N 2.84Å; P103-S107 WeakPolarHBondContact O-CB 3.47Å; P103-S107 PolarHBondContact O-N 3.43Å; P103-S107 PolarHBondContact O-OG 2.96Å
104	A	97.8	Very high	97.3	Very high	71 Å²	71	49.4 Å²	49.4	59%	0.587	24%	0.236	S	C	*	.	H	α-helix	trans	-61.1	-22.5	176.8	0	0	0	0	0	113.8	E102 S160	E102-A104 VanDerWaalsContact C-N 3.32Å; E102-A104 PolarHBondContact O-N 2.83Å; A104-S160 WeakPolarHBondContact CA-O 3.28Å
105	R	98.4	Very high	97.3	Very high	131 Å²	131	48.2 Å²	48.2	49%	0.494	23%	0.229	S	C	.	.	H	α-helix	trans	-95.8	-36.8	179.5	176	58.6	-172.9	87.4	-0.3	112.6	E102 P103	E102-R105 HydrophobicContact CB-CB 4.17Å; E102-R105 PolarHBondContact O-N 3.48Å; P103-R105 PolarHBondContact O-N 2.83Å; P103-R105 VanDerWaalsContact O-N 3.14Å
106	W	98.4	Very high	97.3	Very high	55 Å²	55	51.1 Å²	51.1	21%	0.208	24%	0.244	C	C	.	.	H	α-helix	trans	-113.7	-7.5	-166.5	-64.2	110.1	0	0	0	114.6	L95 M98 M99 E102 P103 Y108 T109 F110	L95-W106 HydrophobicContact CD1-CE3 4.13Å; M98-W106 HydrophobicContact CB-CB 4.36Å; M98-W106 HydrophobicContact CB-CD2 4.23Å; M98-W106 HydrophobicContact CB-CG 3.9Å; M98-W106 HydrophobicContact CE-CD2 3.73Å; M98-W106 HydrophobicContact CE-CE3 3.87Å; M98-W106 HydrophobicContact CE-CH2 3.38Å; M98-W106 HydrophobicContact CE-CZ2 3.2Å; M98-W106 HydrophobicContact CE-CZ3 3.7Å; M98-W106 VanDerWaalsContact O-CD1 3.26Å; M99-W106 HydrophobicContact CB-CB 4.45Å; E102-W106 PolarHBondContact O-N 3Å; P103-W106 PolarHBondContact O-N 2.84Å; W106-Y108 PolarHBondContact O-N 3.39Å; W106-T109 HydrophobicContact CE3-CG2 4.24Å; W106-T109 HydrophobicContact CZ3-CG2 4.43Å; W106-T109 PolarHBondContact O-N 3.01Å; W106-F110 WeakPolarHBondContact O-CB 3.24Å; W106-F110 PolarHBondContact O-N 3.3Å
107	S	98.4	Very high	97.3	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-56.4	-49.1	178.8	-72.6	0	0	0	0	112.2	P103 T109 F110 Q111 S160	P103-S107 WeakPolarHBondContact O-CB 3.47Å; P103-S107 PolarHBondContact O-N 3.43Å; P103-S107 PolarHBondContact O-OG 2.96Å; S107-T109 PolarHBondContact O-N 2.98Å; S107-F110 PolarHBondContact O-N 3.34Å; S107-Q111 WeakPolarHBondContact O-CB 3.41Å; S107-Q111 VanDerWaalsContact O-CG 3.23Å; S107-Q111 WeakPolarHBondContact O-CG 3.37Å; S107-Q111 PolarHBondContact O-N 3.38Å; S107-S160 WeakPolarHBondContact OG-CB 3.43Å
108	Y	98.6	Very high	97.2	Very high	55 Å²	55	50.5 Å²	50.5	22%	0.216	24%	0.241	C	C	.	.	H	α-helix	trans	-61.6	-46.8	-179.5	176	-99.9	0	0	0	111.8	W106 F110 Q111 T112 L161 E165 I168	W106-Y108 PolarHBondContact O-N 3.39Å; Y108-F110 VanDerWaalsContact C-N 3.35Å; Y108-F110 PolarHBondContact O-N 3.35Å; Y108-Q111 PolarHBondContact O-N 3.16Å; Y108-T112 HydrophobicContact CD2-CG2 4.28Å; Y108-T112 HydrophobicContact CE1-CG2 4.09Å; Y108-T112 HydrophobicContact CE2-CG2 3.86Å; Y108-T112 WeakPolarHBondContact O-CB 3.37Å; Y108-T112 VanDerWaalsContact O-CG2 3.31Å; Y108-T112 WeakPolarHBondContact O-CG2 3.29Å; Y108-T112 PolarHBondContact O-N 3.31Å; Y108-T112 PolarHBondContact O-OG1 3.08Å; Y108-L161 VanDerWaalsContact N-CD2 3.27Å; Y108-E165 VanDerWaalsContact CB-OE1 3.29Å; Y108-E165 WeakPolarHBondContact CB-OE1 3.2Å; Y108-E165 HydrophobicContact CD2-CB 3.67Å; Y108-E165 HydrophobicContact CD2-CG 3.98Å; Y108-E165 HydrophobicContact CE2-CB 4.43Å; Y108-E165 HydrophobicContact CG-CB 4.04Å; Y108-E165 HydrophobicContact CG-CG 3.88Å; Y108-I168 HydrophobicContact CE2-CB 4.29Å; Y108-I168 HydrophobicContact CE2-CG2 4.19Å; Y108-I168 WeakPolarHBondContact OH-CG2 3.47Å
109	T	98.4	Very high	97.1	Very high	46 Å²	46	47.9 Å²	47.9	28%	0.282	23%	0.229	S	C	.	.	H	α-helix	trans	-60.4	-43.4	177.1	-50.1	0	0	0	0	111.8	L95 W106 S107 T112 F113	L95-T109 HydrophobicContact CD1-CG2 3.98Å; L95-T109 HydrophobicContact CD2-CG2 4.32Å; W106-T109 HydrophobicContact CE3-CG2 4.24Å; W106-T109 HydrophobicContact CZ3-CG2 4.43Å; W106-T109 PolarHBondContact O-N 3.01Å; S107-T109 PolarHBondContact O-N 2.98Å; T109-T112 PolarHBondContact O-OG1 3.15Å; T109-F113 WeakPolarHBondContact O-CB 3.24Å; T109-F113 PolarHBondContact O-N 2.88Å; T109-F113 VanDerWaalsContact O-N 3.11Å
110	F	98.1	Very high	97	Very high	14 Å²	14	53.8 Å²	53.8	6%	0.061	25%	0.254	C	S	.	.	H	α-helix	trans	-68.8	-44.1	178.9	179.5	-91.8	0	0	0	111.9	W75 L95 L96 M99 W106 S107 Y108 T112 F113 S114	W75-F110 HydrophobicContact CB-CE2 4.2Å; W75-F110 HydrophobicContact CD2-CE2 4.31Å; W75-F110 HydrophobicContact CD2-CZ 4.33Å; W75-F110 HydrophobicContact CE3-CE2 4.14Å; W75-F110 AromaticContact CE3-CZ 3.85Å; W75-F110 HydrophobicContact CE3-CZ 3.85Å; W75-F110 HydrophobicContact CG-CE2 4.37Å; W75-F110 HydrophobicContact CZ3-CZ 4.24Å; L95-F110 HydrophobicContact CD2-CD2 4.39Å; L95-F110 HydrophobicContact CG-CB 4.33Å; L95-F110 HydrophobicContact CG-CD2 4.07Å; L96-F110 HydrophobicContact CB-CE2 4.09Å; L96-F110 HydrophobicContact CD1-CE2 3.63Å; L96-F110 HydrophobicContact CD1-CZ 3.61Å; M99-F110 HydrophobicContact CB-CB 3.86Å; M99-F110 HydrophobicContact CB-CD2 4.15Å; M99-F110 HydrophobicContact CB-CG 3.91Å; M99-F110 HydrophobicContact CE-CD1 4.09Å; M99-F110 HydrophobicContact CE-CE1 4.01Å; M99-F110 HydrophobicContact CE-CG 4.47Å; M99-F110 HydrophobicContact CE-CZ 4.32Å; M99-F110 HydrophobicContact CG-CB 3.84Å; M99-F110 HydrophobicContact CG-CD1 4.05Å; M99-F110 HydrophobicContact CG-CG 3.89Å; W106-F110 WeakPolarHBondContact O-CB 3.24Å; W106-F110 PolarHBondContact O-N 3.3Å; S107-F110 PolarHBondContact O-N 3.34Å; Y108-F110 VanDerWaalsContact C-N 3.35Å; Y108-F110 PolarHBondContact O-N 3.35Å; F110-T112 PolarHBondContact O-N 3.23Å; F110-F113 PolarHBondContact O-N 3.2Å; F110-S114 VanDerWaalsContact O-CB 3.31Å; F110-S114 WeakPolarHBondContact O-CB 3.31Å; F110-S114 PolarHBondContact O-N 3.39Å; F110-S114 PolarHBondContact O-OG 3.33Å
111	Q	98.3	Very high	96.9	Very high	3 Å²	3	52.2 Å²	52.2	1%	0.014	25%	0.251	C	S	.	.	H	α-helix	trans	-64.9	-39.7	-180	-70.6	-55.9	-42.9	0	0	111.7	S107 Y108 S114 F115 A152 L155 Y169	S107-Q111 WeakPolarHBondContact O-CB 3.41Å; S107-Q111 VanDerWaalsContact O-CG 3.23Å; S107-Q111 WeakPolarHBondContact O-CG 3.37Å; S107-Q111 PolarHBondContact O-N 3.38Å; Y108-Q111 PolarHBondContact O-N 3.16Å; Q111-S114 WeakPolarHBondContact CA-OG 3.31Å; Q111-S114 PolarHBondContact O-OG 2.82Å; Q111-F115 WeakPolarHBondContact O-CB 3.38Å; Q111-F115 PolarHBondContact O-N 2.99Å; Q111-A152 HydrophobicContact CB-CB 4.43Å; Q111-A152 HydrophobicContact CG-CB 4.03Å; Q111-L155 HydrophobicContact CG-CD1 3.73Å; Q111-Y169 HydrophobicContact CB-CD2 4.07Å; Q111-Y169 HydrophobicContact CB-CE2 3.71Å
112	T	97.8	Very high	96.8	Very high	43 Å²	43	43.8 Å²	43.8	26%	0.264	22%	0.219	S	C	.	.	H	α-helix	trans	-66.2	-43.2	175.4	51.5	0	0	0	0	112.2	Y108 T109 F110 L116 Y169	Y108-T112 HydrophobicContact CD2-CG2 4.28Å; Y108-T112 HydrophobicContact CE1-CG2 4.09Å; Y108-T112 HydrophobicContact CE2-CG2 3.86Å; Y108-T112 WeakPolarHBondContact O-CB 3.37Å; Y108-T112 VanDerWaalsContact O-CG2 3.31Å; Y108-T112 WeakPolarHBondContact O-CG2 3.29Å; Y108-T112 PolarHBondContact O-N 3.31Å; Y108-T112 PolarHBondContact O-OG1 3.08Å; T109-T112 PolarHBondContact O-OG1 3.15Å; F110-T112 PolarHBondContact O-N 3.23Å; T112-L116 WeakPolarHBondContact O-CB 3.46Å; T112-L116 PolarHBondContact O-N 3.36Å; T112-Y169 HydrophobicContact CG2-CD2 4.22Å
113	F	97.1	Very high	96.6	Very high	70 Å²	70	39.9 Å²	39.9	31%	0.307	20%	0.202	S	C	.	.	H	α-helix	trans	-69.3	-45.5	178.9	-173.3	-117.4	0	0	0	113	W75 I78 L95 T109 F110 L116 S117	W75-F113 AromaticContact CD1-CD1 3.72Å; W75-F113 AromaticContact CD1-CE1 3.57Å; I78-F113 HydrophobicContact CD1-CD1 3.91Å; I78-F113 HydrophobicContact CD1-CE1 3.29Å; I78-F113 HydrophobicContact CD1-CZ 3.75Å; L95-F113 HydrophobicContact CD2-CB 3.87Å; L95-F113 HydrophobicContact CD2-CD1 3.84Å; L95-F113 HydrophobicContact CD2-CG 4.09Å; T109-F113 WeakPolarHBondContact O-CB 3.24Å; T109-F113 PolarHBondContact O-N 2.88Å; T109-F113 VanDerWaalsContact O-N 3.11Å; F110-F113 PolarHBondContact O-N 3.2Å; F113-L116 PolarHBondContact O-N 3.28Å; F113-S117 WeakPolarHBondContact O-CB 3.49Å; F113-S117 PolarHBondContact O-N 3.06Å; F113-S117 PolarHBondContact O-OG 3.48Å
114	S	96.6	Very high	96.4	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.007	21%	0.212	C	C	.	.	H	α-helix	trans	-61.3	-48	177.6	56	0	0	0	0	111.3	F110 Q111 L116 S117 R118	F110-S114 VanDerWaalsContact O-CB 3.31Å; F110-S114 WeakPolarHBondContact O-CB 3.31Å; F110-S114 PolarHBondContact O-N 3.39Å; F110-S114 PolarHBondContact O-OG 3.33Å; Q111-S114 WeakPolarHBondContact CA-OG 3.31Å; Q111-S114 PolarHBondContact O-OG 2.82Å; S114-L116 PolarHBondContact O-N 2.88Å; S114-S117 PolarHBondContact O-N 3.24Å; S114-S117 PolarHBondContact O-OG 2.94Å; S114-R118 WeakPolarHBondContact O-CB 3.31Å; S114-R118 PolarHBondContact O-N 3.49Å; S114-R118 PolarHBondContact O-NH1 2.99Å
115	F	97.2	Very high	96.1	Very high	10 Å²	10	45 Å²	45	4%	0.044	22%	0.22	C	C	.	.	H	α-helix	trans	-56	-50	173.6	168.5	-108.4	0	0	0	112.2	Q111 S117 R118 L119 V144 D147 H173 L176 L177	Q111-F115 WeakPolarHBondContact O-CB 3.38Å; Q111-F115 PolarHBondContact O-N 2.99Å; F115-S117 PolarHBondContact O-N 3.09Å; F115-R118 PolarHBondContact O-N 3.15Å; F115-L119 HydrophobicContact CE1-CD2 4.27Å; F115-L119 HydrophobicContact CZ-CD2 4.14Å; F115-L119 VanDerWaalsContact O-CB 3.27Å; F115-L119 WeakPolarHBondContact O-CB 3.38Å; F115-L119 PolarHBondContact O-N 2.81Å; F115-V144 HydrophobicContact CD2-CB 4.09Å; F115-V144 HydrophobicContact CD2-CG1 4.12Å; F115-V144 HydrophobicContact CE2-CB 3.88Å; F115-V144 HydrophobicContact CE2-CG1 3.99Å; F115-D147 HydrophobicContact CB-CB 4.39Å; F115-H173 AromaticContact CD2-CD2 3.57Å; F115-H173 AromaticContact CE2-CD2 3.31Å; F115-H173 WeakPolarHBondContact CE2-CD2 3.28Å; F115-H173 AromaticContact CE2-NE2 3.76Å; F115-H173 HydrophobicContact CZ-CB 4.39Å; F115-H173 AromaticContact CZ-CD2 3.88Å; F115-L176 HydrophobicContact CE1-CB 4.33Å; F115-L176 HydrophobicContact CE1-CD1 3.69Å; F115-L176 HydrophobicContact CZ-CB 4.15Å; F115-L176 HydrophobicContact CZ-CD1 4.34Å; F115-L177 HydrophobicContact CE2-CD2 4.11Å; F115-L177 HydrophobicContact CZ-CD2 4.29Å
116	L	95.6	Very high	95.7	Very high	72 Å²	72	42.1 Å²	42.1	38%	0.377	21%	0.211	S	C	.	.	H	α-helix	trans	-62.3	-43.2	-179.8	178.7	61.8	0	0	0	112.1	T112 F113 S114 R118 L119 K120	T112-L116 WeakPolarHBondContact O-CB 3.46Å; T112-L116 PolarHBondContact O-N 3.36Å; F113-L116 PolarHBondContact O-N 3.28Å; S114-L116 PolarHBondContact O-N 2.88Å; L116-R118 VanDerWaalsContact C-N 3.33Å; L116-R118 PolarHBondContact O-N 3.44Å; L116-L119 PolarHBondContact O-N 3.08Å; L116-K120 WeakPolarHBondContact O-CG 3.45Å; L116-K120 PolarHBondContact O-N 3.41Å
117	S	95.1	Very high	95.4	Very high	16 Å²	16	41.8 Å²	41.8	11%	0.112	22%	0.215	C	C	.	.	H	α-helix	trans	-62.1	-41.2	178.1	70.1	0	0	0	0	111.6	P71 W75 F113 S114 F115 K120 V121	P71-S117 WeakPolarHBondContact CG-OG 3.41Å; W75-S117 PolarHBondContact NE1-OG 3.19Å; F113-S117 WeakPolarHBondContact O-CB 3.49Å; F113-S117 PolarHBondContact O-N 3.06Å; F113-S117 PolarHBondContact O-OG 3.48Å; S114-S117 PolarHBondContact O-N 3.24Å; S114-S117 PolarHBondContact O-OG 2.94Å; F115-S117 PolarHBondContact O-N 3.09Å; S117-K120 PolarHBondContact O-N 3.22Å; S117-V121 WeakPolarHBondContact O-CG2 3.48Å; S117-V121 PolarHBondContact O-N 3.44Å
118	R	95.7	Very high	94.9	Very high	9 Å²	9	48.9 Å²	48.9	3%	0.034	25%	0.249	C	C	.	.	H	α-helix	trans	-72.9	-37	178.4	-166.2	175.4	-69.5	99.8	-21.2	112.3	E70 S114 F115 L116 K120 V121 Q122 V144 D147	E70-R118 IonicContact OE1-CZ 2.86Å; E70-R118 IonicContact OE1-NH2 2.79Å; E70-R118 PolarHBondContact OE1-NH2 2.84Å; S114-R118 WeakPolarHBondContact O-CB 3.31Å; S114-R118 PolarHBondContact O-N 3.49Å; S114-R118 PolarHBondContact O-NH1 2.99Å; F115-R118 PolarHBondContact O-N 3.15Å; L116-R118 VanDerWaalsContact C-N 3.33Å; L116-R118 PolarHBondContact O-N 3.44Å; R118-K120 VanDerWaalsContact C-N 3.34Å; R118-V121 PolarHBondContact O-N 3.34Å; R118-Q122 WeakPolarHBondContact O-CG 3.47Å; R118-Q122 PolarHBondContact O-N 3.23Å; R118-V144 HydrophobicContact CG-CG1 4.44Å; R118-D147 IonicContact CZ-OD1 3.28Å; R118-D147 VanDerWaalsContact CZ-OD1 3.24Å; R118-D147 IonicContact CZ-OD2 2.57Å; R118-D147 IonicContact NH1-OD1 3.72Å; R118-D147 PolarHBondContact NH1-OD1 2.86Å; R118-D147 IonicContact NH1-OD2 3.43Å; R118-D147 PolarHBondContact NH1-OD2 3.45Å; R118-D147 IonicContact NH2-OD1 2.83Å; R118-D147 PolarHBondContact NH2-OD1 2.99Å
119	L	95.6	Very high	94.5	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-58.9	-46.1	172.3	177.9	62	0	0	0	110.8	F115 L116 V121 Q122 L123 V144 L176 F180 L184	F115-L119 HydrophobicContact CE1-CD2 4.27Å; F115-L119 HydrophobicContact CZ-CD2 4.14Å; F115-L119 VanDerWaalsContact O-CB 3.27Å; F115-L119 WeakPolarHBondContact O-CB 3.38Å; F115-L119 PolarHBondContact O-N 2.81Å; L116-L119 PolarHBondContact O-N 3.08Å; L119-V121 PolarHBondContact O-N 3.17Å; L119-Q122 PolarHBondContact O-N 3.05Å; L119-L123 HydrophobicContact CD1-CD1 3.84Å; L119-L123 HydrophobicContact CD1-CG 4.07Å; L119-L123 HydrophobicContact CG-CD1 3.91Å; L119-L123 HydrophobicContact CG-CG 4.45Å; L119-L123 VanDerWaalsContact O-CG 3.25Å; L119-L123 WeakPolarHBondContact O-CG 3.37Å; L119-L123 PolarHBondContact O-N 3.38Å; L119-V144 HydrophobicContact CB-CG1 4.2Å; L119-V144 HydrophobicContact CD1-CG1 4.47Å; L119-L176 HydrophobicContact CD2-CB 4.11Å; L119-L176 HydrophobicContact CD2-CD1 4.16Å; L119-F180 HydrophobicContact CD1-CD2 4.2Å; L119-F180 HydrophobicContact CD2-CD2 4.17Å; L119-F180 HydrophobicContact CD2-CE2 4.27Å; L119-L184 HydrophobicContact CD1-CD1 3.47Å; L119-L184 VanDerWaalsContact CD1-CD1 3.47Å; L119-L184 HydrophobicContact CD1-CD2 3.91Å; L119-L184 HydrophobicContact CD1-CG 4.29Å
120	K	94.3	Very high	94.1	Very high	128 Å²	128	50.5 Å²	50.5	56%	0.557	25%	0.253	S	S	*	.	H	α-helix	trans	-56.6	-50	176	-74.8	175.4	177.8	-178.5	0	111.6	L116 S117 R118 Q122 L123 E124	L116-K120 WeakPolarHBondContact O-CG 3.45Å; L116-K120 PolarHBondContact O-N 3.41Å; S117-K120 PolarHBondContact O-N 3.22Å; R118-K120 VanDerWaalsContact C-N 3.34Å; K120-Q122 VanDerWaalsContact C-N 3.29Å; K120-Q122 PolarHBondContact O-N 2.67Å; K120-L123 CarbonylContact O-C 3.59Å; K120-L123 PolarHBondContact O-N 2.84Å; K120-E124 PolarHBondContact O-N 3.46Å
121	V	93.4	Very high	93.6	Very high	25 Å²	25	54.9 Å²	54.9	15%	0.152	28%	0.276	C	S	.	.	H	α-helix	trans	-58.7	-39.6	177.5	171.3	0	0	0	0	112	A68 S117 R118 L119 L123	A68-V121 HydrophobicContact CB-CG1 3.59Å; S117-V121 WeakPolarHBondContact O-CG2 3.48Å; S117-V121 PolarHBondContact O-N 3.44Å; R118-V121 PolarHBondContact O-N 3.34Å; L119-V121 PolarHBondContact O-N 3.17Å; V121-L123 VanDerWaalsContact C-N 3.29Å; V121-L123 PolarHBondContact O-N 3.06Å
122	Q	93.5	Very high	93.1	Very high	2 Å²	2	62.3 Å²	62.3	1%	0.009	31%	0.311	C	S	.	.	H	α-helix	trans	-73.5	-18.4	176.8	-70.9	-167.6	-17.6	0	0	113.9	R40 R118 L119 K120 F140 L184	R40-Q122 PolarHBondContact NH2-O 3.29Å; R118-Q122 WeakPolarHBondContact O-CG 3.47Å; R118-Q122 PolarHBondContact O-N 3.23Å; L119-Q122 PolarHBondContact O-N 3.05Å; K120-Q122 VanDerWaalsContact C-N 3.29Å; K120-Q122 PolarHBondContact O-N 2.67Å; Q122-F140 HydrophobicContact CB-CE1 4.27Å; Q122-F140 HydrophobicContact CB-CZ 4.44Å; Q122-F140 HydrophobicContact CG-CD1 3.81Å; Q122-F140 HydrophobicContact CG-CE1 3.66Å; Q122-F140 HydrophobicContact CG-CG 4.33Å; Q122-F140 HydrophobicContact CG-CZ 4.02Å; Q122-L184 HydrophobicContact CB-CD2 3.53Å
123	L	93.3	Very high	92.6	Very high	36 Å²	36	61.1 Å²	61.1	19%	0.188	31%	0.306	C	S	.	.	H	α-helix	trans	-96.9	-7.9	177.5	-66.2	179	0	0	0	113.7	L119 K120 V121 F180 R183 L184	L119-L123 HydrophobicContact CD1-CD1 3.84Å; L119-L123 HydrophobicContact CD1-CG 4.07Å; L119-L123 HydrophobicContact CG-CD1 3.91Å; L119-L123 HydrophobicContact CG-CG 4.45Å; L119-L123 VanDerWaalsContact O-CG 3.25Å; L119-L123 WeakPolarHBondContact O-CG 3.37Å; L119-L123 PolarHBondContact O-N 3.38Å; K120-L123 CarbonylContact O-C 3.59Å; K120-L123 PolarHBondContact O-N 2.84Å; V121-L123 VanDerWaalsContact C-N 3.29Å; V121-L123 PolarHBondContact O-N 3.06Å; L123-F180 HydrophobicContact CD1-CB 4.47Å; L123-F180 HydrophobicContact CD1-CD1 4.29Å; L123-F180 HydrophobicContact CD1-CD2 3.76Å; L123-F180 HydrophobicContact CD1-CE1 4.48Å; L123-F180 HydrophobicContact CD1-CE2 3.97Å; L123-F180 HydrophobicContact CD1-CG 3.91Å; L123-F180 HydrophobicContact CD1-CZ 4.32Å; L123-F180 HydrophobicContact CD2-CB 4Å; L123-F180 HydrophobicContact CD2-CG 4.23Å; L123-R183 HydrophobicContact CD2-CB 3.65Å; L123-L184 HydrophobicContact CD2-CD2 3.56Å; L123-L184 HydrophobicContact CD2-CG 3.97Å; L123-L184 HydrophobicContact CG-CD2 4.04Å
124	E	92.4	Very high	92	Very high	109 Å²	109	69.2 Å²	69.2	51%	0.509	34%	0.335	S	S	.	.	S	Bend	trans	-58.4	142	175	-80.1	170.4	-166.5	0	0	111.2	K120	K120-E124 PolarHBondContact O-N 3.46Å
125	P	91.4	Very high	91.6	Very high	116 Å²	116	75.6 Å²	75.6	75%	0.753	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-57	149.7	174.3	-23.2	33.6	0	0	0	111.9
126	F	91.6	Very high	91.4	Very high	71 Å²	71	76.4 Å²	76.4	31%	0.311	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-63.6	133.4	173.8	-60.2	-56	0	0	0	110.5	P38 L130 L131 Q138	P38-F126 HydrophobicContact CB-CD1 4.42Å; P38-F126 HydrophobicContact CB-CE1 4.16Å; P38-F126 HydrophobicContact CB-CZ 4.39Å; P38-F126 HydrophobicContact CG-CD1 3.91Å; P38-F126 HydrophobicContact CG-CD2 3.94Å; P38-F126 HydrophobicContact CG-CE1 3.93Å; P38-F126 HydrophobicContact CG-CE2 3.97Å; P38-F126 HydrophobicContact CG-CG 3.91Å; P38-F126 HydrophobicContact CG-CZ 3.97Å; F126-L130 HydrophobicContact CB-CD2 4.19Å; F126-L130 HydrophobicContact CD1-CD2 3.85Å; F126-L130 HydrophobicContact CG-CD2 4.3Å; F126-L131 HydrophobicContact CB-CD1 4.38Å; F126-L131 HydrophobicContact CB-CD2 3.73Å; F126-L131 HydrophobicContact CB-CG 3.93Å; F126-L131 HydrophobicContact CD2-CD2 4.02Å; F126-L131 HydrophobicContact CG-CD2 4.24Å; F126-Q138 VanDerWaalsContact CE1-OE1 3.28Å
127	P	90.9	Very high	91.4	Very high	47 Å²	47	73.1 Å²	73.1	31%	0.305	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-60.2	146.9	173.4	-23.4	33.3	0	0	0	111.7	K129 L130 L131	P127-K129 VanDerWaalsContact C-N 3.26Å; P127-K129 PolarHBondContact O-N 3.19Å; P127-L130 VanDerWaalsContact O-CB 3.31Å; P127-L130 WeakPolarHBondContact O-CB 3.42Å; P127-L130 PolarHBondContact O-N 3.47Å; P127-L131 PolarHBondContact O-N 3.28Å
128	E	88.8	Confident	91.5	Very high	149 Å²	149	72.4 Å²	72.4	70%	0.696	35%	0.346	S	S	*	.	H	α-helix	trans	-55.5	-40.9	-179.3	-66.2	-179.9	-178.8	0	0	112.7	L130 L131 Q132	E128-L130 PolarHBondContact O-N 3.49Å; E128-L131 PolarHBondContact O-N 3.07Å; E128-L131 VanDerWaalsContact O-N 3.08Å; E128-Q132 WeakPolarHBondContact O-CG 3.35Å; E128-Q132 PolarHBondContact O-N 3.49Å
129	K	88.9	Confident	91.6	Very high	133 Å²	133	72 Å²	72	58%	0.578	35%	0.345	S	S	*	.	H	α-helix	trans	-55.1	-40.7	175.9	-173.7	-172.6	-175	-172.2	0	112.1	P63 P127 A133	P63-K129 WeakPolarHBondContact O-CE 3.4Å; P63-K129 PolarHBondContact O-NZ 3.32Å; P127-K129 VanDerWaalsContact C-N 3.26Å; P127-K129 PolarHBondContact O-N 3.19Å; K129-A133 PolarHBondContact O-N 3.13Å
130	L	89.7	Confident	91.7	Very high	3 Å²	3	72 Å²	72	2%	0.016	34%	0.344	C	S	.	.	H	α-helix	trans	-68	-44.3	178.6	-176.9	64.9	0	0	0	110.1	P38 H66 F126 P127 E128 Q132 A133 P136 V137 Q138	P38-L130 HydrophobicContact CB-CD2 3.91Å; P38-L130 HydrophobicContact CB-CG 4.32Å; P38-L130 HydrophobicContact CG-CD2 3.85Å; P38-L130 HydrophobicContact CG-CG 4.12Å; H66-L130 HydrophobicContact CB-CB 4.35Å; H66-L130 HydrophobicContact CB-CD1 4.11Å; H66-L130 HydrophobicContact CB-CD2 3.91Å; H66-L130 HydrophobicContact CB-CG 4.36Å; F126-L130 HydrophobicContact CB-CD2 4.19Å; F126-L130 HydrophobicContact CD1-CD2 3.85Å; F126-L130 HydrophobicContact CG-CD2 4.3Å; P127-L130 VanDerWaalsContact O-CB 3.31Å; P127-L130 WeakPolarHBondContact O-CB 3.42Å; P127-L130 PolarHBondContact O-N 3.47Å; E128-L130 PolarHBondContact O-N 3.49Å; L130-Q132 PolarHBondContact O-N 2.94Å; L130-A133 WeakPolarHBondContact O-CB 3.26Å; L130-A133 PolarHBondContact O-N 3.39Å; L130-A133 VanDerWaalsContact O-N 3.1Å; L130-P136 HydrophobicContact CD1-CB 3.71Å; L130-P136 HydrophobicContact CG-CB 3.98Å; L130-P136 WeakPolarHBondContact O-CB 3.4Å; L130-V137 WeakPolarHBondContact CD1-O 3.37Å; L130-Q138 HydrophobicContact CD2-CB 4.09Å
131	L	88.1	Confident	91.7	Very high	105 Å²	105	66.5 Å²	66.5	55%	0.55	32%	0.321	S	S	.	.	H	α-helix	trans	-63.9	-27	-179.5	-64.4	176.8	0	0	0	113.4	F126 P127 E128	F126-L131 HydrophobicContact CB-CD1 4.38Å; F126-L131 HydrophobicContact CB-CD2 3.73Å; F126-L131 HydrophobicContact CB-CG 3.93Å; F126-L131 HydrophobicContact CD2-CD2 4.02Å; F126-L131 HydrophobicContact CG-CD2 4.24Å; P127-L131 PolarHBondContact O-N 3.28Å; E128-L131 PolarHBondContact O-N 3.07Å; E128-L131 VanDerWaalsContact O-N 3.08Å
132	Q	87.4	Confident	91.9	Very high	159 Å²	159	66.3 Å²	66.3	74%	0.743	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-11.8	177.1	-67.2	173	3.9	0	0	113.5	E128 L130	E128-Q132 WeakPolarHBondContact O-CG 3.35Å; E128-Q132 PolarHBondContact O-N 3.49Å; L130-Q132 PolarHBondContact O-N 2.94Å
133	A	88.2	Confident	92	Very high	19 Å²	19	66.2 Å²	66.2	16%	0.157	32%	0.317	C	S	.	.	S	Bend	trans	-71.8	141.3	-178.8	0	0	0	0	0	111.5	E64 K129 L130 K135 P136	E64-A133 HydrophobicContact CB-CB 4.43Å; K129-A133 PolarHBondContact O-N 3.13Å; L130-A133 WeakPolarHBondContact O-CB 3.26Å; L130-A133 PolarHBondContact O-N 3.39Å; L130-A133 VanDerWaalsContact O-N 3.1Å; A133-K135 VanDerWaalsContact C-N 3.27Å; A133-K135 PolarHBondContact O-N 3.27Å; A133-P136 HydrophobicContact CB-CB 4.42Å; A133-P136 WeakPolarHBondContact O-CD 3.11Å
134	R	85.4	Confident	92.2	Very high	240 Å²	240	64.5 Å²	64.5	91%	0.906	31%	0.308	S	S	*	.	S	Bend	trans	-64	-32.4	177.2	-176.7	177.4	173.6	171.1	-0.2	112.7
135	K	87.9	Confident	92.4	Very high	135 Å²	135	59.9 Å²	59.9	59%	0.587	29%	0.286	S	S	*	.	S	Bend	trans	-132.6	77.6	178.7	-66.8	-174.1	-179.5	-175.2	0	108.6	A133 V137	A133-K135 VanDerWaalsContact C-N 3.27Å; A133-K135 PolarHBondContact O-N 3.27Å; K135-V137 PolarHBondContact O-N 2.77Å
136	P	92.6	Very high	92.7	Very high	27 Å²	27	54.4 Å²	54.4	18%	0.175	25%	0.25	C	S	.	.			trans	-69	127.5	-173.9	24.3	-28.8	0	0	0	111	P38 R39 L130 A133	P38-P136 CarbonylContact C-O 3.52Å; P38-P136 WeakPolarHBondContact CA-O 3.41Å; P38-P136 HydrophobicContact CB-CB 3.92Å; P38-P136 HydrophobicContact CB-CG 4.36Å; P38-P136 HydrophobicContact CG-CB 3.97Å; P38-P136 HydrophobicContact CG-CG 4.31Å; R39-P136 PolarHBondContact N-O 2.9Å; L130-P136 HydrophobicContact CD1-CB 3.71Å; L130-P136 HydrophobicContact CG-CB 3.98Å; L130-P136 WeakPolarHBondContact O-CB 3.4Å; A133-P136 HydrophobicContact CB-CB 4.42Å; A133-P136 WeakPolarHBondContact O-CD 3.11Å
137	V	95.9	Very high	92.9	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.012	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	129.4	174.3	-177.3	0	0	0	0	109.7	R39 L41 W65 H66 L130 K135 I139 I274	R39-V137 HydrophobicContact CB-CG2 4.35Å; R39-V137 CarbonylContact O-C 3.55Å; R39-V137 VanDerWaalsContact O-CA 3.31Å; R39-V137 WeakPolarHBondContact O-CA 3.41Å; L41-V137 HydrophobicContact CD1-CG1 3.71Å; W65-V137 WeakPolarHBondContact CA-O 3.44Å; W65-V137 HydrophobicContact CB-CB 4.36Å; W65-V137 HydrophobicContact CD2-CB 3.58Å; W65-V137 HydrophobicContact CD2-CG1 3.76Å; W65-V137 HydrophobicContact CD2-CG2 4.03Å; W65-V137 HydrophobicContact CE3-CB 4.11Å; W65-V137 HydrophobicContact CE3-CG1 3.73Å; W65-V137 HydrophobicContact CG-CB 3.66Å; W65-V137 HydrophobicContact CG-CG1 4.23Å; W65-V137 HydrophobicContact CG-CG2 4.34Å; W65-V137 HydrophobicContact CZ2-CB 4.47Å; W65-V137 HydrophobicContact CZ2-CG2 4.05Å; W65-V137 HydrophobicContact CZ3-CG1 4.17Å; H66-V137 PolarHBondContact N-O 3.37Å; L130-V137 WeakPolarHBondContact CD1-O 3.37Å; K135-V137 PolarHBondContact O-N 2.77Å; V137-I139 HydrophobicContact CG1-CD1 3.67Å; V137-I139 HydrophobicContact CG1-CG1 4.14Å; V137-I274 HydrophobicContact CG1-CD1 4.24Å; V137-I274 HydrophobicContact CG2-CG2 3.98Å
138	Q	96.6	Very high	93.3	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.009	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	126.6	169.8	-175.4	176.9	39.3	0	0	109.2	R39 R40 L41 H66 F126 L130 F140	R39-Q138 PolarHBondContact O-N 3.16Å; R40-Q138 CarbonylContact C-O 3.48Å; R40-Q138 WeakPolarHBondContact CA-O 3.3Å; R40-Q138 HydrophobicContact CG-CB 4.33Å; L41-Q138 PolarHBondContact N-O 3.2Å; H66-Q138 PolarHBondContact ND1-NE2 2.68Å; H66-Q138 CarbonylContact O-C 3.58Å; H66-Q138 WeakPolarHBondContact O-CA 3.34Å; F126-Q138 VanDerWaalsContact CE1-OE1 3.28Å; L130-Q138 HydrophobicContact CD2-CB 4.09Å; Q138-F140 HydrophobicContact CG-CE1 4.23Å; Q138-F140 HydrophobicContact CG-CE2 3.94Å; Q138-F140 HydrophobicContact CG-CZ 3.72Å
139	I	97.2	Very high	93.7	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	135.1	177.9	-59	-57.8	0	0	0	108.9	L41 I43 L58 W65 H66 V67 A68 V137	L41-I139 HydrophobicContact CB-CD1 3.84Å; L41-I139 HydrophobicContact CD1-CD1 4.05Å; L41-I139 HydrophobicContact CG-CD1 4.44Å; L41-I139 CarbonylContact O-C 3.58Å; L41-I139 WeakPolarHBondContact O-CA 3.47Å; I43-I139 HydrophobicContact CD1-CG2 3.33Å; I43-I139 HydrophobicContact CG1-CG2 3.8Å; L58-I139 HydrophobicContact CD1-CG2 4.31Å; W65-I139 HydrophobicContact CE3-CD1 4.09Å; W65-I139 HydrophobicContact CE3-CG1 3.89Å; W65-I139 HydrophobicContact CZ3-CD1 4.26Å; W65-I139 HydrophobicContact CZ3-CG1 4.48Å; H66-I139 PolarHBondContact O-N 3.4Å; V67-I139 WeakPolarHBondContact CA-O 3.38Å; V67-I139 HydrophobicContact CG1-CB 4.47Å; V67-I139 HydrophobicContact CG1-CG2 4.42Å; V67-I139 HydrophobicContact CG2-CB 4.31Å; A68-I139 PolarHBondContact N-O 3.01Å; V137-I139 HydrophobicContact CG1-CD1 3.67Å; V137-I139 HydrophobicContact CG1-CG1 4.14Å
140	F	97.3	Very high	94.2	Very high	4 Å²	4	36 Å²	36	2%	0.018	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	136.4	171.6	-60.8	-78.4	0	0	0	110.5	R40 L41 S42 I43 A68 Q122 Q138 R142 L186	R40-F140 HydrophobicContact CB-CE2 4.27Å; L41-F140 WeakPolarHBondContact O-CD2 3.43Å; L41-F140 PolarHBondContact O-N 3.35Å; S42-F140 CarbonylContact C-O 3.54Å; S42-F140 WeakPolarHBondContact CA-O 3.25Å; I43-F140 PolarHBondContact N-O 2.81Å; A68-F140 HydrophobicContact CB-CD1 3.53Å; A68-F140 HydrophobicContact CB-CE1 3.77Å; Q122-F140 HydrophobicContact CB-CE1 4.27Å; Q122-F140 HydrophobicContact CB-CZ 4.44Å; Q122-F140 HydrophobicContact CG-CD1 3.81Å; Q122-F140 HydrophobicContact CG-CE1 3.66Å; Q122-F140 HydrophobicContact CG-CG 4.33Å; Q122-F140 HydrophobicContact CG-CZ 4.02Å; Q138-F140 HydrophobicContact CG-CE1 4.23Å; Q138-F140 HydrophobicContact CG-CE2 3.94Å; Q138-F140 HydrophobicContact CG-CZ 3.72Å; F140-R142 VanDerWaalsContact CB-O 3.28Å; F140-R142 WeakPolarHBondContact CB-O 3.22Å; F140-R142 PolarHBondContact O-N 2.94Å; F140-L186 HydrophobicContact CD2-CD2 3.95Å; F140-L186 HydrophobicContact CE2-CD2 4.11Å
141	E	96.1	Very high	94.6	Very high	13 Å²	13	36.6 Å²	36.6	6%	0.061	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	105.3	164.2	-171.1	173.7	-160.1	0	0	108.7	K51 S52 A68 E70	K51-E141 HydrophobicContact CB-CG 4.13Å; K51-E141 WeakPolarHBondContact CB-OE1 3.31Å; K51-E141 HydrophobicContact CD-CG 4.39Å; S52-E141 PolarHBondContact N-OE1 3.3Å; S52-E141 PolarHBondContact OG-OE1 3.3Å; A68-E141 PolarHBondContact O-N 3.29Å; E70-E141 HydrophobicContact CB-CB 4.2Å; E70-E141 HydrophobicContact CB-CG 4.04Å; E70-E141 PolarHBondContact N-OE2 3.1Å; E70-E141 VanDerWaalsContact N-OE2 3.16Å
142	R	97	Very high	95.1	Very high	21 Å²	21	31.6 Å²	31.6	8%	0.079	14%	0.139	C	C	.	.	S	Bend	trans	63.7	174.2	-166.1	-62.4	-167.1	178.6	133.6	-7.2	114.7	S42 I43 K51 E70 F140 F151	S42-R142 WeakPolarHBondContact OG-CA 3.48Å; S42-R142 PolarHBondContact OG-O 3.15Å; I43-R142 WeakPolarHBondContact O-CA 3.48Å; I43-R142 PolarHBondContact O-N 2.82Å; K51-R142 HydrophobicContact CD-CG 4.18Å; E70-R142 WeakPolarHBondContact OE1-CD 3.45Å; E70-R142 IonicContact OE1-CZ 2.91Å; E70-R142 IonicContact OE1-NE 3.16Å; E70-R142 IonicContact OE1-NH1 3.72Å; E70-R142 PolarHBondContact OE1-NH1 2.92Å; E70-R142 IonicContact OE2-NH1 2.65Å; E70-R142 PolarHBondContact OE2-NH1 3.04Å; E70-R142 VanDerWaalsContact OE2-NH1 3.16Å; F140-R142 VanDerWaalsContact CB-O 3.28Å; F140-R142 WeakPolarHBondContact CB-O 3.22Å; F140-R142 PolarHBondContact O-N 2.94Å; R142-F151 VanDerWaalsContact NH2-CZ 3.29Å
143	S	96	Very high	95.6	Very high	0 Å²	0	26 Å²	26	0%	0	11%	0.112	C	C	.	.			trans	-134.5	162.2	178.4	66.4	0	0	0	0	111.8	S42 E44 Y145 S146 D147	S42-S143 PolarHBondContact OG-N 3.34Å; E44-S143 VanDerWaalsContact OE1-CB 3.26Å; E44-S143 WeakPolarHBondContact OE1-CB 3.21Å; E44-S143 PolarHBondContact OE1-N 3.03Å; E44-S143 PolarHBondContact OE1-OG 3.43Å; S143-Y145 PolarHBondContact O-N 3.14Å; S143-Y145 VanDerWaalsContact O-N 3.09Å; S143-Y145 WeakPolarHBondContact OG-CB 3.44Å; S143-Y145 PolarHBondContact OG-N 3.04Å; S143-S146 PolarHBondContact N-OG 3.23Å; S143-S146 PolarHBondContact O-N 2.75Å; S143-S146 PolarHBondContact O-OG 3.41Å; S143-S146 PolarHBondContact OG-N 3.01Å; S143-D147 PolarHBondContact O-N 2.88Å
144	V	96.2	Very high	96.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-52.4	-26.9	168.4	-68.2	0	0	0	0	112.5	F115 R118 L119 D147 H173 L177	F115-V144 HydrophobicContact CD2-CB 4.09Å; F115-V144 HydrophobicContact CD2-CG1 4.12Å; F115-V144 HydrophobicContact CE2-CB 3.88Å; F115-V144 HydrophobicContact CE2-CG1 3.99Å; R118-V144 HydrophobicContact CG-CG1 4.44Å; L119-V144 HydrophobicContact CB-CG1 4.2Å; L119-V144 HydrophobicContact CD1-CG1 4.47Å; V144-D147 WeakPolarHBondContact O-CB 3.47Å; V144-D147 PolarHBondContact O-N 2.86Å; V144-H173 PolarHBondContact O-NE2 2.75Å; V144-H173 VanDerWaalsContact O-NE2 3.07Å; V144-L177 HydrophobicContact CB-CD2 4.16Å; V144-L177 HydrophobicContact CG2-CD1 4.13Å; V144-L177 HydrophobicContact CG2-CD2 3.73Å
145	Y	97.1	Very high	96.8	Very high	12 Å²	12	14 Å²	14	5%	0.047	6%	0.064	C	C	.	.	H	α-helix	trans	-72.7	-39.9	178	-51.9	-67.6	0	0	0	112.1	S143 D147 R148 Y149 L177 L186 F189 F239 L242	S143-Y145 PolarHBondContact O-N 3.14Å; S143-Y145 VanDerWaalsContact O-N 3.09Å; S143-Y145 WeakPolarHBondContact OG-CB 3.44Å; S143-Y145 PolarHBondContact OG-N 3.04Å; Y145-D147 PolarHBondContact O-N 3.17Å; Y145-R148 PolarHBondContact O-N 3.24Å; Y145-Y149 HydrophobicContact CD1-CE2 4.49Å; Y145-Y149 WeakPolarHBondContact O-CB 3.38Å; Y145-Y149 VanDerWaalsContact O-CD2 3.23Å; Y145-Y149 WeakPolarHBondContact O-CD2 3.4Å; Y145-Y149 PolarHBondContact O-N 2.84Å; Y145-L177 HydrophobicContact CD1-CD1 3.78Å; Y145-L177 HydrophobicContact CE1-CD1 3.43Å; Y145-L177 VanDerWaalsContact CE1-CD1 3.43Å; Y145-L186 HydrophobicContact CD2-CD1 3.79Å; Y145-L186 HydrophobicContact CE2-CD1 3.64Å; Y145-L186 HydrophobicContact CE2-CG 4.14Å; Y145-F189 HydrophobicContact CD2-CE1 4.46Å; Y145-F189 HydrophobicContact CD2-CZ 4.1Å; Y145-F239 HydrophobicContact CD1-CD2 4.33Å; Y145-F239 HydrophobicContact CE1-CD2 4.23Å; Y145-F239 HydrophobicContact CE1-CG 4.44Å; Y145-L242 HydrophobicContact CD1-CD1 3.28Å; Y145-L242 HydrophobicContact CD1-CD2 3.8Å; Y145-L242 HydrophobicContact CD1-CG 3.94Å; Y145-L242 HydrophobicContact CD2-CD2 3.65Å; Y145-L242 HydrophobicContact CE1-CD1 3.56Å; Y145-L242 HydrophobicContact CE1-CD2 3.72Å; Y145-L242 HydrophobicContact CE1-CG 3.78Å; Y145-L242 HydrophobicContact CE2-CD2 3.62Å; Y145-L242 HydrophobicContact CG-CD1 3.82Å; Y145-L242 HydrophobicContact CG-CD2 3.72Å; Y145-L242 HydrophobicContact CG-CG 4.32Å
146	S	97.4	Very high	97.3	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-63.7	-31.4	175.1	72	0	0	0	0	112.2	E44 S143 R148 I150 F151	E44-S146 VanDerWaalsContact OE2-CB 3.24Å; E44-S146 WeakPolarHBondContact OE2-CB 3.44Å; E44-S146 PolarHBondContact OE2-OG 2.88Å; S143-S146 PolarHBondContact N-OG 3.23Å; S143-S146 PolarHBondContact O-N 2.75Å; S143-S146 PolarHBondContact O-OG 3.41Å; S143-S146 PolarHBondContact OG-N 3.01Å; S146-R148 VanDerWaalsContact C-N 3.33Å; S146-R148 PolarHBondContact O-N 3.37Å; S146-I150 WeakPolarHBondContact O-CA 3.49Å; S146-I150 WeakPolarHBondContact O-CB 3.4Å; S146-I150 PolarHBondContact O-N 2.86Å; S146-F151 WeakPolarHBondContact O-CD2 3.44Å; S146-F151 PolarHBondContact O-N 2.84Å; S146-F151 VanDerWaalsContact O-N 3.14Å
147	D	97.4	Very high	97.5	Very high	2 Å²	2	14.3 Å²	14.3	1%	0.011	6%	0.064	C	C	.	.	I	π-helix	trans	-56.9	-48.5	174.2	-67.9	-43.6	0	0	0	111.4	F115 R118 S143 V144 Y145 F151 A152 Y169	F115-D147 HydrophobicContact CB-CB 4.39Å; R118-D147 IonicContact CZ-OD1 3.28Å; R118-D147 VanDerWaalsContact CZ-OD1 3.24Å; R118-D147 IonicContact CZ-OD2 2.57Å; R118-D147 IonicContact NH1-OD1 3.72Å; R118-D147 PolarHBondContact NH1-OD1 2.86Å; R118-D147 IonicContact NH1-OD2 3.43Å; R118-D147 PolarHBondContact NH1-OD2 3.45Å; R118-D147 IonicContact NH2-OD1 2.83Å; R118-D147 PolarHBondContact NH2-OD1 2.99Å; S143-D147 PolarHBondContact O-N 2.88Å; V144-D147 WeakPolarHBondContact O-CB 3.47Å; V144-D147 PolarHBondContact O-N 2.86Å; Y145-D147 PolarHBondContact O-N 3.17Å; D147-F151 PolarHBondContact O-N 2.88Å; D147-A152 VanDerWaalsContact O-CB 3.26Å; D147-A152 WeakPolarHBondContact O-CB 3.37Å; D147-A152 PolarHBondContact O-N 2.76Å; D147-Y169 WeakPolarHBondContact CB-OH 3.39Å
148	R	98	Very high	97.6	Very high	6 Å²	6	17 Å²	17	2%	0.023	8%	0.078	C	C	.	.	I	π-helix	trans	-77.2	-54.1	-179.6	178.5	169.8	-179.5	175.1	-0.3	113.1	Y145 S146 K153 W166 Y169 H173 S174	Y145-R148 PolarHBondContact O-N 3.24Å; S146-R148 VanDerWaalsContact C-N 3.33Å; S146-R148 PolarHBondContact O-N 3.37Å; R148-K153 VanDerWaalsContact O-CB 3.24Å; R148-K153 WeakPolarHBondContact O-CB 3.43Å; R148-K153 PolarHBondContact O-N 3.48Å; R148-W166 HydrophobicContact CG-CH2 4.09Å; R148-Y169 HydrophobicContact CB-CE1 3.95Å; R148-Y169 HydrophobicContact CG-CE1 4.07Å; R148-Y169 PolarHBondContact N-OH 3.44Å; R148-H173 WeakPolarHBondContact CB-NE2 3.37Å; R148-H173 WeakPolarHBondContact CD-ND1 3.42Å; R148-S174 PolarHBondContact NH1-OG 3.46Å
149	Y	98.3	Very high	97.6	Very high	6 Å²	6	19.6 Å²	19.6	2%	0.024	11%	0.106	C	C	.	.	I	π-helix	trans	-84.5	-15.3	-165.9	-64.2	-65.9	0	0	0	113.7	Y145 T235 L237 H238 F239 L242	Y145-Y149 HydrophobicContact CD1-CE2 4.49Å; Y145-Y149 WeakPolarHBondContact O-CB 3.38Å; Y145-Y149 VanDerWaalsContact O-CD2 3.23Å; Y145-Y149 WeakPolarHBondContact O-CD2 3.4Å; Y145-Y149 PolarHBondContact O-N 2.84Å; Y149-T235 HydrophobicContact CD1-CG2 4.08Å; Y149-L237 HydrophobicContact CD1-CD2 3.95Å; Y149-L237 HydrophobicContact CD2-CD2 4.05Å; Y149-L237 HydrophobicContact CE1-CD2 3.88Å; Y149-L237 HydrophobicContact CE2-CD2 4.01Å; Y149-L237 HydrophobicContact CG-CD2 4.04Å; Y149-H238 AromaticContact CE1-ND1 3.63Å; Y149-H238 AromaticContact CZ-ND1 3.85Å; Y149-H238 PolarHBondContact OH-N 3.32Å; Y149-H238 PolarHBondContact OH-ND1 2.89Å; Y149-H238 VanDerWaalsContact OH-ND1 3.14Å; Y149-F239 HydrophobicContact CE2-CD2 4.01Å; Y149-F239 HydrophobicContact CE2-CE2 4.05Å; Y149-F239 WeakPolarHBondContact OH-CD2 3.36Å; Y149-F239 WeakPolarHBondContact OH-CE2 3.31Å; Y149-L242 HydrophobicContact CE2-CD1 3.98Å
150	I	98.5	Very high	97.7	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.111	C	C	.	.	I	π-helix	trans	-107.9	-68.5	173.3	-55.1	-57.8	0	0	0	109.7	S146 N154 L222 Q225 H226 W229	S146-I150 WeakPolarHBondContact O-CA 3.49Å; S146-I150 WeakPolarHBondContact O-CB 3.4Å; S146-I150 PolarHBondContact O-N 2.86Å; I150-N154 WeakPolarHBondContact O-CB 3.49Å; I150-N154 PolarHBondContact O-N 2.81Å; I150-N154 VanDerWaalsContact O-N 3.09Å; I150-L222 HydrophobicContact CG2-CD2 3.99Å; I150-Q225 HydrophobicContact CB-CB 4.5Å; I150-Q225 HydrophobicContact CD1-CB 3.51Å; I150-Q225 WeakPolarHBondContact CD1-O 3.27Å; I150-Q225 HydrophobicContact CG2-CB 4.26Å; I150-H226 HydrophobicContact CD1-CB 4.41Å; I150-H226 WeakPolarHBondContact CG2-CE1 3.37Å; I150-W229 HydrophobicContact CD1-CB 4.46Å; I150-W229 HydrophobicContact CD1-CE3 3.82Å; I150-W229 HydrophobicContact CG1-CE3 3.9Å; I150-W229 HydrophobicContact CG1-CZ3 4.16Å
151	F	98.4	Very high	97.7	Very high	15 Å²	15	20.3 Å²	20.3	7%	0.066	11%	0.111	C	C	.	.	I	π-helix	trans	-77.2	-56.6	-165.2	-63.6	-78.3	0	0	0	113.1	I47 R142 S146 D147 K153 N154 L155 L222	I47-F151 HydrophobicContact CG1-CE1 4.46Å; R142-F151 VanDerWaalsContact NH2-CZ 3.29Å; S146-F151 WeakPolarHBondContact O-CD2 3.44Å; S146-F151 PolarHBondContact O-N 2.84Å; S146-F151 VanDerWaalsContact O-N 3.14Å; D147-F151 PolarHBondContact O-N 2.88Å; F151-K153 PolarHBondContact O-N 2.8Å; F151-N154 PolarHBondContact O-N 2.8Å; F151-L155 VanDerWaalsContact O-CG 3.31Å; F151-L155 WeakPolarHBondContact O-CG 3.46Å; F151-L155 PolarHBondContact O-N 3.25Å; F151-L222 HydrophobicContact CD1-CD1 4.47Å; F151-L222 HydrophobicContact CD1-CD2 3.99Å; F151-L222 HydrophobicContact CE1-CD1 3.94Å; F151-L222 HydrophobicContact CE1-CD2 4.08Å
152	A	98.5	Very high	97.9	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.126	C	C	.	.	I	π-helix	trans	-64.9	-41.6	-178.8	0	0	0	0	0	111.9	Q111 D147 N154 L155 F156 L161 W166 Y169	Q111-A152 HydrophobicContact CB-CB 4.43Å; Q111-A152 HydrophobicContact CG-CB 4.03Å; D147-A152 VanDerWaalsContact O-CB 3.26Å; D147-A152 WeakPolarHBondContact O-CB 3.37Å; D147-A152 PolarHBondContact O-N 2.76Å; A152-N154 VanDerWaalsContact C-N 3.32Å; A152-N154 PolarHBondContact O-N 2.93Å; A152-L155 PolarHBondContact O-N 2.95Å; A152-F156 PolarHBondContact O-N 2.85Å; A152-L161 HydrophobicContact CB-CD1 4.35Å; A152-L161 WeakPolarHBondContact O-CD1 3.34Å; A152-W166 HydrophobicContact CB-CZ3 3.82Å; A152-Y169 HydrophobicContact CB-CD1 3.87Å; A152-Y169 HydrophobicContact CB-CE1 3.38Å; A152-Y169 HydrophobicContact CB-CE2 4.28Å
153	K	98.5	Very high	97.9	Very high	43 Å²	43	27.1 Å²	27.1	19%	0.187	15%	0.153	C	C	.	.	H	α-helix	trans	-56.6	-46.3	172	179.3	177.7	-179.9	-69.7	0	111.4	R148 F151 F156 E157 W166	R148-K153 VanDerWaalsContact O-CB 3.24Å; R148-K153 WeakPolarHBondContact O-CB 3.43Å; R148-K153 PolarHBondContact O-N 3.48Å; F151-K153 PolarHBondContact O-N 2.8Å; K153-F156 PolarHBondContact O-N 3.36Å; K153-E157 WeakPolarHBondContact CE-OE1 3.22Å; K153-E157 HydrophobicContact CG-CG 4.49Å; K153-E157 IonicContact NZ-OE1 3.64Å; K153-E157 PolarHBondContact NZ-OE1 2.82Å; K153-E157 IonicContact NZ-OE2 3.88Å; K153-E157 PolarHBondContact NZ-OE2 3.04Å; K153-E157 WeakPolarHBondContact O-CG 3.5Å; K153-E157 PolarHBondContact O-N 3.27Å; K153-W166 HydrophobicContact CB-CH2 4.23Å
154	N	98.6	Very high	98.1	Very high	4 Å²	4	33 Å²	33	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-64.5	-41.8	179	-164.8	73.1	0	0	0	112.8	I150 F151 A152 F156 E157 N158 Y218 Q221 L222 Q225	I150-N154 WeakPolarHBondContact O-CB 3.49Å; I150-N154 PolarHBondContact O-N 2.81Å; I150-N154 VanDerWaalsContact O-N 3.09Å; F151-N154 PolarHBondContact O-N 2.8Å; A152-N154 VanDerWaalsContact C-N 3.32Å; A152-N154 PolarHBondContact O-N 2.93Å; N154-F156 VanDerWaalsContact C-N 3.27Å; N154-F156 PolarHBondContact O-N 3.1Å; N154-E157 PolarHBondContact O-N 3.43Å; N154-N158 WeakPolarHBondContact O-CB 3.48Å; N154-N158 PolarHBondContact O-N 3.17Å; N154-N158 PolarHBondContact O-ND2 3.27Å; N154-Y218 WeakPolarHBondContact ND2-CE2 3.44Å; N154-Q221 PolarHBondContact ND2-OE1 2.97Å; N154-Q221 WeakPolarHBondContact OD1-CB 3.47Å; N154-L222 HydrophobicContact CB-CD2 4.01Å; N154-Q225 HydrophobicContact CB-CG 4.23Å; N154-Q225 PolarHBondContact OD1-NE2 2.7Å
155	L	98.5	Very high	98.2	Very high	3 Å²	3	35 Å²	35	2%	0.016	19%	0.193	C	C	.	.	H	α-helix	trans	-66.1	-31.1	177.4	-69.7	167.9	0	0	0	112.1	Q111 F151 A152 N158 G159 S160 L161	Q111-L155 HydrophobicContact CG-CD1 3.73Å; F151-L155 VanDerWaalsContact O-CG 3.31Å; F151-L155 WeakPolarHBondContact O-CG 3.46Å; F151-L155 PolarHBondContact O-N 3.25Å; A152-L155 PolarHBondContact O-N 2.95Å; L155-N158 WeakPolarHBondContact CA-OD1 3.18Å; L155-N158 PolarHBondContact O-OD1 3.27Å; L155-G159 PolarHBondContact O-N 3.08Å; L155-S160 CarbonylContact O-C 3.59Å; L155-S160 WeakPolarHBondContact O-CA 3.36Å; L155-S160 WeakPolarHBondContact O-CB 3.37Å; L155-S160 PolarHBondContact O-N 3Å; L155-L161 HydrophobicContact CB-CD1 4.06Å; L155-L161 HydrophobicContact CB-CG 3.96Å; L155-L161 PolarHBondContact O-N 2.91Å
156	F	98.6	Very high	98.3	Very high	59 Å²	59	36 Å²	36	26%	0.259	20%	0.197	S	C	.	.	H	α-helix	trans	-68.8	-50.6	169.2	173.5	-113.3	0	0	0	111.7	A152 K153 N154 N158 G159 L161 D163 W166	A152-F156 PolarHBondContact O-N 2.85Å; K153-F156 PolarHBondContact O-N 3.36Å; N154-F156 VanDerWaalsContact C-N 3.27Å; N154-F156 PolarHBondContact O-N 3.1Å; F156-N158 VanDerWaalsContact C-N 3.25Å; F156-N158 PolarHBondContact O-N 3.26Å; F156-G159 PolarHBondContact O-N 3.31Å; F156-L161 HydrophobicContact CB-CB 4.21Å; F156-L161 HydrophobicContact CB-CD1 4.38Å; F156-D163 WeakPolarHBondContact CE2-OD1 3.4Å; F156-W166 HydrophobicContact CB-CB 4.27Å; F156-W166 HydrophobicContact CB-CD2 3.97Å; F156-W166 HydrophobicContact CB-CE3 4.25Å; F156-W166 HydrophobicContact CB-CG 3.98Å; F156-W166 AromaticContact CD1-CD1 3.46Å; F156-W166 VanDerWaalsContact CD1-CD1 3.46Å; F156-W166 HydrophobicContact CD1-CD2 4.2Å; F156-W166 AromaticContact CD1-CE2 3.98Å; F156-W166 AromaticContact CD1-CG 3.9Å; F156-W166 HydrophobicContact CD1-CG 3.9Å; F156-W166 AromaticContact CD1-NE1 3.48Å; F156-W166 HydrophobicContact CD2-CB 3.41Å; F156-W166 VanDerWaalsContact CD2-CB 3.41Å; F156-W166 AromaticContact CD2-CD1 3.61Å; F156-W166 HydrophobicContact CD2-CD2 4.41Å; F156-W166 AromaticContact CD2-CG 3.54Å; F156-W166 HydrophobicContact CD2-CG 3.54Å; F156-W166 AromaticContact CE1-CD1 3.47Å; F156-W166 VanDerWaalsContact CE1-CD1 3.47Å; F156-W166 HydrophobicContact CE1-CG 4.28Å; F156-W166 AromaticContact CE1-NE1 3.61Å; F156-W166 HydrophobicContact CE2-CB 3.87Å; F156-W166 AromaticContact CE2-CD1 3.62Å; F156-W166 AromaticContact CE2-CG 3.96Å; F156-W166 HydrophobicContact CE2-CG 3.96Å; F156-W166 HydrophobicContact CG-CB 3.86Å; F156-W166 AromaticContact CG-CD1 3.52Å; F156-W166 AromaticContact CG-CD2 3.92Å; F156-W166 HydrophobicContact CG-CD2 3.92Å; F156-W166 AromaticContact CG-CG 3.5Å; F156-W166 HydrophobicContact CG-CG 3.5Å; F156-W166 AromaticContact CG-NE1 3.91Å; F156-W166 AromaticContact CZ-CD1 3.54Å; F156-W166 HydrophobicContact CZ-CG 4.31Å
157	E	98.1	Very high	98.3	Very high	108 Å²	108	41.9 Å²	41.9	51%	0.505	22%	0.224	S	C	.	.	H	α-helix	trans	-65	-26.9	-177.1	-72.6	177.3	169.2	0	0	113.6	K153 N154 Q225	K153-E157 WeakPolarHBondContact CE-OE1 3.22Å; K153-E157 HydrophobicContact CG-CG 4.49Å; K153-E157 IonicContact NZ-OE1 3.64Å; K153-E157 PolarHBondContact NZ-OE1 2.82Å; K153-E157 IonicContact NZ-OE2 3.88Å; K153-E157 PolarHBondContact NZ-OE2 3.04Å; K153-E157 WeakPolarHBondContact O-CG 3.5Å; K153-E157 PolarHBondContact O-N 3.27Å; N154-E157 PolarHBondContact O-N 3.43Å; E157-Q225 PolarHBondContact OE2-NE2 3.16Å
158	N	96.9	Very high	98.4	Very high	58 Å²	58	44.7 Å²	44.7	31%	0.31	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	3.5	175.6	78.7	14.3	0	0	0	114.2	N154 L155 F156 S160	N154-N158 WeakPolarHBondContact O-CB 3.48Å; N154-N158 PolarHBondContact O-N 3.17Å; N154-N158 PolarHBondContact O-ND2 3.27Å; L155-N158 WeakPolarHBondContact CA-OD1 3.18Å; L155-N158 PolarHBondContact O-OD1 3.27Å; F156-N158 VanDerWaalsContact C-N 3.25Å; F156-N158 PolarHBondContact O-N 3.26Å; N158-S160 VanDerWaalsContact OD1-CB 3.27Å; N158-S160 WeakPolarHBondContact OD1-CB 3.28Å; N158-S160 PolarHBondContact OD1-N 3.23Å; N158-S160 VanDerWaalsContact OD1-N 3.13Å; N158-S160 PolarHBondContact OD1-OG 3.03Å
159	G	97.9	Very high	98.4	Very high	58 Å²	58	44.7 Å²	44.7	60%	0.598	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.4	8.5	175.7	0	0	0	0	0	115.9	L155 F156	L155-G159 PolarHBondContact O-N 3.08Å; F156-G159 PolarHBondContact O-N 3.31Å
160	S	98.3	Very high	98.4	Very high	14 Å²	14	46.4 Å²	46.4	10%	0.098	25%	0.247	C	C	.	.	S	Bend	trans	-80.2	-19	175.6	-55.2	0	0	0	0	113.9	A104 S107 L155 N158	A104-S160 WeakPolarHBondContact CA-O 3.28Å; S107-S160 WeakPolarHBondContact OG-CB 3.43Å; L155-S160 CarbonylContact O-C 3.59Å; L155-S160 WeakPolarHBondContact O-CA 3.36Å; L155-S160 WeakPolarHBondContact O-CB 3.37Å; L155-S160 PolarHBondContact O-N 3Å; N158-S160 VanDerWaalsContact OD1-CB 3.27Å; N158-S160 WeakPolarHBondContact OD1-CB 3.28Å; N158-S160 PolarHBondContact OD1-N 3.23Å; N158-S160 VanDerWaalsContact OD1-N 3.13Å; N158-S160 PolarHBondContact OD1-OG 3.03Å
161	L	98.6	Very high	98.4	Very high	4 Å²	4	51.2 Å²	51.2	2%	0.021	27%	0.272	C	S	.	.	S	Bend	trans	-111.9	133	166.4	-64.5	174.6	0	0	0	109.2	Y108 A152 L155 F156 E165 W166	Y108-L161 VanDerWaalsContact N-CD2 3.27Å; A152-L161 HydrophobicContact CB-CD1 4.35Å; A152-L161 WeakPolarHBondContact O-CD1 3.34Å; L155-L161 HydrophobicContact CB-CD1 4.06Å; L155-L161 HydrophobicContact CB-CG 3.96Å; L155-L161 PolarHBondContact O-N 2.91Å; F156-L161 HydrophobicContact CB-CB 4.21Å; F156-L161 HydrophobicContact CB-CD1 4.38Å; L161-E165 HydrophobicContact CB-CB 4.44Å; L161-E165 HydrophobicContact CD2-CB 4.18Å; L161-W166 HydrophobicContact CD1-CE3 4.36Å
162	S	98.6	Very high	98.2	Very high	56 Å²	56	57.5 Å²	57.5	39%	0.392	30%	0.296	S	S	.	.			trans	-70.9	164.1	168.9	62.9	0	0	0	0	112.1	I164 E165 W166	S162-I164 PolarHBondContact O-N 2.65Å; S162-E165 WeakPolarHBondContact CB-OE2 3.43Å; S162-E165 PolarHBondContact N-OE2 3.09Å; S162-E165 PolarHBondContact O-N 3.33Å; S162-E165 WeakPolarHBondContact OG-CB 3.33Å; S162-E165 VanDerWaalsContact OG-CG 3.28Å; S162-E165 WeakPolarHBondContact OG-CG 3.48Å; S162-E165 PolarHBondContact OG-N 2.76Å; S162-E165 PolarHBondContact OG-OE2 3Å; S162-W166 WeakPolarHBondContact O-CB 3.46Å; S162-W166 PolarHBondContact O-N 3.04Å
163	D	98.6	Very high	98.1	Very high	121 Å²	121	57.5 Å²	57.5	65%	0.647	30%	0.296	S	S	*	.	H	α-helix	trans	-56.4	-37.5	174.9	-64.1	-62.9	0	0	0	112.6	F156 H167	F156-D163 WeakPolarHBondContact CE2-OD1 3.4Å; D163-H167 VanDerWaalsContact O-CB 3.27Å; D163-H167 WeakPolarHBondContact O-CB 3.47Å; D163-H167 PolarHBondContact O-N 3.31Å
164	I	98.6	Very high	98	Very high	124 Å²	124	57.3 Å²	57.3	64%	0.636	30%	0.3	S	S	*	.	H	α-helix	trans	-67.1	-49.4	178.2	-65	176.8	0	0	0	110.1	S162 W166 H167 I168	S162-I164 PolarHBondContact O-N 2.65Å; I164-W166 VanDerWaalsContact C-N 3.33Å; I164-W166 PolarHBondContact O-N 3.05Å; I164-H167 PolarHBondContact O-N 3.27Å; I164-I168 HydrophobicContact CG2-CD1 3.69Å; I164-I168 HydrophobicContact CG2-CG1 4.44Å; I164-I168 VanDerWaalsContact O-CG1 3.27Å; I164-I168 WeakPolarHBondContact O-CG1 3.1Å; I164-I168 PolarHBondContact O-N 3.49Å
165	E	98.7	Very high	97.9	Very high	42 Å²	42	62.3 Å²	62.3	20%	0.196	32%	0.322	C	S	.	.	H	α-helix	trans	-62.6	-41.2	179	-73.2	167.6	130.4	0	0	111.7	Y108 L161 S162 I168 Y169	Y108-E165 VanDerWaalsContact CB-OE1 3.29Å; Y108-E165 WeakPolarHBondContact CB-OE1 3.2Å; Y108-E165 HydrophobicContact CD2-CB 3.67Å; Y108-E165 HydrophobicContact CD2-CG 3.98Å; Y108-E165 HydrophobicContact CE2-CB 4.43Å; Y108-E165 HydrophobicContact CG-CB 4.04Å; Y108-E165 HydrophobicContact CG-CG 3.88Å; L161-E165 HydrophobicContact CB-CB 4.44Å; L161-E165 HydrophobicContact CD2-CB 4.18Å; S162-E165 WeakPolarHBondContact CB-OE2 3.43Å; S162-E165 PolarHBondContact N-OE2 3.09Å; S162-E165 PolarHBondContact O-N 3.33Å; S162-E165 WeakPolarHBondContact OG-CB 3.33Å; S162-E165 VanDerWaalsContact OG-CG 3.28Å; S162-E165 WeakPolarHBondContact OG-CG 3.48Å; S162-E165 PolarHBondContact OG-N 2.76Å; S162-E165 PolarHBondContact OG-OE2 3Å; E165-I168 PolarHBondContact O-N 2.69Å; E165-Y169 VanDerWaalsContact O-CB 3.22Å; E165-Y169 WeakPolarHBondContact O-CB 3.44Å; E165-Y169 PolarHBondContact O-N 2.56Å
166	W	98.6	Very high	97.8	Very high	32 Å²	32	63.5 Å²	63.5	12%	0.121	33%	0.328	C	S	.	.	H	α-helix	trans	-65.3	-42.5	176.5	177.8	-131.6	0	0	0	112.1	R148 A152 K153 F156 L161 S162 I164 Y169 Q170	R148-W166 HydrophobicContact CG-CH2 4.09Å; A152-W166 HydrophobicContact CB-CZ3 3.82Å; K153-W166 HydrophobicContact CB-CH2 4.23Å; F156-W166 HydrophobicContact CB-CB 4.27Å; F156-W166 HydrophobicContact CB-CD2 3.97Å; F156-W166 HydrophobicContact CB-CE3 4.25Å; F156-W166 HydrophobicContact CB-CG 3.98Å; F156-W166 AromaticContact CD1-CD1 3.46Å; F156-W166 VanDerWaalsContact CD1-CD1 3.46Å; F156-W166 HydrophobicContact CD1-CD2 4.2Å; F156-W166 AromaticContact CD1-CE2 3.98Å; F156-W166 AromaticContact CD1-CG 3.9Å; F156-W166 HydrophobicContact CD1-CG 3.9Å; F156-W166 AromaticContact CD1-NE1 3.48Å; F156-W166 HydrophobicContact CD2-CB 3.41Å; F156-W166 VanDerWaalsContact CD2-CB 3.41Å; F156-W166 AromaticContact CD2-CD1 3.61Å; F156-W166 HydrophobicContact CD2-CD2 4.41Å; F156-W166 AromaticContact CD2-CG 3.54Å; F156-W166 HydrophobicContact CD2-CG 3.54Å; F156-W166 AromaticContact CE1-CD1 3.47Å; F156-W166 VanDerWaalsContact CE1-CD1 3.47Å; F156-W166 HydrophobicContact CE1-CG 4.28Å; F156-W166 AromaticContact CE1-NE1 3.61Å; F156-W166 HydrophobicContact CE2-CB 3.87Å; F156-W166 AromaticContact CE2-CD1 3.62Å; F156-W166 AromaticContact CE2-CG 3.96Å; F156-W166 HydrophobicContact CE2-CG 3.96Å; F156-W166 HydrophobicContact CG-CB 3.86Å; F156-W166 AromaticContact CG-CD1 3.52Å; F156-W166 AromaticContact CG-CD2 3.92Å; F156-W166 HydrophobicContact CG-CD2 3.92Å; F156-W166 AromaticContact CG-CG 3.5Å; F156-W166 HydrophobicContact CG-CG 3.5Å; F156-W166 AromaticContact CG-NE1 3.91Å; F156-W166 AromaticContact CZ-CD1 3.54Å; F156-W166 HydrophobicContact CZ-CG 4.31Å; L161-W166 HydrophobicContact CD1-CE3 4.36Å; S162-W166 WeakPolarHBondContact O-CB 3.46Å; S162-W166 PolarHBondContact O-N 3.04Å; I164-W166 VanDerWaalsContact C-N 3.33Å; I164-W166 PolarHBondContact O-N 3.05Å; W166-Y169 AromaticContact CE3-CD1 3.96Å; W166-Y169 HydrophobicContact CE3-CD1 3.96Å; W166-Y169 AromaticContact CZ3-CD1 3.61Å; W166-Y169 HydrophobicContact CZ3-CD1 3.61Å; W166-Y169 HydrophobicContact CZ3-CE1 4.03Å; W166-Q170 VanDerWaalsContact CD1-NE2 3.34Å; W166-Q170 HydrophobicContact CD2-CG 3.82Å; W166-Q170 HydrophobicContact CE3-CG 3.88Å; W166-Q170 HydrophobicContact CH2-CG 3.7Å; W166-Q170 HydrophobicContact CZ2-CG 3.63Å; W166-Q170 HydrophobicContact CZ3-CG 3.82Å; W166-Q170 WeakPolarHBondContact O-CB 3.39Å; W166-Q170 VanDerWaalsContact O-CG 3.23Å; W166-Q170 WeakPolarHBondContact O-CG 3.24Å; W166-Q170 PolarHBondContact O-N 3.19Å; W166-Q170 PolarHBondContact O-NE2 2.85Å
167	H	98.6	Very high	97.5	Very high	124 Å²	124	60.9 Å²	60.9	57%	0.574	32%	0.316	S	S	*	.	H	α-helix	trans	-60.6	-50.4	175.4	-178.8	71.7	0	0	0	111.6	D163 I164 Y169 Q170 D171	D163-H167 VanDerWaalsContact O-CB 3.27Å; D163-H167 WeakPolarHBondContact O-CB 3.47Å; D163-H167 PolarHBondContact O-N 3.31Å; I164-H167 PolarHBondContact O-N 3.27Å; H167-Y169 PolarHBondContact O-N 3.13Å; H167-Q170 PolarHBondContact O-N 3.17Å; H167-D171 PolarHBondContact O-N 3.1Å
168	I	98.6	Very high	97.3	Very high	62 Å²	62	64.6 Å²	64.6	32%	0.318	33%	0.326	S	S	.	.	H	α-helix	trans	-62.2	-45.2	179.8	-64.2	167.4	0	0	0	110.7	Y108 I164 E165 Q170 D171 W172	Y108-I168 HydrophobicContact CE2-CB 4.29Å; Y108-I168 HydrophobicContact CE2-CG2 4.19Å; Y108-I168 WeakPolarHBondContact OH-CG2 3.47Å; I164-I168 HydrophobicContact CG2-CD1 3.69Å; I164-I168 HydrophobicContact CG2-CG1 4.44Å; I164-I168 VanDerWaalsContact O-CG1 3.27Å; I164-I168 WeakPolarHBondContact O-CG1 3.1Å; I164-I168 PolarHBondContact O-N 3.49Å; E165-I168 PolarHBondContact O-N 2.69Å; I168-Q170 VanDerWaalsContact C-N 3.32Å; I168-Q170 PolarHBondContact O-N 3.31Å; I168-D171 PolarHBondContact O-N 3.32Å; I168-W172 VanDerWaalsContact O-CD1 3.32Å; I168-W172 PolarHBondContact O-N 3.35Å
169	Y	98.6	Very high	97.2	Very high	5 Å²	5	66.2 Å²	66.2	2%	0.02	33%	0.332	C	S	.	.	H	α-helix	trans	-58.6	-45.2	178.8	176	-90.8	0	0	0	111.7	Q111 T112 D147 R148 A152 E165 W166 H167 D171 H173	Q111-Y169 HydrophobicContact CB-CD2 4.07Å; Q111-Y169 HydrophobicContact CB-CE2 3.71Å; T112-Y169 HydrophobicContact CG2-CD2 4.22Å; D147-Y169 WeakPolarHBondContact CB-OH 3.39Å; R148-Y169 HydrophobicContact CB-CE1 3.95Å; R148-Y169 HydrophobicContact CG-CE1 4.07Å; R148-Y169 PolarHBondContact N-OH 3.44Å; A152-Y169 HydrophobicContact CB-CD1 3.87Å; A152-Y169 HydrophobicContact CB-CE1 3.38Å; A152-Y169 HydrophobicContact CB-CE2 4.28Å; E165-Y169 VanDerWaalsContact O-CB 3.22Å; E165-Y169 WeakPolarHBondContact O-CB 3.44Å; E165-Y169 PolarHBondContact O-N 2.56Å; W166-Y169 AromaticContact CE3-CD1 3.96Å; W166-Y169 HydrophobicContact CE3-CD1 3.96Å; W166-Y169 AromaticContact CZ3-CD1 3.61Å; W166-Y169 HydrophobicContact CZ3-CD1 3.61Å; W166-Y169 HydrophobicContact CZ3-CE1 4.03Å; H167-Y169 PolarHBondContact O-N 3.13Å; Y169-D171 PolarHBondContact O-N 3.16Å; Y169-H173 HydrophobicContact CE1-CB 4.42Å; Y169-H173 WeakPolarHBondContact O-CB 3.26Å; Y169-H173 PolarHBondContact O-N 2.99Å
170	Q	98.3	Very high	97	Very high	42 Å²	42	66 Å²	66	20%	0.196	32%	0.315	C	S	.	.	H	α-helix	trans	-64.7	-38.7	178.4	-73.3	-177.1	98.3	0	0	112.9	W166 H167 I168 S174	W166-Q170 VanDerWaalsContact CD1-NE2 3.34Å; W166-Q170 HydrophobicContact CD2-CG 3.82Å; W166-Q170 HydrophobicContact CE3-CG 3.88Å; W166-Q170 HydrophobicContact CH2-CG 3.7Å; W166-Q170 HydrophobicContact CZ2-CG 3.63Å; W166-Q170 HydrophobicContact CZ3-CG 3.82Å; W166-Q170 WeakPolarHBondContact O-CB 3.39Å; W166-Q170 VanDerWaalsContact O-CG 3.23Å; W166-Q170 WeakPolarHBondContact O-CG 3.24Å; W166-Q170 PolarHBondContact O-N 3.19Å; W166-Q170 PolarHBondContact O-NE2 2.85Å; H167-Q170 PolarHBondContact O-N 3.17Å; I168-Q170 VanDerWaalsContact C-N 3.32Å; I168-Q170 PolarHBondContact O-N 3.31Å; Q170-S174 VanDerWaalsContact O-CB 3.27Å; Q170-S174 WeakPolarHBondContact O-CB 3.37Å; Q170-S174 PolarHBondContact O-N 3.33Å; Q170-S174 PolarHBondContact O-OG 3.24Å
171	D	97.7	Very high	96.5	Very high	101 Å²	101	67.9 Å²	67.9	54%	0.54	33%	0.331	S	S	.	.	H	α-helix	trans	-64.2	-52.6	178.7	-166.7	61.7	0	0	0	110.6	H167 I168 Y169 H173 S174 F175	H167-D171 PolarHBondContact O-N 3.1Å; I168-D171 PolarHBondContact O-N 3.32Å; Y169-D171 PolarHBondContact O-N 3.16Å; D171-H173 PolarHBondContact O-N 2.75Å; D171-S174 PolarHBondContact O-N 3.15Å; D171-F175 WeakPolarHBondContact O-CB 3.4Å; D171-F175 PolarHBondContact O-N 2.71Å
172	W	94.4	Very high	95.9	Very high	148 Å²	148	72.5 Å²	72.5	56%	0.561	36%	0.364	S	S	*	.	H	α-helix	trans	-56.2	-47.8	175.2	-88.3	83.3	0	0	0	112.9	I168 L176	I168-W172 VanDerWaalsContact O-CD1 3.32Å; I168-W172 PolarHBondContact O-N 3.35Å; W172-L176 HydrophobicContact CE3-CD1 4.01Å; W172-L176 WeakPolarHBondContact O-CB 3.32Å; W172-L176 WeakPolarHBondContact O-CG 3.31Å; W172-L176 PolarHBondContact O-N 2.75Å
173	H	97.4	Very high	95.4	Very high	0 Å²	0	75.6 Å²	75.6	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-64.4	-45.1	-179.8	178.1	-69.7	0	0	0	111.5	F115 V144 R148 Y169 D171 L177 F239	F115-H173 AromaticContact CD2-CD2 3.57Å; F115-H173 AromaticContact CE2-CD2 3.31Å; F115-H173 WeakPolarHBondContact CE2-CD2 3.28Å; F115-H173 AromaticContact CE2-NE2 3.76Å; F115-H173 HydrophobicContact CZ-CB 4.39Å; F115-H173 AromaticContact CZ-CD2 3.88Å; V144-H173 PolarHBondContact O-NE2 2.75Å; V144-H173 VanDerWaalsContact O-NE2 3.07Å; R148-H173 WeakPolarHBondContact CB-NE2 3.37Å; R148-H173 WeakPolarHBondContact CD-ND1 3.42Å; Y169-H173 HydrophobicContact CE1-CB 4.42Å; Y169-H173 WeakPolarHBondContact O-CB 3.26Å; Y169-H173 PolarHBondContact O-N 2.99Å; D171-H173 PolarHBondContact O-N 2.75Å; H173-L177 WeakPolarHBondContact CE1-CD1 3.33Å; H173-L177 WeakPolarHBondContact O-CB 3.35Å; H173-L177 WeakPolarHBondContact O-CG 2.85Å; H173-L177 PolarHBondContact O-N 2.86Å; H173-F239 AromaticContact CE1-CE2 3.69Å; H173-F239 AromaticContact CE1-CZ 3.81Å; H173-F239 AromaticContact ND1-CE2 3.97Å; H173-F239 AromaticContact ND1-CZ 3.72Å
174	S	95.9	Very high	95	Very high	39 Å²	39	69.9 Å²	69.9	27%	0.273	34%	0.336	S	S	.	.	H	α-helix	trans	-62.2	-46.8	178.7	-55.1	0	0	0	0	111.3	R148 Q170 D171 L177 W178	R148-S174 PolarHBondContact NH1-OG 3.46Å; Q170-S174 VanDerWaalsContact O-CB 3.27Å; Q170-S174 WeakPolarHBondContact O-CB 3.37Å; Q170-S174 PolarHBondContact O-N 3.33Å; Q170-S174 PolarHBondContact O-OG 3.24Å; D171-S174 PolarHBondContact O-N 3.15Å; S174-L177 PolarHBondContact O-N 3.01Å; S174-W178 WeakPolarHBondContact O-CB 3.33Å; S174-W178 PolarHBondContact O-N 3.32Å
175	F	96.4	Very high	94.7	Very high	108 Å²	108	67.1 Å²	67.1	47%	0.474	33%	0.325	S	S	.	.	H	α-helix	trans	-58.2	-52.2	178.9	173.5	-109.6	0	0	0	111.7	D171 L177 W178 E179	D171-F175 WeakPolarHBondContact O-CB 3.4Å; D171-F175 PolarHBondContact O-N 2.71Å; F175-L177 PolarHBondContact O-N 3.1Å; F175-W178 WeakPolarHBondContact O-CB 3.23Å; F175-W178 PolarHBondContact O-N 2.79Å; F175-E179 HydrophobicContact CD2-CG 4.16Å; F175-E179 HydrophobicContact CE1-CG 4.15Å; F175-E179 HydrophobicContact CE2-CG 3.69Å; F175-E179 VanDerWaalsContact CE2-OE1 3.32Å; F175-E179 WeakPolarHBondContact CE2-OE1 3.39Å; F175-E179 HydrophobicContact CZ-CG 3.68Å; F175-E179 WeakPolarHBondContact O-CG 3.43Å; F175-E179 PolarHBondContact O-N 3.18Å
176	L	95.8	Very high	94.5	Very high	28 Å²	28	65.8 Å²	65.8	15%	0.147	32%	0.319	C	S	.	.	H	α-helix	trans	-68.1	-36.1	-176.8	-69.5	171.7	0	0	0	113	F115 L119 W172 W178 F180	F115-L176 HydrophobicContact CE1-CB 4.33Å; F115-L176 HydrophobicContact CE1-CD1 3.69Å; F115-L176 HydrophobicContact CZ-CB 4.15Å; F115-L176 HydrophobicContact CZ-CD1 4.34Å; L119-L176 HydrophobicContact CD2-CB 4.11Å; L119-L176 HydrophobicContact CD2-CD1 4.16Å; W172-L176 HydrophobicContact CE3-CD1 4.01Å; W172-L176 WeakPolarHBondContact O-CB 3.32Å; W172-L176 WeakPolarHBondContact O-CG 3.31Å; W172-L176 PolarHBondContact O-N 2.75Å; L176-W178 VanDerWaalsContact C-N 3.32Å; L176-F180 HydrophobicContact CD2-CE2 3.95Å; L176-F180 WeakPolarHBondContact O-CB 3.18Å; L176-F180 WeakPolarHBondContact O-CD2 3.47Å; L176-F180 PolarHBondContact O-N 3.08Å
177	L	93.9	Very high	94.4	Very high	4 Å²	4	66.2 Å²	66.2	2%	0.021	32%	0.322	C	S	.	.	H	α-helix	trans	-69.7	-31.6	174.2	-70.4	-153.1	0	0	0	112.5	F115 V144 Y145 H173 S174 F175 A181 L184 F239	F115-L177 HydrophobicContact CE2-CD2 4.11Å; F115-L177 HydrophobicContact CZ-CD2 4.29Å; V144-L177 HydrophobicContact CB-CD2 4.16Å; V144-L177 HydrophobicContact CG2-CD1 4.13Å; V144-L177 HydrophobicContact CG2-CD2 3.73Å; Y145-L177 HydrophobicContact CD1-CD1 3.78Å; Y145-L177 HydrophobicContact CE1-CD1 3.43Å; Y145-L177 VanDerWaalsContact CE1-CD1 3.43Å; H173-L177 WeakPolarHBondContact CE1-CD1 3.33Å; H173-L177 WeakPolarHBondContact O-CB 3.35Å; H173-L177 WeakPolarHBondContact O-CG 2.85Å; H173-L177 PolarHBondContact O-N 2.86Å; S174-L177 PolarHBondContact O-N 3.01Å; F175-L177 PolarHBondContact O-N 3.1Å; L177-A181 WeakPolarHBondContact O-CA 3.2Å; L177-A181 WeakPolarHBondContact O-CB 3.23Å; L177-A181 PolarHBondContact O-N 3.22Å; L177-L184 HydrophobicContact CD2-CD1 3.41Å; L177-L184 VanDerWaalsContact CD2-CD1 3.41Å; L177-F239 HydrophobicContact CB-CD1 4.33Å; L177-F239 HydrophobicContact CB-CE1 3.54Å; L177-F239 HydrophobicContact CB-CZ 3.83Å; L177-F239 HydrophobicContact CD1-CD1 4.47Å; L177-F239 HydrophobicContact CD1-CD2 4.34Å; L177-F239 HydrophobicContact CD1-CE1 3.94Å; L177-F239 HydrophobicContact CD1-CE2 3.8Å; L177-F239 HydrophobicContact CD1-CZ 3.6Å; L177-F239 HydrophobicContact CG-CE1 4.29Å; L177-F239 HydrophobicContact CG-CZ 4.11Å
178	W	93.1	Very high	94.3	Very high	186 Å²	186	60.3 Å²	60.3	71%	0.705	30%	0.295	S	S	*	.	H	α-helix	trans	-67.8	-50.5	173.6	-179.1	80	0	0	0	111.4	S174 F175 L176 F180 A181	S174-W178 WeakPolarHBondContact O-CB 3.33Å; S174-W178 PolarHBondContact O-N 3.32Å; F175-W178 WeakPolarHBondContact O-CB 3.23Å; F175-W178 PolarHBondContact O-N 2.79Å; L176-W178 VanDerWaalsContact C-N 3.32Å; W178-F180 PolarHBondContact O-N 3.16Å; W178-A181 WeakPolarHBondContact O-CB 3.27Å; W178-A181 PolarHBondContact O-N 2.82Å
179	E	94.8	Very high	94.3	Very high	93 Å²	93	57.5 Å²	57.5	44%	0.435	28%	0.281	S	S	.	.	H	α-helix	trans	-57.5	-35.2	177.6	-73.2	-65.6	162.2	0	0	112.8	F175	F175-E179 HydrophobicContact CD2-CG 4.16Å; F175-E179 HydrophobicContact CE1-CG 4.15Å; F175-E179 HydrophobicContact CE2-CG 3.69Å; F175-E179 VanDerWaalsContact CE2-OE1 3.32Å; F175-E179 WeakPolarHBondContact CE2-OE1 3.39Å; F175-E179 HydrophobicContact CZ-CG 3.68Å; F175-E179 WeakPolarHBondContact O-CG 3.43Å; F175-E179 PolarHBondContact O-N 3.18Å
180	F	93.2	Very high	94.3	Very high	53 Å²	53	57.2 Å²	57.2	23%	0.232	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	13.3	-176.4	-58.4	-47.1	0	0	0	114.6	L119 L123 L176 W178 S182 R183 L184	L119-F180 HydrophobicContact CD1-CD2 4.2Å; L119-F180 HydrophobicContact CD2-CD2 4.17Å; L119-F180 HydrophobicContact CD2-CE2 4.27Å; L123-F180 HydrophobicContact CD1-CB 4.47Å; L123-F180 HydrophobicContact CD1-CD1 4.29Å; L123-F180 HydrophobicContact CD1-CD2 3.76Å; L123-F180 HydrophobicContact CD1-CE1 4.48Å; L123-F180 HydrophobicContact CD1-CE2 3.97Å; L123-F180 HydrophobicContact CD1-CG 3.91Å; L123-F180 HydrophobicContact CD1-CZ 4.32Å; L123-F180 HydrophobicContact CD2-CB 4Å; L123-F180 HydrophobicContact CD2-CG 4.23Å; L176-F180 HydrophobicContact CD2-CE2 3.95Å; L176-F180 WeakPolarHBondContact O-CB 3.18Å; L176-F180 WeakPolarHBondContact O-CD2 3.47Å; L176-F180 PolarHBondContact O-N 3.08Å; W178-F180 PolarHBondContact O-N 3.16Å; F180-S182 VanDerWaalsContact C-N 3.29Å; F180-S182 PolarHBondContact O-N 3.46Å; F180-S182 VanDerWaalsContact O-N 3.14Å; F180-R183 PolarHBondContact O-N 3.32Å; F180-L184 HydrophobicContact CB-CD1 3.71Å; F180-L184 HydrophobicContact CB-CG 4.06Å; F180-L184 WeakPolarHBondContact O-CG 3.39Å; F180-L184 PolarHBondContact O-N 3.33Å
181	A	87.5	Confident	94.4	Very high	53 Å²	53	55.3 Å²	55.3	44%	0.438	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-51.3	-44.9	-172.1	0	0	0	0	0	113.3	L177 W178 R183 L184	L177-A181 WeakPolarHBondContact O-CA 3.2Å; L177-A181 WeakPolarHBondContact O-CB 3.23Å; L177-A181 PolarHBondContact O-N 3.22Å; W178-A181 WeakPolarHBondContact O-CB 3.27Å; W178-A181 PolarHBondContact O-N 2.82Å; A181-R183 PolarHBondContact O-N 2.66Å; A181-L184 PolarHBondContact O-N 3.14Å
182	S	86.3	Confident	94.4	Very high	102 Å²	102	50.5 Å²	50.5	71%	0.713	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-64.1	-24.3	-179.3	61.8	0	0	0	0	113.9	F180	F180-S182 VanDerWaalsContact C-N 3.29Å; F180-S182 PolarHBondContact O-N 3.46Å; F180-S182 VanDerWaalsContact O-N 3.14Å
183	R	89.3	Confident	94.6	Very high	121 Å²	121	45.3 Å²	45.3	46%	0.457	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-100.4	-6.9	-179.1	-63.8	-167	-68.6	151.3	-5.6	113.4	R40 L123 F180 A181	R40-R183 PolarHBondContact NH1-O 2.64Å; R40-R183 PolarHBondContact NH2-O 3.1Å; L123-R183 HydrophobicContact CD2-CB 3.65Å; F180-R183 PolarHBondContact O-N 3.32Å; A181-R183 PolarHBondContact O-N 2.66Å
184	L	90	Very high	94.6	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	23%	0.227	C	C	.	.	S	Bend	trans	-111.8	12.9	-176.6	-62.5	177.5	0	0	0	113.3	L119 Q122 L123 L177 F180 A181 L186	L119-L184 HydrophobicContact CD1-CD1 3.47Å; L119-L184 VanDerWaalsContact CD1-CD1 3.47Å; L119-L184 HydrophobicContact CD1-CD2 3.91Å; L119-L184 HydrophobicContact CD1-CG 4.29Å; Q122-L184 HydrophobicContact CB-CD2 3.53Å; L123-L184 HydrophobicContact CD2-CD2 3.56Å; L123-L184 HydrophobicContact CD2-CG 3.97Å; L123-L184 HydrophobicContact CG-CD2 4.04Å; L177-L184 HydrophobicContact CD2-CD1 3.41Å; L177-L184 VanDerWaalsContact CD2-CD1 3.41Å; F180-L184 HydrophobicContact CB-CD1 3.71Å; F180-L184 HydrophobicContact CB-CG 4.06Å; F180-L184 WeakPolarHBondContact O-CG 3.39Å; F180-L184 PolarHBondContact O-N 3.33Å; A181-L184 PolarHBondContact O-N 3.14Å; L184-L186 PolarHBondContact O-N 3.13Å
185	T	91.4	Very high	94.8	Very high	66 Å²	66	45.1 Å²	45.1	41%	0.405	23%	0.226	S	C	.	.			trans	-58.8	125.9	178.7	56.6	0	0	0	0	110.9	R40	R40-T185 WeakPolarHBondContact CD-O 3.41Å; R40-T185 PolarHBondContact NH1-O 3Å; R40-T185 VanDerWaalsContact NH1-O 3.13Å
186	L	95	Very high	94.9	Very high	13 Å²	13	40.5 Å²	40.5	7%	0.068	21%	0.206	C	C	.	.			trans	-106.5	145.8	167.7	-65.7	-179.7	0	0	0	109.1	R40 F140 Y145 L184 F189 I245	R40-L186 HydrophobicContact CB-CD2 4.12Å; F140-L186 HydrophobicContact CD2-CD2 3.95Å; F140-L186 HydrophobicContact CE2-CD2 4.11Å; Y145-L186 HydrophobicContact CD2-CD1 3.79Å; Y145-L186 HydrophobicContact CE2-CD1 3.64Å; Y145-L186 HydrophobicContact CE2-CG 4.14Å; L184-L186 PolarHBondContact O-N 3.13Å; L186-F189 HydrophobicContact CD1-CD1 4.43Å; L186-F189 HydrophobicContact CD1-CE1 3.53Å; L186-F189 HydrophobicContact CD1-CZ 3.74Å; L186-I245 HydrophobicContact CB-CD1 4.06Å; L186-I245 WeakPolarHBondContact O-CD1 3.18Å
187	H	96.2	Very high	95	Very high	41 Å²	41	43.9 Å²	43.9	19%	0.19	22%	0.221	C	C	.	.			trans	-104.9	-16.8	179.9	-58.6	84.6	0	0	0	112.1	R40 P246 L277	R40-H187 PolarHBondContact N-ND1 2.71Å; R40-H187 PolarHBondContact O-N 2.93Å; H187-P246 WeakPolarHBondContact O-CD 3.27Å; H187-L277 HydrophobicContact CB-CD1 4.33Å; H187-L277 WeakPolarHBondContact O-CD2 3.15Å
188	G	97.5	Very high	95.2	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.8	155.4	179.5	0	0	0	0	0	112.8	L41 S42 I245 P246	L41-G188 WeakPolarHBondContact CA-O 3.24Å; L41-G188 WeakPolarHBondContact CB-O 3.45Å; S42-G188 PolarHBondContact N-O 2.9Å; G188-I245 VanDerWaalsContact CA-CG2 3.46Å; G188-P246 CarbonylContact C-O 3.59Å; G188-P246 VanDerWaalsContact CA-O 3.32Å; G188-P246 WeakPolarHBondContact CA-O 3.42Å
189	F	98.4	Very high	95.4	Very high	3 Å²	3	36.4 Å²	36.4	1%	0.013	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	141.1	166.2	-64.1	-77.8	0	0	0	110.1	S42 E44 Y145 L186 W229 L230 L242 I245 P246 V247 L248	S42-F189 CarbonylContact O-C 3.58Å; S42-F189 WeakPolarHBondContact O-CA 3.26Å; E44-F189 HydrophobicContact CG-CD1 3.72Å; E44-F189 HydrophobicContact CG-CE1 4.36Å; Y145-F189 HydrophobicContact CD2-CE1 4.46Å; Y145-F189 HydrophobicContact CD2-CZ 4.1Å; L186-F189 HydrophobicContact CD1-CD1 4.43Å; L186-F189 HydrophobicContact CD1-CE1 3.53Å; L186-F189 HydrophobicContact CD1-CZ 3.74Å; F189-W229 HydrophobicContact CD1-CH2 4.42Å; F189-W229 AromaticContact CE1-CH2 3.87Å; F189-W229 HydrophobicContact CE1-CH2 3.87Å; F189-W229 HydrophobicContact CE1-CZ2 4.05Å; F189-W229 HydrophobicContact CE2-CZ2 4.17Å; F189-W229 HydrophobicContact CZ-CH2 4.06Å; F189-W229 AromaticContact CZ-CZ2 3.75Å; F189-W229 HydrophobicContact CZ-CZ2 3.75Å; F189-L230 HydrophobicContact CB-CD2 4.27Å; F189-L230 HydrophobicContact CD2-CD2 4.36Å; F189-L230 HydrophobicContact CG-CD2 4.19Å; F189-L242 HydrophobicContact CE2-CD2 4.09Å; F189-L242 HydrophobicContact CZ-CD2 3.84Å; F189-I245 HydrophobicContact CD2-CB 4.15Å; F189-I245 HydrophobicContact CD2-CG2 3.56Å; F189-I245 HydrophobicContact CE2-CB 3.96Å; F189-I245 HydrophobicContact CE2-CD1 3.96Å; F189-I245 HydrophobicContact CE2-CG2 3.7Å; F189-I245 HydrophobicContact CZ-CD1 4.45Å; F189-P246 PolarHBondContact N-O 3.05Å; F189-V247 HydrophobicContact CB-CG1 4.23Å; F189-V247 HydrophobicContact CB-CG2 4.08Å; F189-V247 HydrophobicContact CD2-CG2 4.2Å; F189-V247 CarbonylContact O-C 3.54Å; F189-V247 WeakPolarHBondContact O-CA 3.48Å; F189-L248 PolarHBondContact O-N 2.93Å
190	I	98.7	Very high	95.5	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	105.7	167.2	-59.4	172	0	0	0	106.3	L41 S42 I43 E44 F54 L192 L248 L250 V270 F273	L41-I190 HydrophobicContact CD2-CD1 4.14Å; L41-I190 HydrophobicContact CD2-CG1 4.15Å; S42-I190 PolarHBondContact O-N 3.25Å; I43-I190 CarbonylContact C-O 3.6Å; I43-I190 VanDerWaalsContact CA-O 3.31Å; I43-I190 WeakPolarHBondContact CA-O 3.46Å; I43-I190 HydrophobicContact CG1-CB 4.31Å; E44-I190 PolarHBondContact N-O 3.27Å; F54-I190 HydrophobicContact CE1-CG2 4.08Å; F54-I190 HydrophobicContact CZ-CG2 4.3Å; I190-L192 HydrophobicContact CG2-CD2 4.24Å; I190-L248 CarbonylContact C-O 3.55Å; I190-L248 WeakPolarHBondContact CA-O 3.4Å; I190-L248 HydrophobicContact CG1-CD2 4.43Å; I190-L248 HydrophobicContact CG2-CD2 4.41Å; I190-L250 HydrophobicContact CG2-CD1 3.71Å; I190-L250 HydrophobicContact CG2-CG 4.36Å; I190-V270 HydrophobicContact CD1-CG1 4.15Å; I190-V270 HydrophobicContact CD1-CG2 4.33Å; I190-F273 HydrophobicContact CG1-CE1 4.44Å
191	Y	98.8	Very high	95.7	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.008	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	109.7	179.6	178.3	-144.7	0	0	0	110.2	Q193 H226 E227 L230 L248 V249 L250	Y191-Q193 HydrophobicContact CD1-CB 4.24Å; Y191-Q193 HydrophobicContact CE1-CB 3.82Å; Y191-Q193 HydrophobicContact CE1-CG 3.79Å; Y191-Q193 HydrophobicContact CE2-CB 4.49Å; Y191-Q193 PolarHBondContact O-N 3.5Å; Y191-H226 HydrophobicContact CE2-CB 3.8Å; Y191-H226 AromaticContact CE2-CD2 3.98Å; Y191-H226 WeakPolarHBondContact OH-CB 3.46Å; Y191-E227 VanDerWaalsContact CE1-OE1 3.24Å; Y191-E227 WeakPolarHBondContact CE1-OE1 3.43Å; Y191-E227 PolarHBondContact OH-OE1 3.15Å; Y191-L230 HydrophobicContact CD1-CB 4.03Å; Y191-L230 HydrophobicContact CD1-CD1 4.39Å; Y191-L230 HydrophobicContact CD2-CD1 3.67Å; Y191-L230 HydrophobicContact CE2-CD1 4.31Å; Y191-L230 HydrophobicContact CG-CB 4.14Å; Y191-L230 HydrophobicContact CG-CD1 3.74Å; Y191-L248 PolarHBondContact N-O 3.19Å; Y191-V249 HydrophobicContact CD1-CG1 4Å; Y191-V249 HydrophobicContact CD1-CG2 4.22Å; Y191-L250 PolarHBondContact O-N 3.02Å
192	L	98.6	Very high	96.1	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	107	169.6	-58.3	-173	0	0	0	108.8	I43 E44 V49 K51 F54 I190 L250 V252	I43-L192 HydrophobicContact CG2-CD1 3.83Å; I43-L192 HydrophobicContact CG2-CG 3.88Å; E44-L192 PolarHBondContact O-N 2.92Å; V49-L192 HydrophobicContact CG1-CB 4.13Å; V49-L192 HydrophobicContact CG2-CB 4.22Å; V49-L192 WeakPolarHBondContact CG2-O 3.17Å; K51-L192 HydrophobicContact CG-CD1 4.17Å; F54-L192 HydrophobicContact CB-CD1 3.68Å; F54-L192 HydrophobicContact CD1-CD1 4.12Å; F54-L192 HydrophobicContact CD1-CD2 4.17Å; F54-L192 HydrophobicContact CD2-CD1 4.43Å; F54-L192 HydrophobicContact CD2-CD2 4.09Å; F54-L192 HydrophobicContact CE1-CD2 4.16Å; F54-L192 HydrophobicContact CE2-CD2 4.09Å; F54-L192 HydrophobicContact CG-CD1 3.85Å; F54-L192 HydrophobicContact CG-CD2 4.11Å; F54-L192 HydrophobicContact CZ-CD2 4.1Å; I190-L192 HydrophobicContact CG2-CD2 4.24Å; L192-L250 HydrophobicContact CD2-CB 4.07Å; L192-L250 HydrophobicContact CD2-CD1 3.96Å; L192-V252 HydrophobicContact CB-CG2 3.96Å; L192-V252 HydrophobicContact CD2-CG1 4.28Å
193	Q	98.6	Very high	96.6	Very high	38 Å²	38	30.6 Å²	30.6	18%	0.178	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	126.8	-176.8	-167.6	-175.2	44.4	0	0	110	Y191 E227 V249 L250 V252	Y191-Q193 HydrophobicContact CD1-CB 4.24Å; Y191-Q193 HydrophobicContact CE1-CB 3.82Å; Y191-Q193 HydrophobicContact CE1-CG 3.79Å; Y191-Q193 HydrophobicContact CE2-CB 4.49Å; Y191-Q193 PolarHBondContact O-N 3.5Å; Q193-E227 VanDerWaalsContact NE2-CD 3.27Å; Q193-E227 PolarHBondContact NE2-OE1 3.44Å; Q193-E227 PolarHBondContact NE2-OE2 3.29Å; Q193-E227 VanDerWaalsContact NE2-OE2 3.12Å; Q193-V249 HydrophobicContact CB-CG1 4.1Å; Q193-L250 PolarHBondContact N-O 3.33Å; Q193-V252 WeakPolarHBondContact O-CG2 3.39Å; Q193-V252 PolarHBondContact O-N 3.21Å
194	A	98.3	Very high	96.8	Very high	2 Å²	2	30.4 Å²	30.4	2%	0.017	15%	0.147	C	C	.	.			trans	-148.8	157.3	165.3	0	0	0	0	0	109.3	V49 V198 H223 V252	V49-A194 HydrophobicContact CG2-CB 3.75Å; A194-V198 HydrophobicContact CB-CB 4.3Å; A194-V198 HydrophobicContact CB-CG1 4.05Å; A194-H223 PolarHBondContact O-ND1 3.07Å; A194-V252 HydrophobicContact CB-CG2 4.28Å
195	S	98.5	Very high	96.9	Very high	34 Å²	34	37.4 Å²	37.4	24%	0.238	17%	0.174	C	C	.	.			trans	-61.3	150.1	176.2	60.6	0	0	0	0	112	Q197 V198 C199 N253	S195-Q197 PolarHBondContact O-N 2.91Å; S195-V198 PolarHBondContact O-N 2.91Å; S195-V198 VanDerWaalsContact O-N 3.14Å; S195-V198 WeakPolarHBondContact OG-CB 3.31Å; S195-V198 WeakPolarHBondContact OG-CG2 3.45Å; S195-V198 PolarHBondContact OG-N 3.3Å; S195-C199 PolarHBondContact O-N 3.43Å; S195-C199 PolarHBondContact O-SG 3.2Å; S195-N253 PolarHBondContact N-OD1 3.01Å; S195-N253 PolarHBondContact OG-OD1 3.5Å; S195-N253 VanDerWaalsContact OG-OD1 3.12Å
196	P	98.5	Very high	97	Very high	10 Å²	10	39.3 Å²	39.3	7%	0.065	17%	0.174	C	C	.	.	H	α-helix	trans	-53.3	-35.6	173.5	-29.1	37.4	0	0	0	113.4	C199 L200 L216 L219 E220 H223	P196-C199 WeakPolarHBondContact O-CB 3.44Å; P196-C199 PolarHBondContact O-N 2.97Å; P196-L200 WeakPolarHBondContact O-CB 3.48Å; P196-L200 PolarHBondContact O-N 2.87Å; P196-L216 HydrophobicContact CB-CD1 3.72Å; P196-L219 HydrophobicContact CB-CB 4.11Å; P196-E220 HydrophobicContact CB-CG 3.7Å; P196-E220 HydrophobicContact CG-CB 4.38Å; P196-E220 HydrophobicContact CG-CG 3.78Å; P196-H223 HydrophobicContact CG-CB 3.73Å
197	Q	98.3	Very high	96.8	Very high	99 Å²	99	41.5 Å²	41.5	46%	0.463	19%	0.193	S	C	.	.	H	α-helix	trans	-66.9	-42.7	178.8	-63.8	74.9	14.9	0	0	111.6	S195 L200 K201 L216	S195-Q197 PolarHBondContact O-N 2.91Å; Q197-L200 PolarHBondContact O-N 3.26Å; Q197-K201 WeakPolarHBondContact O-CB 3.22Å; Q197-K201 PolarHBondContact O-N 2.79Å; Q197-L216 HydrophobicContact CG-CD1 4.2Å; Q197-L216 HydrophobicContact CG-CD2 4.41Å
198	V	97.9	Very high	96.5	Very high	33 Å²	33	41.9 Å²	41.9	20%	0.2	19%	0.193	C	C	.	.	H	α-helix	trans	-63.7	-43.5	173.2	168.8	0	0	0	0	110.5	A194 S195 L200 K201 R202	A194-V198 HydrophobicContact CB-CB 4.3Å; A194-V198 HydrophobicContact CB-CG1 4.05Å; S195-V198 PolarHBondContact O-N 2.91Å; S195-V198 VanDerWaalsContact O-N 3.14Å; S195-V198 WeakPolarHBondContact OG-CB 3.31Å; S195-V198 WeakPolarHBondContact OG-CG2 3.45Å; S195-V198 PolarHBondContact OG-N 3.3Å; V198-L200 PolarHBondContact O-N 3.4Å; V198-K201 PolarHBondContact O-N 3.46Å; V198-R202 VanDerWaalsContact CG1-CZ 3.47Å; V198-R202 WeakPolarHBondContact O-CG 3.35Å; V198-R202 PolarHBondContact O-N 3.14Å
199	C	97.9	Very high	96.2	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60.1	-44.9	176.8	-65.4	0	0	0	0	111.6	I47 S195 P196 R202 L203 L219	I47-C199 WeakPolarHBondContact O-CB 3.42Å; S195-C199 PolarHBondContact O-N 3.43Å; S195-C199 PolarHBondContact O-SG 3.2Å; P196-C199 WeakPolarHBondContact O-CB 3.44Å; P196-C199 PolarHBondContact O-N 2.97Å; C199-R202 PolarHBondContact O-N 3.07Å; C199-L203 VanDerWaalsContact O-CB 3.31Å; C199-L203 WeakPolarHBondContact O-CB 3.44Å; C199-L203 PolarHBondContact O-N 3.23Å; C199-L219 HydrophobicContact CB-CD1 4.24Å
200	L	97.4	Very high	95.9	Very high	26 Å²	26	48.9 Å²	48.9	14%	0.136	23%	0.226	C	C	.	.	H	α-helix	trans	-61.9	-44.9	177.4	-172	62.9	0	0	0	111.8	P196 Q197 V198 R202 L203 Y204 L216 L219	P196-L200 WeakPolarHBondContact O-CB 3.48Å; P196-L200 PolarHBondContact O-N 2.87Å; Q197-L200 PolarHBondContact O-N 3.26Å; V198-L200 PolarHBondContact O-N 3.4Å; L200-R202 VanDerWaalsContact C-N 3.31Å; L200-R202 PolarHBondContact O-N 3.4Å; L200-L203 WeakPolarHBondContact O-CB 3.48Å; L200-L203 PolarHBondContact O-N 3.38Å; L200-Y204 HydrophobicContact CD1-CD2 4.41Å; L200-Y204 HydrophobicContact CD1-CE2 3.73Å; L200-Y204 HydrophobicContact CD2-CE2 4Å; L200-Y204 HydrophobicContact CG-CD2 4.08Å; L200-Y204 HydrophobicContact CG-CE2 3.52Å; L200-Y204 VanDerWaalsContact O-CD2 3.31Å; L200-Y204 WeakPolarHBondContact O-CD2 3.35Å; L200-Y204 PolarHBondContact O-N 3.09Å; L200-L216 HydrophobicContact CB-CD1 4.44Å; L200-L216 HydrophobicContact CD2-CB 3.96Å; L200-L216 HydrophobicContact CD2-CD1 4.14Å; L200-L219 HydrophobicContact CB-CD1 3.7Å; L200-L219 HydrophobicContact CD1-CD1 3.85Å; L200-L219 HydrophobicContact CG-CD1 4.37Å
201	K	96.3	Very high	95.6	Very high	121 Å²	121	49.2 Å²	49.2	53%	0.526	23%	0.227	S	C	.	.	H	α-helix	trans	-58.8	-42.9	175.3	-177.4	-179.6	178.8	-177.5	0	111.7	Q197 V198 R205	Q197-K201 WeakPolarHBondContact O-CB 3.22Å; Q197-K201 PolarHBondContact O-N 2.79Å; V198-K201 PolarHBondContact O-N 3.46Å; K201-R205 WeakPolarHBondContact O-CG 3.44Å; K201-R205 PolarHBondContact O-N 3.34Å; K201-R205 VanDerWaalsContact O-N 3.16Å
202	R	96.4	Very high	95.1	Very high	30 Å²	30	54.2 Å²	54.2	11%	0.113	25%	0.249	C	C	.	.	H	α-helix	trans	-68.7	-36.2	177.1	-71.8	177	178	159.8	10.3	112.2	A48 V49 V198 C199 L200 R205 R206 V252 N253 D254	A48-R202 HydrophobicContact CB-CB 4.08Å; A48-R202 VanDerWaalsContact O-CB 3.24Å; A48-R202 WeakPolarHBondContact O-CB 3.23Å; A48-R202 VanDerWaalsContact O-CD 3.29Å; A48-R202 WeakPolarHBondContact O-CD 3.44Å; V49-R202 PolarHBondContact O-NH1 3.18Å; V198-R202 VanDerWaalsContact CG1-CZ 3.47Å; V198-R202 WeakPolarHBondContact O-CG 3.35Å; V198-R202 PolarHBondContact O-N 3.14Å; C199-R202 PolarHBondContact O-N 3.07Å; L200-R202 VanDerWaalsContact C-N 3.31Å; L200-R202 PolarHBondContact O-N 3.4Å; R202-R205 PolarHBondContact O-N 3.47Å; R202-R206 PolarHBondContact O-N 3.24Å; R202-V252 PolarHBondContact NH1-O 3.34Å; R202-V252 PolarHBondContact NH2-O 2.91Å; R202-N253 PolarHBondContact NH2-O 2.88Å; R202-D254 PolarHBondContact NH2-O 3.47Å
203	L	95.6	Very high	94.6	Very high	2 Å²	2	57.3 Å²	57.3	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-60.2	-50.1	176	-173.9	162.3	0	0	0	110.4	I47 A48 C199 L200 R205 R206 A207 E211 I214 L219	I47-L203 HydrophobicContact CG2-CD1 4Å; A48-L203 HydrophobicContact CB-CB 3.68Å; A48-L203 HydrophobicContact CB-CG 4.44Å; C199-L203 VanDerWaalsContact O-CB 3.31Å; C199-L203 WeakPolarHBondContact O-CB 3.44Å; C199-L203 PolarHBondContact O-N 3.23Å; L200-L203 WeakPolarHBondContact O-CB 3.48Å; L200-L203 PolarHBondContact O-N 3.38Å; L203-R205 VanDerWaalsContact C-N 3.34Å; L203-R205 PolarHBondContact O-N 2.57Å; L203-R206 PolarHBondContact O-N 3.37Å; L203-A207 PolarHBondContact O-N 2.9Å; L203-A207 VanDerWaalsContact O-N 3.16Å; L203-E211 HydrophobicContact CD1-CB 4.46Å; L203-E211 HydrophobicContact CD2-CB 4.07Å; L203-E211 WeakPolarHBondContact CD2-O 3.46Å; L203-E211 HydrophobicContact CG-CB 4.22Å; L203-I214 HydrophobicContact CD1-CB 3.94Å; L203-I214 HydrophobicContact CD1-CD1 4.01Å; L203-I214 HydrophobicContact CD1-CG2 3.91Å; L203-L219 HydrophobicContact CD1-CD1 4.38Å
204	Y	94.2	Very high	94.4	Very high	117 Å²	117	55.8 Å²	55.8	46%	0.459	27%	0.274	S	S	.	.	H	α-helix	trans	-62.3	-38.5	176.2	-68.3	-47.6	0	0	0	112.9	L200 R206 A207	L200-Y204 HydrophobicContact CD1-CD2 4.41Å; L200-Y204 HydrophobicContact CD1-CE2 3.73Å; L200-Y204 HydrophobicContact CD2-CE2 4Å; L200-Y204 HydrophobicContact CG-CD2 4.08Å; L200-Y204 HydrophobicContact CG-CE2 3.52Å; L200-Y204 VanDerWaalsContact O-CD2 3.31Å; L200-Y204 WeakPolarHBondContact O-CD2 3.35Å; L200-Y204 PolarHBondContact O-N 3.09Å; Y204-R206 VanDerWaalsContact C-N 3.34Å; Y204-R206 PolarHBondContact O-N 2.62Å; Y204-A207 PolarHBondContact O-N 3.4Å
205	R	93	Very high	94.3	Very high	149 Å²	149	61.6 Å²	61.6	56%	0.562	30%	0.301	S	S	*	.	H	α-helix	trans	-62.6	-37.5	174.8	-74.8	175.3	175.9	-175.2	-4.9	112.9	K201 R202 L203 A207 D255	K201-R205 WeakPolarHBondContact O-CG 3.44Å; K201-R205 PolarHBondContact O-N 3.34Å; K201-R205 VanDerWaalsContact O-N 3.16Å; R202-R205 PolarHBondContact O-N 3.47Å; L203-R205 VanDerWaalsContact C-N 3.34Å; L203-R205 PolarHBondContact O-N 2.57Å; R205-A207 VanDerWaalsContact C-N 3.28Å; R205-D255 IonicContact NH1-OD2 3.71Å; R205-D255 PolarHBondContact NH1-OD2 3.39Å
206	R	92.1	Very high	94.3	Very high	106 Å²	106	62.3 Å²	62.3	40%	0.4	30%	0.302	S	S	.	.	H	α-helix	trans	-72	-24.5	177.7	-167.1	171.3	81.4	170.3	-4.4	112.4	R202 L203 Y204 R208 E211	R202-R206 PolarHBondContact O-N 3.24Å; L203-R206 PolarHBondContact O-N 3.37Å; Y204-R206 VanDerWaalsContact C-N 3.34Å; Y204-R206 PolarHBondContact O-N 2.62Å; R206-R208 PolarHBondContact O-N 2.7Å; R206-R208 VanDerWaalsContact O-N 3.17Å; R206-E211 IonicContact CZ-OE2 3.91Å; R206-E211 IonicContact NE-OE2 2.66Å; R206-E211 IonicContact NH2-OE1 3.4Å; R206-E211 PolarHBondContact NH2-OE1 3Å; R206-E211 IonicContact NH2-OE2 2.64Å; R206-E211 PolarHBondContact NH2-OE2 3.19Å
207	A	90.6	Very high	94.3	Very high	58 Å²	58	64.4 Å²	64.4	48%	0.479	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	38.7	173.1	0	0	0	0	0	114.2	L203 Y204 R205 E209	L203-A207 PolarHBondContact O-N 2.9Å; L203-A207 VanDerWaalsContact O-N 3.16Å; Y204-A207 PolarHBondContact O-N 3.4Å; R205-A207 VanDerWaalsContact C-N 3.28Å; A207-E209 PolarHBondContact O-N 2.71Å
208	R	91.2	Very high	94.3	Very high	50 Å²	50	61.3 Å²	61.3	19%	0.189	30%	0.304	C	S	.	.			trans	-72.5	126.2	173.1	178.8	178.8	-64.7	171.6	-15.4	109	R206 E210 E211 K212	R206-R208 PolarHBondContact O-N 2.7Å; R206-R208 VanDerWaalsContact O-N 3.17Å; R208-E210 VanDerWaalsContact C-N 3.34Å; R208-E210 WeakPolarHBondContact CD-OE2 3.45Å; R208-E210 WeakPolarHBondContact CG-OE2 3.27Å; R208-E210 PolarHBondContact O-N 3.43Å; R208-E211 HydrophobicContact CB-CB 4.33Å; R208-E211 HydrophobicContact CB-CG 4.36Å; R208-E211 WeakPolarHBondContact CD-OE1 3.33Å; R208-E211 HydrophobicContact CG-CG 4.3Å; R208-E211 IonicContact CZ-OE1 3.52Å; R208-E211 IonicContact NE-OE1 2.62Å; R208-E211 IonicContact NH1-OE1 3.24Å; R208-E211 PolarHBondContact NH1-OE1 3.34Å; R208-E211 PolarHBondContact O-N 3.44Å; R208-E211 VanDerWaalsContact O-N 3.1Å; R208-K212 PolarHBondContact O-N 3.35Å
209	E	91.6	Very high	94.3	Very high	127 Å²	127	59.8 Å²	59.8	59%	0.593	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-55.5	-45.8	-172.7	-67.8	-59.3	132.4	0	0	113.1	A207 E211 K212	A207-E209 PolarHBondContact O-N 2.71Å; E209-E211 PolarHBondContact O-N 3.01Å; E209-K212 PolarHBondContact O-N 3.14Å; E209-K212 VanDerWaalsContact OE1-CE 3.23Å; E209-K212 WeakPolarHBondContact OE1-CE 3.31Å; E209-K212 IonicContact OE1-NZ 3.97Å; E209-K212 PolarHBondContact OE1-NZ 2.64Å; E209-K212 WeakPolarHBondContact OE2-CE 3.19Å; E209-K212 IonicContact OE2-NZ 2.75Å; E209-K212 PolarHBondContact OE2-NZ 2.97Å
210	E	91.8	Very high	94.3	Very high	22 Å²	22	64 Å²	64	10%	0.103	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-66.5	-23.4	-177.2	-53.1	90.3	152.7	0	0	112.7	Q76 N94 L96 D97 Y100 R208	Q76-E210 WeakPolarHBondContact CG-OE1 3.39Å; Q76-E210 PolarHBondContact NE2-OE1 3.42Å; Q76-E210 PolarHBondContact NE2-OE2 2.95Å; N94-E210 PolarHBondContact ND2-OE1 3.34Å; L96-E210 HydrophobicContact CD2-CB 4.3Å; L96-E210 HydrophobicContact CD2-CG 4.49Å; L96-E210 HydrophobicContact CG-CB 4.26Å; D97-E210 HydrophobicContact CB-CB 4.33Å; D97-E210 HydrophobicContact CB-CG 3.67Å; Y100-E210 HydrophobicContact CD2-CB 4.26Å; Y100-E210 VanDerWaalsContact CD2-O 3.22Å; Y100-E210 WeakPolarHBondContact CD2-O 3.33Å; R208-E210 VanDerWaalsContact C-N 3.34Å; R208-E210 WeakPolarHBondContact CD-OE2 3.45Å; R208-E210 WeakPolarHBondContact CG-OE2 3.27Å; R208-E210 PolarHBondContact O-N 3.43Å
211	E	91.8	Very high	94.4	Very high	7 Å²	7	66.3 Å²	66.3	3%	0.033	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-94.1	-7.8	-175.1	-68.3	172.6	-178.5	0	0	112.4	Y100 L203 R206 R208 E209 G213 I214	Y100-E211 HydrophobicContact CE2-CG 4.16Å; L203-E211 HydrophobicContact CD1-CB 4.46Å; L203-E211 HydrophobicContact CD2-CB 4.07Å; L203-E211 WeakPolarHBondContact CD2-O 3.46Å; L203-E211 HydrophobicContact CG-CB 4.22Å; R206-E211 IonicContact CZ-OE2 3.91Å; R206-E211 IonicContact NE-OE2 2.66Å; R206-E211 IonicContact NH2-OE1 3.4Å; R206-E211 PolarHBondContact NH2-OE1 3Å; R206-E211 IonicContact NH2-OE2 2.64Å; R206-E211 PolarHBondContact NH2-OE2 3.19Å; R208-E211 HydrophobicContact CB-CB 4.33Å; R208-E211 HydrophobicContact CB-CG 4.36Å; R208-E211 WeakPolarHBondContact CD-OE1 3.33Å; R208-E211 HydrophobicContact CG-CG 4.3Å; R208-E211 IonicContact CZ-OE1 3.52Å; R208-E211 IonicContact NE-OE1 2.62Å; R208-E211 IonicContact NH1-OE1 3.24Å; R208-E211 PolarHBondContact NH1-OE1 3.34Å; R208-E211 PolarHBondContact O-N 3.44Å; R208-E211 VanDerWaalsContact O-N 3.1Å; E209-E211 PolarHBondContact O-N 3.01Å; E211-G213 PolarHBondContact O-N 3.21Å; E211-G213 VanDerWaalsContact O-N 3.15Å; E211-I214 HydrophobicContact CB-CD1 3.8Å; E211-I214 HydrophobicContact CG-CD1 3.84Å; E211-I214 WeakPolarHBondContact O-CB 3.4Å; E211-I214 WeakPolarHBondContact O-CG1 3.37Å; E211-I214 PolarHBondContact O-N 3.28Å
212	K	87.9	Confident	94.5	Very high	108 Å²	108	60.5 Å²	60.5	47%	0.47	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-31	-174.5	-76.2	179.9	178.4	173.4	0	114.5	R208 E209 I214	R208-K212 PolarHBondContact O-N 3.35Å; E209-K212 PolarHBondContact O-N 3.14Å; E209-K212 VanDerWaalsContact OE1-CE 3.23Å; E209-K212 WeakPolarHBondContact OE1-CE 3.31Å; E209-K212 IonicContact OE1-NZ 3.97Å; E209-K212 PolarHBondContact OE1-NZ 2.64Å; E209-K212 WeakPolarHBondContact OE2-CE 3.19Å; E209-K212 IonicContact OE2-NZ 2.75Å; E209-K212 PolarHBondContact OE2-NZ 2.97Å; K212-I214 VanDerWaalsContact C-N 3.32Å
213	G	89.7	Confident	94.6	Very high	64 Å²	64	61 Å²	61	66%	0.66	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	3.8	179.2	0	0	0	0	0	114.6	E211 E215	E211-G213 PolarHBondContact O-N 3.21Å; E211-G213 VanDerWaalsContact O-N 3.15Å; G213-E215 PolarHBondContact O-N 2.83Å
214	I	94.1	Very high	94.7	Very high	6 Å²	6	62.7 Å²	62.7	3%	0.031	32%	0.32	C	S	.	.			trans	-74.7	118.2	179.9	-66	174.5	0	0	0	109.9	I47 Y100 L203 E211 K212 Y218 L219	I47-I214 HydrophobicContact CD1-CD1 4.18Å; Y100-I214 HydrophobicContact CD1-CD1 4.24Å; Y100-I214 HydrophobicContact CD1-CG1 4.11Å; Y100-I214 HydrophobicContact CE1-CD1 3.56Å; Y100-I214 HydrophobicContact CE1-CG1 3.84Å; Y100-I214 HydrophobicContact CE2-CD1 4.1Å; Y100-I214 VanDerWaalsContact CZ-CD1 3.48Å; L203-I214 HydrophobicContact CD1-CB 3.94Å; L203-I214 HydrophobicContact CD1-CD1 4.01Å; L203-I214 HydrophobicContact CD1-CG2 3.91Å; E211-I214 HydrophobicContact CB-CD1 3.8Å; E211-I214 HydrophobicContact CG-CD1 3.84Å; E211-I214 WeakPolarHBondContact O-CB 3.4Å; E211-I214 WeakPolarHBondContact O-CG1 3.37Å; E211-I214 PolarHBondContact O-N 3.28Å; K212-I214 VanDerWaalsContact C-N 3.32Å; I214-Y218 HydrophobicContact CG2-CD1 3.92Å; I214-L219 HydrophobicContact CG2-CD1 4.45Å; I214-L219 HydrophobicContact CG2-CD2 3.95Å; I214-L219 HydrophobicContact CG2-CG 3.94Å
215	E	95.8	Very high	94.9	Very high	125 Å²	125	57.8 Å²	57.8	58%	0.584	30%	0.302	S	S	*	.			trans	-85.8	156.5	177.3	-64.4	-60.4	155.3	0	0	112.6	G213 A217 Y218 L219	G213-E215 PolarHBondContact O-N 2.83Å; E215-A217 PolarHBondContact O-N 2.75Å; E215-Y218 PolarHBondContact O-N 2.77Å; E215-Y218 VanDerWaalsContact O-N 3.1Å; E215-L219 PolarHBondContact O-N 3.03Å
216	L	98	Very high	95.2	Very high	49 Å²	49	50.7 Å²	50.7	26%	0.257	28%	0.275	S	S	.	.	H	α-helix	trans	-53.4	-42.3	177.3	-178.2	60.4	0	0	0	112.1	P196 Q197 L200 Y218 L219 E220	P196-L216 HydrophobicContact CB-CD1 3.72Å; Q197-L216 HydrophobicContact CG-CD1 4.2Å; Q197-L216 HydrophobicContact CG-CD2 4.41Å; L200-L216 HydrophobicContact CB-CD1 4.44Å; L200-L216 HydrophobicContact CD2-CB 3.96Å; L200-L216 HydrophobicContact CD2-CD1 4.14Å; L216-Y218 PolarHBondContact O-N 3.42Å; L216-L219 CarbonylContact O-C 3.6Å; L216-L219 WeakPolarHBondContact O-CA 3.18Å; L216-L219 WeakPolarHBondContact O-CB 3.4Å; L216-L219 PolarHBondContact O-N 2.92Å; L216-E220 HydrophobicContact CD1-CG 4.38Å; L216-E220 HydrophobicContact CG-CG 4.2Å; L216-E220 WeakPolarHBondContact O-CG 3.18Å; L216-E220 PolarHBondContact O-N 3.36Å
217	A	98.1	Very high	95.5	Very high	53 Å²	53	46.9 Å²	46.9	44%	0.438	26%	0.262	S	S	.	.	H	α-helix	trans	-57.9	-36.4	-178.7	0	0	0	0	0	112.5	E215 E220 Q221	E215-A217 PolarHBondContact O-N 2.75Å; A217-E220 PolarHBondContact O-N 2.79Å; A217-Q221 VanDerWaalsContact O-CG 3.28Å; A217-Q221 WeakPolarHBondContact O-CG 3.23Å; A217-Q221 PolarHBondContact O-N 2.9Å
218	Y	98.1	Very high	95.9	Very high	35 Å²	35	45 Å²	45	14%	0.137	25%	0.246	C	C	.	.	H	α-helix	trans	-68.3	-39.9	176.1	-175.7	-113.4	0	0	0	111.4	I47 Y100 N154 I214 E215 L216 E220 Q221 L222	I47-Y218 HydrophobicContact CD1-CD1 4.46Å; I47-Y218 HydrophobicContact CD1-CE1 3.91Å; Y100-Y218 HydrophobicContact CE1-CE1 4.21Å; N154-Y218 WeakPolarHBondContact ND2-CE2 3.44Å; I214-Y218 HydrophobicContact CG2-CD1 3.92Å; E215-Y218 PolarHBondContact O-N 2.77Å; E215-Y218 VanDerWaalsContact O-N 3.1Å; L216-Y218 PolarHBondContact O-N 3.42Å; Y218-E220 VanDerWaalsContact C-N 3.35Å; Y218-Q221 WeakPolarHBondContact O-CB 3.47Å; Y218-Q221 PolarHBondContact O-N 3.48Å; Y218-L222 HydrophobicContact CD1-CD1 4.05Å; Y218-L222 HydrophobicContact CE1-CD1 3.61Å; Y218-L222 HydrophobicContact CE1-CG 4.27Å; Y218-L222 WeakPolarHBondContact O-CG 3.43Å; Y218-L222 PolarHBondContact O-N 3.28Å
219	L	98.4	Very high	96.2	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-68	-34.4	175.5	-61.6	178.9	0	0	0	112.3	N46 I47 P196 C199 L200 L203 I214 E215 L216 H223	N46-L219 PolarHBondContact ND2-O 3.25Å; I47-L219 HydrophobicContact CB-CD2 3.87Å; I47-L219 HydrophobicContact CD1-CD2 4.28Å; I47-L219 HydrophobicContact CG1-CD2 4.45Å; P196-L219 HydrophobicContact CB-CB 4.11Å; C199-L219 HydrophobicContact CB-CD1 4.24Å; L200-L219 HydrophobicContact CB-CD1 3.7Å; L200-L219 HydrophobicContact CD1-CD1 3.85Å; L200-L219 HydrophobicContact CG-CD1 4.37Å; L203-L219 HydrophobicContact CD1-CD1 4.38Å; I214-L219 HydrophobicContact CG2-CD1 4.45Å; I214-L219 HydrophobicContact CG2-CD2 3.95Å; I214-L219 HydrophobicContact CG2-CG 3.94Å; E215-L219 PolarHBondContact O-N 3.03Å; L216-L219 CarbonylContact O-C 3.6Å; L216-L219 WeakPolarHBondContact O-CA 3.18Å; L216-L219 WeakPolarHBondContact O-CB 3.4Å; L216-L219 PolarHBondContact O-N 2.92Å; L219-H223 VanDerWaalsContact O-CB 3.25Å; L219-H223 WeakPolarHBondContact O-CB 3.18Å; L219-H223 PolarHBondContact O-N 2.91Å
220	E	98.7	Very high	96.5	Very high	88 Å²	88	37 Å²	37	41%	0.411	21%	0.211	S	C	.	.	H	α-helix	trans	-64.3	-44.8	173.6	-73	173.2	166.1	0	0	111.5	P196 L216 A217 Y218 H223 G224	P196-E220 HydrophobicContact CB-CG 3.7Å; P196-E220 HydrophobicContact CG-CB 4.38Å; P196-E220 HydrophobicContact CG-CG 3.78Å; L216-E220 HydrophobicContact CD1-CG 4.38Å; L216-E220 HydrophobicContact CG-CG 4.2Å; L216-E220 WeakPolarHBondContact O-CG 3.18Å; L216-E220 PolarHBondContact O-N 3.36Å; A217-E220 PolarHBondContact O-N 2.79Å; Y218-E220 VanDerWaalsContact C-N 3.35Å; E220-H223 PolarHBondContact O-N 2.64Å; E220-G224 PolarHBondContact O-N 3.27Å
221	Q	98.6	Very high	96.7	Very high	75 Å²	75	39.4 Å²	39.4	35%	0.35	22%	0.224	S	C	.	.	H	α-helix	trans	-56.9	-53.3	173.3	-72.4	171.7	13.8	0	0	111.1	N154 A217 Y218 H223 G224 Q225	N154-Q221 PolarHBondContact ND2-OE1 2.97Å; N154-Q221 WeakPolarHBondContact OD1-CB 3.47Å; A217-Q221 VanDerWaalsContact O-CG 3.28Å; A217-Q221 WeakPolarHBondContact O-CG 3.23Å; A217-Q221 PolarHBondContact O-N 2.9Å; Y218-Q221 WeakPolarHBondContact O-CB 3.47Å; Y218-Q221 PolarHBondContact O-N 3.48Å; Q221-H223 VanDerWaalsContact C-N 3.29Å; Q221-H223 PolarHBondContact O-N 2.79Å; Q221-G224 PolarHBondContact O-N 2.94Å; Q221-G224 VanDerWaalsContact O-N 3.15Å; Q221-Q225 WeakPolarHBondContact O-CG 3.09Å; Q221-Q225 PolarHBondContact O-N 3.29Å; Q221-Q225 VanDerWaalsContact O-N 3.1Å
222	L	98.6	Very high	97	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.5	-38.7	178.6	-67.4	-179.2	0	0	0	112.2	N46 I47 I150 F151 N154 Y218 Q225 H226	N46-L222 WeakPolarHBondContact OD1-CB 3.35Å; I47-L222 HydrophobicContact CD1-CD1 3.58Å; I47-L222 HydrophobicContact CG1-CD1 3.94Å; I150-L222 HydrophobicContact CG2-CD2 3.99Å; F151-L222 HydrophobicContact CD1-CD1 4.47Å; F151-L222 HydrophobicContact CD1-CD2 3.99Å; F151-L222 HydrophobicContact CE1-CD1 3.94Å; F151-L222 HydrophobicContact CE1-CD2 4.08Å; N154-L222 HydrophobicContact CB-CD2 4.01Å; Y218-L222 HydrophobicContact CD1-CD1 4.05Å; Y218-L222 HydrophobicContact CE1-CD1 3.61Å; Y218-L222 HydrophobicContact CE1-CG 4.27Å; Y218-L222 WeakPolarHBondContact O-CG 3.43Å; Y218-L222 PolarHBondContact O-N 3.28Å; L222-Q225 PolarHBondContact O-N 3.37Å; L222-H226 PolarHBondContact O-N 3.23Å; L222-H226 VanDerWaalsContact O-N 3.14Å; L222-H226 PolarHBondContact O-ND1 3.18Å
223	H	98.8	Very high	97.3	Very high	40 Å²	40	44.8 Å²	44.8	19%	0.185	25%	0.249	C	C	.	.	H	α-helix	trans	-60.4	-47.4	175.4	179	75.6	0	0	0	110.9	A194 P196 L219 E220 Q221 Q225 H226 E227	A194-H223 PolarHBondContact O-ND1 3.07Å; P196-H223 HydrophobicContact CG-CB 3.73Å; L219-H223 VanDerWaalsContact O-CB 3.25Å; L219-H223 WeakPolarHBondContact O-CB 3.18Å; L219-H223 PolarHBondContact O-N 2.91Å; E220-H223 PolarHBondContact O-N 2.64Å; Q221-H223 VanDerWaalsContact C-N 3.29Å; Q221-H223 PolarHBondContact O-N 2.79Å; H223-Q225 VanDerWaalsContact C-N 3.29Å; H223-Q225 PolarHBondContact O-N 3.14Å; H223-H226 PolarHBondContact O-N 3.04Å; H223-E227 IonicContact CE1-OE1 2.98Å; H223-E227 WeakPolarHBondContact O-CG 3.32Å; H223-E227 PolarHBondContact O-N 3.47Å
224	G	98.6	Very high	97.7	Very high	37 Å²	37	46.7 Å²	46.7	38%	0.381	25%	0.248	S	C	.	.	H	α-helix	trans	-56	-40.4	175.2	0	0	0	0	0	113.3	E220 Q221 H226 E227 A228	E220-G224 PolarHBondContact O-N 3.27Å; Q221-G224 PolarHBondContact O-N 2.94Å; Q221-G224 VanDerWaalsContact O-N 3.15Å; G224-H226 PolarHBondContact O-N 3.07Å; G224-E227 PolarHBondContact O-N 3.14Å; G224-A228 VanDerWaalsContact O-CB 3.26Å; G224-A228 WeakPolarHBondContact O-CB 3.42Å; G224-A228 PolarHBondContact O-N 2.62Å
225	Q	98.6	Very high	97.8	Very high	15 Å²	15	47.2 Å²	47.2	7%	0.07	25%	0.251	C	S	.	.	H	α-helix	trans	-63.5	-40.8	175.4	-55.3	-62.3	-12	0	0	112.2	I150 N154 E157 Q221 L222 H223 W229	I150-Q225 HydrophobicContact CB-CB 4.5Å; I150-Q225 HydrophobicContact CD1-CB 3.51Å; I150-Q225 WeakPolarHBondContact CD1-O 3.27Å; I150-Q225 HydrophobicContact CG2-CB 4.26Å; N154-Q225 HydrophobicContact CB-CG 4.23Å; N154-Q225 PolarHBondContact OD1-NE2 2.7Å; E157-Q225 PolarHBondContact OE2-NE2 3.16Å; Q221-Q225 WeakPolarHBondContact O-CG 3.09Å; Q221-Q225 PolarHBondContact O-N 3.29Å; Q221-Q225 VanDerWaalsContact O-N 3.1Å; L222-Q225 PolarHBondContact O-N 3.37Å; H223-Q225 VanDerWaalsContact C-N 3.29Å; H223-Q225 PolarHBondContact O-N 3.14Å; Q225-W229 WeakPolarHBondContact O-CB 3.43Å; Q225-W229 PolarHBondContact O-N 2.81Å; Q225-W229 VanDerWaalsContact O-N 3.07Å
226	H	98.7	Very high	97.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-67.7	-45	177.8	-71.3	85.9	0	0	0	111.4	G45 I150 Y191 L222 H223 G224 A228 W229 L230	G45-H226 WeakPolarHBondContact CA-NE2 3.11Å; G45-H226 PolarHBondContact N-NE2 2.91Å; G45-H226 PolarHBondContact O-NE2 3.45Å; I150-H226 HydrophobicContact CD1-CB 4.41Å; I150-H226 WeakPolarHBondContact CG2-CE1 3.37Å; Y191-H226 HydrophobicContact CE2-CB 3.8Å; Y191-H226 AromaticContact CE2-CD2 3.98Å; Y191-H226 WeakPolarHBondContact OH-CB 3.46Å; L222-H226 PolarHBondContact O-N 3.23Å; L222-H226 VanDerWaalsContact O-N 3.14Å; L222-H226 PolarHBondContact O-ND1 3.18Å; H223-H226 PolarHBondContact O-N 3.04Å; G224-H226 PolarHBondContact O-N 3.07Å; H226-A228 PolarHBondContact O-N 3.05Å; H226-W229 PolarHBondContact O-N 3.28Å; H226-L230 WeakPolarHBondContact O-CB 3.25Å; H226-L230 PolarHBondContact O-N 3.03Å
227	E	98.6	Very high	97.5	Very high	26 Å²	26	48.3 Å²	48.3	12%	0.121	25%	0.253	C	S	.	.	I	π-helix	trans	-59.9	-47.3	177.1	-67.7	-64.6	99.1	0	0	110.8	Y191 Q193 H223 G224 W229 L231 H232	Y191-E227 VanDerWaalsContact CE1-OE1 3.24Å; Y191-E227 WeakPolarHBondContact CE1-OE1 3.43Å; Y191-E227 PolarHBondContact OH-OE1 3.15Å; Q193-E227 VanDerWaalsContact NE2-CD 3.27Å; Q193-E227 PolarHBondContact NE2-OE1 3.44Å; Q193-E227 PolarHBondContact NE2-OE2 3.29Å; Q193-E227 VanDerWaalsContact NE2-OE2 3.12Å; H223-E227 IonicContact CE1-OE1 2.98Å; H223-E227 WeakPolarHBondContact O-CG 3.32Å; H223-E227 PolarHBondContact O-N 3.47Å; G224-E227 PolarHBondContact O-N 3.14Å; E227-W229 VanDerWaalsContact C-N 3.3Å; E227-W229 PolarHBondContact O-N 3.3Å; E227-L231 WeakPolarHBondContact O-CB 3.4Å; E227-L231 PolarHBondContact O-N 2.82Å; E227-L231 VanDerWaalsContact O-N 3.13Å; E227-L231 WeakPolarHBondContact OE2-CD2 3.38Å; E227-H232 PolarHBondContact O-N 3.36Å
228	A	98.3	Very high	97.2	Very high	19 Å²	19	50.3 Å²	50.3	16%	0.157	25%	0.253	C	S	.	.	I	π-helix	trans	-60.8	-38	178.5	0	0	0	0	0	112.6	G224 H226 K233 T234 T235	G224-A228 VanDerWaalsContact O-CB 3.26Å; G224-A228 WeakPolarHBondContact O-CB 3.42Å; G224-A228 PolarHBondContact O-N 2.62Å; H226-A228 PolarHBondContact O-N 3.05Å; A228-K233 CarbonylContact O-C 3.51Å; A228-K233 WeakPolarHBondContact O-CA 3.45Å; A228-K233 PolarHBondContact O-N 2.78Å; A228-T234 PolarHBondContact O-N 2.99Å; A228-T234 PolarHBondContact O-OG1 3.46Å; A228-T235 WeakPolarHBondContact CB-OG1 3.31Å; A228-T235 PolarHBondContact O-N 3.34Å
229	W	98	Very high	96.7	Very high	5 Å²	5	50 Å²	50	2%	0.019	25%	0.253	C	S	.	.	I	π-helix	trans	-84.9	-50.3	-178	176.8	35.3	0	0	0	113.8	E44 I150 F189 Q225 H226 E227 K233 T235	E44-W229 HydrophobicContact CG-CH2 4.35Å; E44-W229 HydrophobicContact CG-CZ3 4.16Å; I150-W229 HydrophobicContact CD1-CB 4.46Å; I150-W229 HydrophobicContact CD1-CE3 3.82Å; I150-W229 HydrophobicContact CG1-CE3 3.9Å; I150-W229 HydrophobicContact CG1-CZ3 4.16Å; F189-W229 HydrophobicContact CD1-CH2 4.42Å; F189-W229 AromaticContact CE1-CH2 3.87Å; F189-W229 HydrophobicContact CE1-CH2 3.87Å; F189-W229 HydrophobicContact CE1-CZ2 4.05Å; F189-W229 HydrophobicContact CE2-CZ2 4.17Å; F189-W229 HydrophobicContact CZ-CH2 4.06Å; F189-W229 AromaticContact CZ-CZ2 3.75Å; F189-W229 HydrophobicContact CZ-CZ2 3.75Å; Q225-W229 WeakPolarHBondContact O-CB 3.43Å; Q225-W229 PolarHBondContact O-N 2.81Å; Q225-W229 VanDerWaalsContact O-N 3.07Å; H226-W229 PolarHBondContact O-N 3.28Å; E227-W229 VanDerWaalsContact C-N 3.3Å; E227-W229 PolarHBondContact O-N 3.3Å; W229-K233 WeakPolarHBondContact O-CD 3.49Å; W229-K233 PolarHBondContact O-NZ 3.29Å; W229-T235 PolarHBondContact N-OG1 3.44Å
230	L	97.7	Very high	96	Very high	3 Å²	3	57.4 Å²	57.4	2%	0.016	29%	0.287	C	S	.	.	I	π-helix	trans	-93.8	-30.3	-166.2	-63.7	173.5	0	0	0	112.6	E44 F189 Y191 H226 K233 V247	E44-L230 HydrophobicContact CB-CD1 3.51Å; E44-L230 HydrophobicContact CG-CD1 4.09Å; F189-L230 HydrophobicContact CB-CD2 4.27Å; F189-L230 HydrophobicContact CD2-CD2 4.36Å; F189-L230 HydrophobicContact CG-CD2 4.19Å; Y191-L230 HydrophobicContact CD1-CB 4.03Å; Y191-L230 HydrophobicContact CD1-CD1 4.39Å; Y191-L230 HydrophobicContact CD2-CD1 3.67Å; Y191-L230 HydrophobicContact CE2-CD1 4.31Å; Y191-L230 HydrophobicContact CG-CB 4.14Å; Y191-L230 HydrophobicContact CG-CD1 3.74Å; H226-L230 WeakPolarHBondContact O-CB 3.25Å; H226-L230 PolarHBondContact O-N 3.03Å; L230-K233 WeakPolarHBondContact O-CE 3.36Å; L230-K233 PolarHBondContact O-NZ 2.78Å; L230-V247 HydrophobicContact CB-CG1 4.33Å; L230-V247 HydrophobicContact CD2-CG2 4.43Å
231	L	96.6	Very high	95.3	Very high	73 Å²	73	56.8 Å²	56.8	38%	0.382	30%	0.297	S	S	.	.	I	π-helix	trans	-101.5	-60.9	-178.7	-172.5	66.4	0	0	0	112.2	E227 V249	E227-L231 WeakPolarHBondContact O-CB 3.4Å; E227-L231 PolarHBondContact O-N 2.82Å; E227-L231 VanDerWaalsContact O-N 3.13Å; E227-L231 WeakPolarHBondContact OE2-CD2 3.38Å; L231-V249 HydrophobicContact CD1-CG2 4.21Å
232	H	97	Very high	94.7	Very high	118 Å²	118	53.6 Å²	53.6	55%	0.546	28%	0.282	S	S	.	.	S	Bend	trans	-84.4	-15.5	-172.4	-58.8	-50	0	0	0	114.5	E227 T234	E227-H232 PolarHBondContact O-N 3.36Å; H232-T234 HydrophobicContact CB-CG2 4.03Å; H232-T234 PolarHBondContact O-N 2.85Å
233	K	95.4	Very high	94.1	Very high	109 Å²	109	58.6 Å²	58.6	47%	0.474	31%	0.307	S	S	.	.			trans	56.7	33	179.2	-51.2	-67.8	166.4	-165.5	0	113.7	A228 W229 L230	A228-K233 CarbonylContact O-C 3.51Å; A228-K233 WeakPolarHBondContact O-CA 3.45Å; A228-K233 PolarHBondContact O-N 2.78Å; W229-K233 WeakPolarHBondContact O-CD 3.49Å; W229-K233 PolarHBondContact O-NZ 3.29Å; L230-K233 WeakPolarHBondContact O-CE 3.36Å; L230-K233 PolarHBondContact O-NZ 2.78Å
234	T	96.4	Very high	93.6	Very high	104 Å²	104	63.6 Å²	63.6	64%	0.638	34%	0.335	S	S	*	.			trans	-94.4	-19	-179.7	55.8	0	0	0	0	113.3	A228 H232 K236	A228-T234 PolarHBondContact O-N 2.99Å; A228-T234 PolarHBondContact O-OG1 3.46Å; H232-T234 HydrophobicContact CB-CG2 4.03Å; H232-T234 PolarHBondContact O-N 2.85Å; T234-K236 PolarHBondContact O-N 3.03Å
235	T	96	Very high	93.4	Very high	17 Å²	17	62.7 Å²	62.7	10%	0.104	32%	0.322	C	S	.	.	S	Bend	trans	-64.4	121.4	174.3	-61	0	0	0	0	110.3	Y149 A228 W229 L237	Y149-T235 HydrophobicContact CD1-CG2 4.08Å; A228-T235 WeakPolarHBondContact CB-OG1 3.31Å; A228-T235 PolarHBondContact O-N 3.34Å; W229-T235 PolarHBondContact N-OG1 3.44Å; T235-L237 HydrophobicContact CG2-CD2 4.21Å; T235-L237 WeakPolarHBondContact O-CG 3.4Å; T235-L237 PolarHBondContact O-N 2.98Å
236	K	94.5	Very high	93.4	Very high	168 Å²	168	64.9 Å²	64.9	73%	0.73	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-65	118.1	175.8	-176.2	-179.5	177.8	-177.7	0	110.6	T234	T234-K236 PolarHBondContact O-N 3.03Å
237	L	94.1	Very high	93.4	Very high	30 Å²	30	66.6 Å²	66.6	16%	0.157	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-99.7	150.7	178.3	-55.2	-178.3	0	0	0	111.3	Y149 T235 L242	Y149-L237 HydrophobicContact CD1-CD2 3.95Å; Y149-L237 HydrophobicContact CD2-CD2 4.05Å; Y149-L237 HydrophobicContact CE1-CD2 3.88Å; Y149-L237 HydrophobicContact CE2-CD2 4.01Å; Y149-L237 HydrophobicContact CG-CD2 4.04Å; T235-L237 HydrophobicContact CG2-CD2 4.21Å; T235-L237 WeakPolarHBondContact O-CG 3.4Å; T235-L237 PolarHBondContact O-N 2.98Å; L237-L242 HydrophobicContact CD1-CB 3.77Å; L237-L242 HydrophobicContact CD1-CD1 4.42Å
238	H	91.9	Very high	93.4	Very high	94 Å²	94	66.4 Å²	66.4	44%	0.435	35%	0.347	S	S	.	.	S	Bend	trans	-109.5	6.2	180	-52.9	83.2	0	0	0	112.6	Y149	Y149-H238 AromaticContact CE1-ND1 3.63Å; Y149-H238 AromaticContact CZ-ND1 3.85Å; Y149-H238 PolarHBondContact OH-N 3.32Å; Y149-H238 PolarHBondContact OH-ND1 2.89Å; Y149-H238 VanDerWaalsContact OH-ND1 3.14Å
239	F	86.5	Confident	93.4	Very high	30 Å²	30	67.7 Å²	67.7	13%	0.132	35%	0.353	C	S	.	.			trans	-127.4	114.2	-178.4	-54.2	-77.8	0	0	0	108.8	Y145 Y149 H173 L177 A241 L242	Y145-F239 HydrophobicContact CD1-CD2 4.33Å; Y145-F239 HydrophobicContact CE1-CD2 4.23Å; Y145-F239 HydrophobicContact CE1-CG 4.44Å; Y149-F239 HydrophobicContact CE2-CD2 4.01Å; Y149-F239 HydrophobicContact CE2-CE2 4.05Å; Y149-F239 WeakPolarHBondContact OH-CD2 3.36Å; Y149-F239 WeakPolarHBondContact OH-CE2 3.31Å; H173-F239 AromaticContact CE1-CE2 3.69Å; H173-F239 AromaticContact CE1-CZ 3.81Å; H173-F239 AromaticContact ND1-CE2 3.97Å; H173-F239 AromaticContact ND1-CZ 3.72Å; L177-F239 HydrophobicContact CB-CD1 4.33Å; L177-F239 HydrophobicContact CB-CE1 3.54Å; L177-F239 HydrophobicContact CB-CZ 3.83Å; L177-F239 HydrophobicContact CD1-CD1 4.47Å; L177-F239 HydrophobicContact CD1-CD2 4.34Å; L177-F239 HydrophobicContact CD1-CE1 3.94Å; L177-F239 HydrophobicContact CD1-CE2 3.8Å; L177-F239 HydrophobicContact CD1-CZ 3.6Å; L177-F239 HydrophobicContact CG-CE1 4.29Å; L177-F239 HydrophobicContact CG-CZ 4.11Å; F239-A241 PolarHBondContact O-N 3.43Å; F239-L242 HydrophobicContact CB-CD1 3.89Å; F239-L242 HydrophobicContact CB-CG 4.02Å; F239-L242 HydrophobicContact CD2-CD1 3.84Å; F239-L242 HydrophobicContact CG-CD1 4.29Å; F239-L242 WeakPolarHBondContact O-CB 3.47Å; F239-L242 PolarHBondContact O-N 2.99Å; F239-L242 VanDerWaalsContact O-N 3.08Å
240	E	84.9	Confident	93.4	Very high	155 Å²	155	67.5 Å²	67.5	72%	0.724	35%	0.352	S	S	*	.	H	α-helix	trans	-57.7	-38.9	179	-174.4	179.8	178.4	0	0	111.4	L242 M243	E240-L242 PolarHBondContact O-N 3.41Å; E240-M243 PolarHBondContact O-N 3.22Å
241	A	83	Confident	93.4	Very high	75 Å²	75	71.4 Å²	71.4	62%	0.62	37%	0.373	S	S	*	.	H	α-helix	trans	-54.6	-23.8	177.3	0	0	0	0	0	113.9	F239 I245	F239-A241 PolarHBondContact O-N 3.43Å; A241-I245 VanDerWaalsContact O-CD1 3.28Å; A241-I245 WeakPolarHBondContact O-CD1 3.24Å; A241-I245 WeakPolarHBondContact O-CG1 3.5Å
242	L	86.4	Confident	93.4	Very high	7 Å²	7	67.9 Å²	67.9	4%	0.037	36%	0.355	C	S	.	.	H	α-helix	trans	-87.8	-23.9	179.3	-69.7	175	0	0	0	114.4	Y145 Y149 F189 L237 F239 E240 N244 I245	Y145-L242 HydrophobicContact CD1-CD1 3.28Å; Y145-L242 HydrophobicContact CD1-CD2 3.8Å; Y145-L242 HydrophobicContact CD1-CG 3.94Å; Y145-L242 HydrophobicContact CD2-CD2 3.65Å; Y145-L242 HydrophobicContact CE1-CD1 3.56Å; Y145-L242 HydrophobicContact CE1-CD2 3.72Å; Y145-L242 HydrophobicContact CE1-CG 3.78Å; Y145-L242 HydrophobicContact CE2-CD2 3.62Å; Y145-L242 HydrophobicContact CG-CD1 3.82Å; Y145-L242 HydrophobicContact CG-CD2 3.72Å; Y145-L242 HydrophobicContact CG-CG 4.32Å; Y149-L242 HydrophobicContact CE2-CD1 3.98Å; F189-L242 HydrophobicContact CE2-CD2 4.09Å; F189-L242 HydrophobicContact CZ-CD2 3.84Å; L237-L242 HydrophobicContact CD1-CB 3.77Å; L237-L242 HydrophobicContact CD1-CD1 4.42Å; F239-L242 HydrophobicContact CB-CD1 3.89Å; F239-L242 HydrophobicContact CB-CG 4.02Å; F239-L242 HydrophobicContact CD2-CD1 3.84Å; F239-L242 HydrophobicContact CG-CD1 4.29Å; F239-L242 WeakPolarHBondContact O-CB 3.47Å; F239-L242 PolarHBondContact O-N 2.99Å; F239-L242 VanDerWaalsContact O-N 3.08Å; E240-L242 PolarHBondContact O-N 3.41Å; L242-N244 PolarHBondContact O-N 3.45Å; L242-I245 HydrophobicContact CD2-CD1 3.8Å; L242-I245 PolarHBondContact O-N 3.48Å
243	M	85.9	Confident	93.4	Very high	105 Å²	105	64.6 Å²	64.6	52%	0.517	34%	0.341	S	S	.	.	H	α-helix	trans	-62.5	-33.2	-165.5	-67.7	-171.8	179.4	0	0	112.5	E240	E240-M243 PolarHBondContact O-N 3.22Å
244	N	88.7	Confident	93.3	Very high	146 Å²	146	64.2 Å²	64.2	78%	0.781	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.4	15.2	-173.8	-59.9	-49.7	0	0	0	113.4	L242 P246	L242-N244 PolarHBondContact O-N 3.45Å; N244-P246 WeakPolarHBondContact O-CD 3.36Å
245	I	95.1	Very high	93	Very high	18 Å²	18	61.9 Å²	61.9	9%	0.092	33%	0.328	C	S	.	.			trans	-69.1	126.4	178.1	-64.6	-175.7	0	0	0	109.3	L186 G188 F189 A241 L242	L186-I245 HydrophobicContact CB-CD1 4.06Å; L186-I245 WeakPolarHBondContact O-CD1 3.18Å; G188-I245 VanDerWaalsContact CA-CG2 3.46Å; F189-I245 HydrophobicContact CD2-CB 4.15Å; F189-I245 HydrophobicContact CD2-CG2 3.56Å; F189-I245 HydrophobicContact CE2-CB 3.96Å; F189-I245 HydrophobicContact CE2-CD1 3.96Å; F189-I245 HydrophobicContact CE2-CG2 3.7Å; F189-I245 HydrophobicContact CZ-CD1 4.45Å; A241-I245 VanDerWaalsContact O-CD1 3.28Å; A241-I245 WeakPolarHBondContact O-CD1 3.24Å; A241-I245 WeakPolarHBondContact O-CG1 3.5Å; L242-I245 HydrophobicContact CD2-CD1 3.8Å; L242-I245 PolarHBondContact O-N 3.48Å
246	P	97.3	Very high	92.8	Very high	60 Å²	60	61.3 Å²	61.3	39%	0.39	32%	0.324	S	S	.	.			trans	-57.2	142	175	-25.6	35.1	0	0	0	112.2	H187 G188 F189 N244 F273 L277	H187-P246 WeakPolarHBondContact O-CD 3.27Å; G188-P246 CarbonylContact C-O 3.59Å; G188-P246 VanDerWaalsContact CA-O 3.32Å; G188-P246 WeakPolarHBondContact CA-O 3.42Å; F189-P246 PolarHBondContact N-O 3.05Å; N244-P246 WeakPolarHBondContact O-CD 3.36Å; P246-F273 HydrophobicContact CB-CE2 3.64Å; P246-F273 HydrophobicContact CB-CZ 3.75Å; P246-L277 HydrophobicContact CB-CD2 3.86Å; P246-L277 HydrophobicContact CG-CD2 3.75Å
247	V	98.3	Very high	92.5	Very high	36 Å²	36	55.1 Å²	55.1	22%	0.218	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	123.8	176	-175.4	0	0	0	0	109.4	F189 L230 V249	F189-V247 HydrophobicContact CB-CG1 4.23Å; F189-V247 HydrophobicContact CB-CG2 4.08Å; F189-V247 HydrophobicContact CD2-CG2 4.2Å; F189-V247 CarbonylContact O-C 3.54Å; F189-V247 WeakPolarHBondContact O-CA 3.48Å; L230-V247 HydrophobicContact CB-CG1 4.33Å; L230-V247 HydrophobicContact CD2-CG2 4.43Å; V247-V249 HydrophobicContact CG1-CG2 4.14Å
248	L	98.6	Very high	92	Very high	22 Å²	22	61.5 Å²	61.5	12%	0.115	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	118.9	166.2	176.3	64.7	0	0	0	108.3	F189 I190 Y191 L250 V270 F273	F189-L248 PolarHBondContact O-N 2.93Å; I190-L248 CarbonylContact C-O 3.55Å; I190-L248 WeakPolarHBondContact CA-O 3.4Å; I190-L248 HydrophobicContact CG1-CD2 4.43Å; I190-L248 HydrophobicContact CG2-CD2 4.41Å; Y191-L248 PolarHBondContact N-O 3.19Å; L248-L250 HydrophobicContact CD1-CD2 4.03Å; L248-L250 HydrophobicContact CD2-CD1 4.15Å; L248-L250 HydrophobicContact CD2-CD2 3.95Å; L248-L250 HydrophobicContact CD2-CG 4.13Å; L248-L250 HydrophobicContact CG-CD2 3.84Å; L248-L250 HydrophobicContact CG-CG 4Å; L248-V270 HydrophobicContact CD2-CB 4.45Å; L248-V270 HydrophobicContact CD2-CG2 3.94Å; L248-F273 HydrophobicContact CB-CB 4.27Å; L248-F273 HydrophobicContact CB-CD1 3.69Å; L248-F273 HydrophobicContact CB-CD2 3.84Å; L248-F273 HydrophobicContact CB-CE1 3.84Å; L248-F273 HydrophobicContact CB-CE2 3.99Å; L248-F273 HydrophobicContact CB-CG 3.68Å; L248-F273 HydrophobicContact CB-CZ 3.99Å; L248-F273 HydrophobicContact CD1-CB 4.25Å; L248-F273 HydrophobicContact CD1-CG 4.46Å; L248-F273 HydrophobicContact CD2-CB 3.78Å; L248-F273 HydrophobicContact CD2-CD1 4.07Å; L248-F273 HydrophobicContact CD2-CG 4.03Å; L248-F273 HydrophobicContact CG-CB 4.33Å; L248-F273 HydrophobicContact CG-CD1 4.48Å; L248-F273 HydrophobicContact CG-CG 4.27Å
249	V	98.6	Very high	92.1	Very high	46 Å²	46	62 Å²	62	28%	0.279	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	125.3	175.6	-175.3	0	0	0	0	108.6	Y191 Q193 L231 V247	Y191-V249 HydrophobicContact CD1-CG1 4Å; Y191-V249 HydrophobicContact CD1-CG2 4.22Å; Q193-V249 HydrophobicContact CB-CG1 4.1Å; L231-V249 HydrophobicContact CD1-CG2 4.21Å; V247-V249 HydrophobicContact CG1-CG2 4.14Å
250	L	98.4	Very high	92.3	Very high	2 Å²	2	64.7 Å²	64.7	1%	0.01	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	116.8	179.1	-60.8	178.3	0	0	0	109.2	F54 I190 Y191 L192 Q193 L248 V252 L266 E269 V270	F54-L250 HydrophobicContact CE2-CD1 3.91Å; F54-L250 HydrophobicContact CZ-CD1 3.56Å; I190-L250 HydrophobicContact CG2-CD1 3.71Å; I190-L250 HydrophobicContact CG2-CG 4.36Å; Y191-L250 PolarHBondContact O-N 3.02Å; L192-L250 HydrophobicContact CD2-CB 4.07Å; L192-L250 HydrophobicContact CD2-CD1 3.96Å; Q193-L250 PolarHBondContact N-O 3.33Å; L248-L250 HydrophobicContact CD1-CD2 4.03Å; L248-L250 HydrophobicContact CD2-CD1 4.15Å; L248-L250 HydrophobicContact CD2-CD2 3.95Å; L248-L250 HydrophobicContact CD2-CG 4.13Å; L248-L250 HydrophobicContact CG-CD2 3.84Å; L248-L250 HydrophobicContact CG-CG 4Å; L250-V252 PolarHBondContact O-N 3.37Å; L250-L266 HydrophobicContact CB-CD2 3.97Å; L250-L266 HydrophobicContact CD1-CD2 4.13Å; L250-L266 HydrophobicContact CD2-CD2 4.11Å; L250-L266 HydrophobicContact CG-CD2 4.29Å; L250-E269 HydrophobicContact CD2-CB 3.99Å; L250-E269 WeakPolarHBondContact CD2-OE2 3.46Å; L250-V270 HydrophobicContact CD1-CG2 3.98Å
251	D	97.6	Very high	92.8	Very high	84 Å²	84	62 Å²	62	45%	0.449	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	113.6	172.6	-171.1	-30.3	0	0	0	109.9	N253	D251-N253 VanDerWaalsContact OD1-CB 3.3Å; D251-N253 WeakPolarHBondContact OD1-CB 3.41Å; D251-N253 PolarHBondContact OD1-N 3.04Å; D251-N253 PolarHBondContact OD1-ND2 2.9Å; D251-N253 PolarHBondContact OD2-ND2 3.32Å
252	V	97.3	Very high	93.3	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.323	C	S	.	.			trans	-119.2	33.5	178.3	-63.6	0	0	0	0	111.5	V49 L192 Q193 A194 R202 L250 F256 L266	V49-V252 HydrophobicContact CG2-CG2 3.79Å; L192-V252 HydrophobicContact CB-CG2 3.96Å; L192-V252 HydrophobicContact CD2-CG1 4.28Å; Q193-V252 WeakPolarHBondContact O-CG2 3.39Å; Q193-V252 PolarHBondContact O-N 3.21Å; A194-V252 HydrophobicContact CB-CG2 4.28Å; R202-V252 PolarHBondContact NH1-O 3.34Å; R202-V252 PolarHBondContact NH2-O 2.91Å; L250-V252 PolarHBondContact O-N 3.37Å; V252-F256 HydrophobicContact CB-CD1 3.73Å; V252-F256 HydrophobicContact CB-CE1 3.71Å; V252-F256 HydrophobicContact CG1-CD1 3.72Å; V252-F256 HydrophobicContact CG1-CE1 3.72Å; V252-F256 HydrophobicContact CG2-CE1 4.32Å; V252-L266 HydrophobicContact CG1-CD1 4.27Å; V252-L266 HydrophobicContact CG1-CD2 4.3Å
253	N	96.7	Very high	93.7	Very high	48 Å²	48	61.1 Å²	61.1	26%	0.257	33%	0.329	S	S	.	.			trans	-61.6	-50.1	171.2	-79.7	-72.9	0	0	0	111.2	S195 R202 D251	S195-N253 PolarHBondContact N-OD1 3.01Å; S195-N253 PolarHBondContact OG-OD1 3.5Å; S195-N253 VanDerWaalsContact OG-OD1 3.12Å; R202-N253 PolarHBondContact NH2-O 2.88Å; D251-N253 VanDerWaalsContact OD1-CB 3.3Å; D251-N253 WeakPolarHBondContact OD1-CB 3.41Å; D251-N253 PolarHBondContact OD1-N 3.04Å; D251-N253 PolarHBondContact OD1-ND2 2.9Å; D251-N253 PolarHBondContact OD2-ND2 3.32Å
254	D	93.4	Very high	94.2	Very high	101 Å²	101	61.9 Å²	61.9	54%	0.54	33%	0.331	S	S	.	.	S	Bend	trans	-71.3	148	171.8	-30.5	-64.6	0	0	0	110.9	R202 F256 K262	R202-D254 PolarHBondContact NH2-O 3.47Å; D254-F256 PolarHBondContact O-N 3.08Å; D254-K262 HydrophobicContact CB-CD 4.3Å; D254-K262 PolarHBondContact O-NZ 2.93Å; D254-K262 IonicContact OD2-NZ 2.74Å; D254-K262 PolarHBondContact OD2-NZ 3.49Å
255	D	88.7	Confident	94.6	Very high	56 Å²	56	57.5 Å²	57.5	30%	0.299	31%	0.308	S	S	.	.			trans	-75.3	95.3	-171.9	-158.7	-19.4	0	0	0	111.3	R205 S257	R205-D255 IonicContact NH1-OD2 3.71Å; R205-D255 PolarHBondContact NH1-OD2 3.39Å; D255-S257 PolarHBondContact O-N 3.28Å; D255-S257 VanDerWaalsContact OD1-CB 3.29Å; D255-S257 WeakPolarHBondContact OD1-CB 3.28Å; D255-S257 PolarHBondContact OD1-N 3.31Å; D255-S257 PolarHBondContact OD1-OG 3.36Å
256	F	93.1	Very high	94.7	Very high	4 Å²	4	56.9 Å²	56.9	2%	0.018	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-0.1	178.2	68.9	-92.2	0	0	0	113.5	T53 F54 V252 D254 E258 K262 Q263 L266	T53-F256 HydrophobicContact CG2-CE2 3.89Å; T53-F256 HydrophobicContact CG2-CZ 4.4Å; F54-F256 HydrophobicContact CB-CE2 4.15Å; F54-F256 HydrophobicContact CB-CZ 4Å; F54-F256 HydrophobicContact CD2-CE2 4.22Å; F54-F256 HydrophobicContact CD2-CZ 4.35Å; V252-F256 HydrophobicContact CB-CD1 3.73Å; V252-F256 HydrophobicContact CB-CE1 3.71Å; V252-F256 HydrophobicContact CG1-CD1 3.72Å; V252-F256 HydrophobicContact CG1-CE1 3.72Å; V252-F256 HydrophobicContact CG2-CE1 4.32Å; D254-F256 PolarHBondContact O-N 3.08Å; F256-E258 VanDerWaalsContact C-N 3.3Å; F256-E258 PolarHBondContact O-N 2.92Å; F256-K262 HydrophobicContact CB-CB 4.44Å; F256-K262 HydrophobicContact CB-CD 4.06Å; F256-K262 HydrophobicContact CB-CG 4.01Å; F256-Q263 WeakPolarHBondContact O-CG 3.49Å; F256-Q263 PolarHBondContact O-NE2 2.92Å; F256-L266 HydrophobicContact CB-CD1 3.8Å; F256-L266 HydrophobicContact CD1-CD1 4.3Å; F256-L266 HydrophobicContact CD2-CD1 4.16Å; F256-L266 HydrophobicContact CG-CD1 3.83Å
257	S	87.3	Confident	94.7	Very high	39 Å²	39	54.5 Å²	54.5	27%	0.273	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-33.8	-173.6	56.7	0	0	0	0	113.5	D255 Q263	D255-S257 PolarHBondContact O-N 3.28Å; D255-S257 VanDerWaalsContact OD1-CB 3.29Å; D255-S257 WeakPolarHBondContact OD1-CB 3.28Å; D255-S257 PolarHBondContact OD1-N 3.31Å; D255-S257 PolarHBondContact OD1-OG 3.36Å; S257-Q263 PolarHBondContact O-NE2 2.94Å
258	E	85.2	Confident	94.6	Very high	163 Å²	163	59.3 Å²	59.3	76%	0.762	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.4	-12.3	-177.2	-57.3	-58.3	145.4	0	0	113.5	F256 V260	F256-E258 VanDerWaalsContact C-N 3.3Å; F256-E258 PolarHBondContact O-N 2.92Å; E258-V260 PolarHBondContact O-N 3.26Å
259	E	92.1	Very high	94.6	Very high	104 Å²	104	62.2 Å²	62.2	49%	0.486	32%	0.315	S	S	.	.			trans	-84.7	95.4	-178.1	-69.1	-174.9	179.8	0	0	112.1	T261 K262 Q263	E259-T261 VanDerWaalsContact C-N 3.3Å; E259-T261 PolarHBondContact O-N 3.4Å; E259-K262 HydrophobicContact CB-CB 3.99Å; E259-K262 PolarHBondContact O-N 3.47Å; E259-K262 VanDerWaalsContact O-N 3.08Å; E259-Q263 WeakPolarHBondContact O-CG 3.29Å; E259-Q263 PolarHBondContact O-N 3.24Å
260	V	92.7	Very high	94.6	Very high	87 Å²	87	60 Å²	60	53%	0.527	30%	0.302	S	S	.	.	H	α-helix	trans	-53.3	-43.9	-177.7	180	0	0	0	0	112.6	E258 K262 Q263 E264	E258-V260 PolarHBondContact O-N 3.26Å; V260-K262 VanDerWaalsContact C-N 3.34Å; V260-K262 PolarHBondContact O-N 3.03Å; V260-Q263 WeakPolarHBondContact O-CB 3.49Å; V260-Q263 PolarHBondContact O-N 3.31Å; V260-Q263 VanDerWaalsContact O-N 3.16Å; V260-E264 HydrophobicContact CG1-CG 4.34Å; V260-E264 WeakPolarHBondContact O-CG 3.48Å; V260-E264 PolarHBondContact O-N 3.03Å
261	T	93.4	Very high	94.5	Very high	99 Å²	99	62.2 Å²	62.2	61%	0.607	31%	0.314	S	S	*	.	H	α-helix	trans	-60	-44.7	179.3	-49.8	0	0	0	0	111.6	E259 Q263 E264 D265	E259-T261 VanDerWaalsContact C-N 3.3Å; E259-T261 PolarHBondContact O-N 3.4Å; T261-Q263 VanDerWaalsContact C-N 3.34Å; T261-Q263 PolarHBondContact O-N 3.49Å; T261-E264 PolarHBondContact O-N 2.96Å; T261-D265 VanDerWaalsContact O-CG 3.27Å; T261-D265 PolarHBondContact O-N 2.74Å
262	K	93.8	Very high	94.4	Very high	30 Å²	30	61.6 Å²	61.6	13%	0.13	31%	0.313	C	S	.	.	H	α-helix	trans	-66.3	-37.9	177.1	-167.4	164.6	-171.3	172.9	0	111.4	D254 F256 E259 V260 D265 L266	D254-K262 HydrophobicContact CB-CD 4.3Å; D254-K262 PolarHBondContact O-NZ 2.93Å; D254-K262 IonicContact OD2-NZ 2.74Å; D254-K262 PolarHBondContact OD2-NZ 3.49Å; F256-K262 HydrophobicContact CB-CB 4.44Å; F256-K262 HydrophobicContact CB-CD 4.06Å; F256-K262 HydrophobicContact CB-CG 4.01Å; E259-K262 HydrophobicContact CB-CB 3.99Å; E259-K262 PolarHBondContact O-N 3.47Å; E259-K262 VanDerWaalsContact O-N 3.08Å; V260-K262 VanDerWaalsContact C-N 3.34Å; V260-K262 PolarHBondContact O-N 3.03Å; K262-D265 PolarHBondContact O-N 2.87Å; K262-L266 HydrophobicContact CG-CD1 4.37Å; K262-L266 WeakPolarHBondContact O-CB 3.22Å; K262-L266 WeakPolarHBondContact O-CG 3.21Å; K262-L266 PolarHBondContact O-N 3.38Å
263	Q	96	Very high	94.4	Very high	33 Å²	33	63 Å²	63	15%	0.154	32%	0.319	C	S	.	.	H	α-helix	trans	-61.2	-46.4	174.3	-67.1	-177.9	1	0	0	112.1	L57 F256 S257 E259 V260 T261 D265 L266 M267	L57-Q263 HydrophobicContact CD1-CB 4.13Å; L57-Q263 HydrophobicContact CD1-CG 4.3Å; L57-Q263 HydrophobicContact CD2-CB 3.73Å; L57-Q263 HydrophobicContact CD2-CG 3.73Å; F256-Q263 WeakPolarHBondContact O-CG 3.49Å; F256-Q263 PolarHBondContact O-NE2 2.92Å; S257-Q263 PolarHBondContact O-NE2 2.94Å; E259-Q263 WeakPolarHBondContact O-CG 3.29Å; E259-Q263 PolarHBondContact O-N 3.24Å; V260-Q263 WeakPolarHBondContact O-CB 3.49Å; V260-Q263 PolarHBondContact O-N 3.31Å; V260-Q263 VanDerWaalsContact O-N 3.16Å; T261-Q263 VanDerWaalsContact C-N 3.34Å; T261-Q263 PolarHBondContact O-N 3.49Å; Q263-D265 VanDerWaalsContact C-N 3.35Å; Q263-D265 PolarHBondContact O-N 3.27Å; Q263-L266 PolarHBondContact O-N 3.21Å; Q263-M267 VanDerWaalsContact O-CG 3.26Å; Q263-M267 WeakPolarHBondContact O-CG 3.39Å; Q263-M267 PolarHBondContact O-N 3.01Å
264	E	95.6	Very high	94.3	Very high	122 Å²	122	61.1 Å²	61.1	57%	0.57	31%	0.31	S	S	*	.	H	α-helix	trans	-62.5	-41.6	178.3	-72.2	178	170.2	0	0	112.1	V260 T261 M267 R268	V260-E264 HydrophobicContact CG1-CG 4.34Å; V260-E264 WeakPolarHBondContact O-CG 3.48Å; V260-E264 PolarHBondContact O-N 3.03Å; T261-E264 PolarHBondContact O-N 2.96Å; E264-M267 PolarHBondContact O-N 2.93Å; E264-R268 WeakPolarHBondContact O-CB 3.31Å; E264-R268 PolarHBondContact O-N 3.44Å
265	D	96.8	Very high	94.3	Very high	54 Å²	54	62 Å²	62	29%	0.289	31%	0.308	S	S	.	.	H	α-helix	trans	-61.5	-49.9	176.2	-71.8	-20.5	0	0	0	111.6	T261 K262 Q263 M267 R268 E269	T261-D265 VanDerWaalsContact O-CG 3.27Å; T261-D265 PolarHBondContact O-N 2.74Å; K262-D265 PolarHBondContact O-N 2.87Å; Q263-D265 VanDerWaalsContact C-N 3.35Å; Q263-D265 PolarHBondContact O-N 3.27Å; D265-M267 VanDerWaalsContact C-N 3.33Å; D265-M267 PolarHBondContact O-N 3.04Å; D265-R268 VanDerWaalsContact CG-NH2 3.33Å; D265-R268 WeakPolarHBondContact O-CB 3.41Å; D265-R268 PolarHBondContact O-N 2.87Å; D265-R268 VanDerWaalsContact O-N 3.14Å; D265-R268 IonicContact OD1-CZ 3.12Å; D265-R268 IonicContact OD1-NH1 2.7Å; D265-R268 PolarHBondContact OD1-NH1 3.41Å; D265-R268 IonicContact OD1-NH2 2.69Å; D265-R268 PolarHBondContact OD1-NH2 2.89Å; D265-E269 PolarHBondContact O-N 2.93Å
266	L	97.6	Very high	94.4	Very high	5 Å²	5	65.5 Å²	65.5	3%	0.026	33%	0.327	C	S	.	.	H	α-helix	trans	-58.7	-43.7	176.9	-69.9	171.8	0	0	0	111.8	F54 L250 V252 F256 K262 Q263 R268 E269 V270	F54-L266 HydrophobicContact CE2-CB 4.2Å; F54-L266 HydrophobicContact CE2-CD1 4.37Å; L250-L266 HydrophobicContact CB-CD2 3.97Å; L250-L266 HydrophobicContact CD1-CD2 4.13Å; L250-L266 HydrophobicContact CD2-CD2 4.11Å; L250-L266 HydrophobicContact CG-CD2 4.29Å; V252-L266 HydrophobicContact CG1-CD1 4.27Å; V252-L266 HydrophobicContact CG1-CD2 4.3Å; F256-L266 HydrophobicContact CB-CD1 3.8Å; F256-L266 HydrophobicContact CD1-CD1 4.3Å; F256-L266 HydrophobicContact CD2-CD1 4.16Å; F256-L266 HydrophobicContact CG-CD1 3.83Å; K262-L266 HydrophobicContact CG-CD1 4.37Å; K262-L266 WeakPolarHBondContact O-CB 3.22Å; K262-L266 WeakPolarHBondContact O-CG 3.21Å; K262-L266 PolarHBondContact O-N 3.38Å; Q263-L266 PolarHBondContact O-N 3.21Å; L266-R268 VanDerWaalsContact C-N 3.34Å; L266-R268 PolarHBondContact O-N 2.87Å; L266-E269 PolarHBondContact O-N 2.97Å; L266-V270 VanDerWaalsContact O-CG2 3.31Å; L266-V270 WeakPolarHBondContact O-CG2 3.35Å; L266-V270 PolarHBondContact O-N 3.48Å
267	M	97.4	Very high	94.1	Very high	9 Å²	9	67.3 Å²	67.3	4%	0.044	34%	0.337	C	S	.	.	H	α-helix	trans	-66.6	-35.8	178.2	-66.5	-57.9	97.7	0	0	112.1	F54 L57 L58 T61 Y62 Q263 E264 D265 V270 N271	F54-M267 HydrophobicContact CD2-CE 4.15Å; F54-M267 HydrophobicContact CE2-CE 3.51Å; F54-M267 HydrophobicContact CZ-CE 3.78Å; L57-M267 HydrophobicContact CD2-CE 3.62Å; L57-M267 HydrophobicContact CD2-CG 4.32Å; L57-M267 HydrophobicContact CD2-SD 4.24Å; L57-M267 HydrophobicContact CG-CE 3.86Å; L57-M267 HydrophobicContact CG-CG 4.23Å; L57-M267 HydrophobicContact CG-SD 3.9Å; L58-M267 HydrophobicContact CD2-CE 3.94Å; L58-M267 HydrophobicContact CD2-SD 3.68Å; L58-M267 HydrophobicContact CG-CE 4.3Å; L58-M267 HydrophobicContact CG-SD 4.32Å; T61-M267 HydrophobicContact CG2-CB 4.18Å; T61-M267 HydrophobicContact CG2-CG 3.97Å; T61-M267 HydrophobicContact CG2-SD 4.25Å; Y62-M267 HydrophobicContact CE2-SD 4.05Å; Y62-M267 PolarHBondContact OH-O 3.31Å; Q263-M267 VanDerWaalsContact O-CG 3.26Å; Q263-M267 WeakPolarHBondContact O-CG 3.39Å; Q263-M267 PolarHBondContact O-N 3.01Å; E264-M267 PolarHBondContact O-N 2.93Å; D265-M267 VanDerWaalsContact C-N 3.33Å; D265-M267 PolarHBondContact O-N 3.04Å; M267-V270 PolarHBondContact O-N 3.43Å; M267-N271 WeakPolarHBondContact O-CB 3.44Å; M267-N271 PolarHBondContact O-N 3.39Å
268	R	97.3	Very high	94.5	Very high	138 Å²	138	68.8 Å²	68.8	52%	0.521	34%	0.34	S	S	.	.	H	α-helix	trans	-62.9	-43.1	175.2	-178	178.9	62.1	-116	-2	111.4	E264 D265 L266 T272	E264-R268 WeakPolarHBondContact O-CB 3.31Å; E264-R268 PolarHBondContact O-N 3.44Å; D265-R268 VanDerWaalsContact CG-NH2 3.33Å; D265-R268 WeakPolarHBondContact O-CB 3.41Å; D265-R268 PolarHBondContact O-N 2.87Å; D265-R268 VanDerWaalsContact O-N 3.14Å; D265-R268 IonicContact OD1-CZ 3.12Å; D265-R268 IonicContact OD1-NH1 2.7Å; D265-R268 PolarHBondContact OD1-NH1 3.41Å; D265-R268 IonicContact OD1-NH2 2.69Å; D265-R268 PolarHBondContact OD1-NH2 2.89Å; L266-R268 VanDerWaalsContact C-N 3.34Å; L266-R268 PolarHBondContact O-N 2.87Å; R268-T272 WeakPolarHBondContact O-CB 3.26Å; R268-T272 PolarHBondContact O-N 2.97Å; R268-T272 PolarHBondContact O-OG1 2.75Å
269	E	98.1	Very high	95	Very high	82 Å²	82	63.8 Å²	63.8	38%	0.383	32%	0.318	S	S	.	.	H	α-helix	trans	-63.1	-46.8	175.6	-70.5	-177.1	-117.5	0	0	111.4	L250 D265 L266 N271 T272 F273	L250-E269 HydrophobicContact CD2-CB 3.99Å; L250-E269 WeakPolarHBondContact CD2-OE2 3.46Å; D265-E269 PolarHBondContact O-N 2.93Å; L266-E269 PolarHBondContact O-N 2.97Å; E269-N271 PolarHBondContact O-N 3.06Å; E269-T272 PolarHBondContact O-N 2.84Å; E269-F273 WeakPolarHBondContact O-CB 3.46Å; E269-F273 PolarHBondContact O-N 3.4Å
270	V	97.6	Very high	95.1	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-58.6	-47	176.6	171.7	0	0	0	0	111.9	F54 L58 W65 I190 L248 L250 L266 M267 T272 F273 I274	F54-V270 HydrophobicContact CE1-CG2 4.38Å; F54-V270 HydrophobicContact CZ-CG2 3.66Å; L58-V270 HydrophobicContact CD2-CG1 3.93Å; W65-V270 HydrophobicContact CH2-CG1 3.95Å; W65-V270 HydrophobicContact CZ3-CG1 3.99Å; I190-V270 HydrophobicContact CD1-CG1 4.15Å; I190-V270 HydrophobicContact CD1-CG2 4.33Å; L248-V270 HydrophobicContact CD2-CB 4.45Å; L248-V270 HydrophobicContact CD2-CG2 3.94Å; L250-V270 HydrophobicContact CD1-CG2 3.98Å; L266-V270 VanDerWaalsContact O-CG2 3.31Å; L266-V270 WeakPolarHBondContact O-CG2 3.35Å; L266-V270 PolarHBondContact O-N 3.48Å; M267-V270 PolarHBondContact O-N 3.43Å; V270-T272 VanDerWaalsContact C-N 3.31Å; V270-T272 PolarHBondContact O-N 3.11Å; V270-F273 PolarHBondContact O-N 2.55Å; V270-I274 HydrophobicContact CG1-CD1 3.7Å; V270-I274 WeakPolarHBondContact O-CB 3.5Å; V270-I274 PolarHBondContact O-N 3.08Å
271	N	95.9	Very high	95.3	Very high	48 Å²	48	60.1 Å²	60.1	26%	0.257	30%	0.296	S	S	.	.	H	α-helix	trans	-61.7	-41	178.3	-172.9	31	0	0	0	111.9	M267 E269 K275	M267-N271 WeakPolarHBondContact O-CB 3.44Å; M267-N271 PolarHBondContact O-N 3.39Å; E269-N271 PolarHBondContact O-N 3.06Å; N271-K275 PolarHBondContact ND2-NZ 2.95Å; N271-K275 WeakPolarHBondContact O-CB 3.07Å; N271-K275 WeakPolarHBondContact O-CD 3.27Å; N271-K275 WeakPolarHBondContact O-CG 3.42Å; N271-K275 PolarHBondContact O-N 3.26Å; N271-K275 VanDerWaalsContact OD1-CE 3.25Å; N271-K275 WeakPolarHBondContact OD1-CE 3.32Å
272	T	97.2	Very high	95.4	Very high	71 Å²	71	57.6 Å²	57.6	44%	0.436	28%	0.276	S	S	.	.	H	α-helix	trans	-65.1	-47.9	178.3	-57.5	0	0	0	0	110.3	R268 E269 V270 K275 N276	R268-T272 WeakPolarHBondContact O-CB 3.26Å; R268-T272 PolarHBondContact O-N 2.97Å; R268-T272 PolarHBondContact O-OG1 2.75Å; E269-T272 PolarHBondContact O-N 2.84Å; V270-T272 VanDerWaalsContact C-N 3.31Å; V270-T272 PolarHBondContact O-N 3.11Å; T272-K275 PolarHBondContact O-N 2.87Å; T272-N276 VanDerWaalsContact O-CG 3.3Å; T272-N276 PolarHBondContact O-N 3.16Å; T272-N276 PolarHBondContact O-ND2 3.18Å
273	F	97.4	Very high	95.5	Very high	29 Å²	29	59.5 Å²	59.5	13%	0.127	29%	0.286	C	S	.	.	H	α-helix	trans	-57.8	-52.4	176	178.5	-114.9	0	0	0	111.5	L41 I190 P246 L248 E269 V270 K275 N276 L277	L41-F273 HydrophobicContact CD2-CD1 4.07Å; L41-F273 HydrophobicContact CD2-CE1 3.72Å; I190-F273 HydrophobicContact CG1-CE1 4.44Å; P246-F273 HydrophobicContact CB-CE2 3.64Å; P246-F273 HydrophobicContact CB-CZ 3.75Å; L248-F273 HydrophobicContact CB-CB 4.27Å; L248-F273 HydrophobicContact CB-CD1 3.69Å; L248-F273 HydrophobicContact CB-CD2 3.84Å; L248-F273 HydrophobicContact CB-CE1 3.84Å; L248-F273 HydrophobicContact CB-CE2 3.99Å; L248-F273 HydrophobicContact CB-CG 3.68Å; L248-F273 HydrophobicContact CB-CZ 3.99Å; L248-F273 HydrophobicContact CD1-CB 4.25Å; L248-F273 HydrophobicContact CD1-CG 4.46Å; L248-F273 HydrophobicContact CD2-CB 3.78Å; L248-F273 HydrophobicContact CD2-CD1 4.07Å; L248-F273 HydrophobicContact CD2-CG 4.03Å; L248-F273 HydrophobicContact CG-CB 4.33Å; L248-F273 HydrophobicContact CG-CD1 4.48Å; L248-F273 HydrophobicContact CG-CG 4.27Å; E269-F273 WeakPolarHBondContact O-CB 3.46Å; E269-F273 PolarHBondContact O-N 3.4Å; V270-F273 PolarHBondContact O-N 2.55Å; F273-K275 VanDerWaalsContact C-N 3.28Å; F273-K275 PolarHBondContact O-N 3.47Å; F273-N276 PolarHBondContact O-N 2.93Å; F273-L277 HydrophobicContact CD1-CD1 4.47Å; F273-L277 HydrophobicContact CE1-CD1 4.13Å; F273-L277 HydrophobicContact CE1-CD2 4.4Å; F273-L277 HydrophobicContact CE2-CD2 4.24Å; F273-L277 HydrophobicContact CZ-CD2 4.04Å; F273-L277 PolarHBondContact O-N 3.45Å
274	I	94.6	Very high	95.5	Very high	10 Å²	10	61.4 Å²	61.4	5%	0.051	30%	0.296	C	S	.	.	H	α-helix	trans	-64.3	-32.5	-178.3	-76.5	169.1	0	0	0	111.8	R39 L41 W65 V137 V270 N276 L277	R39-I274 PolarHBondContact NH1-O 3.23Å; L41-I274 HydrophobicContact CD1-CD1 4.04Å; L41-I274 HydrophobicContact CD1-CG1 4.07Å; L41-I274 HydrophobicContact CD2-CD1 3.94Å; L41-I274 HydrophobicContact CD2-CG1 3.67Å; W65-I274 HydrophobicContact CE3-CD1 4.35Å; W65-I274 HydrophobicContact CH2-CB 4.48Å; W65-I274 HydrophobicContact CH2-CD1 3.13Å; W65-I274 HydrophobicContact CH2-CG1 4.35Å; W65-I274 HydrophobicContact CH2-CG2 4.43Å; W65-I274 HydrophobicContact CZ2-CD1 4.01Å; W65-I274 HydrophobicContact CZ2-CG2 4.33Å; W65-I274 HydrophobicContact CZ3-CD1 3.31Å; V137-I274 HydrophobicContact CG1-CD1 4.24Å; V137-I274 HydrophobicContact CG2-CG2 3.98Å; V270-I274 HydrophobicContact CG1-CD1 3.7Å; V270-I274 WeakPolarHBondContact O-CB 3.5Å; V270-I274 PolarHBondContact O-N 3.08Å; I274-N276 VanDerWaalsContact C-N 3.25Å; I274-N276 PolarHBondContact O-N 3.41Å; I274-L277 HydrophobicContact CG1-CD1 4.4Å; I274-L277 PolarHBondContact O-N 2.65Å
275	K	91.6	Very high	95.4	Very high	118 Å²	118	56.7 Å²	56.7	51%	0.513	27%	0.274	S	S	.	.	H	α-helix	trans	-66.3	-27.4	174.5	-80.2	168.8	176.6	169.5	0	113.4	N271 T272 F273	N271-K275 PolarHBondContact ND2-NZ 2.95Å; N271-K275 WeakPolarHBondContact O-CB 3.07Å; N271-K275 WeakPolarHBondContact O-CD 3.27Å; N271-K275 WeakPolarHBondContact O-CG 3.42Å; N271-K275 PolarHBondContact O-N 3.26Å; N271-K275 VanDerWaalsContact OD1-CE 3.25Å; N271-K275 WeakPolarHBondContact OD1-CE 3.32Å; T272-K275 PolarHBondContact O-N 2.87Å; F273-K275 VanDerWaalsContact C-N 3.28Å; F273-K275 PolarHBondContact O-N 3.47Å
276	N	91.4	Very high	95.3	Very high	131 Å²	131	56.9 Å²	56.9	70%	0.701	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-2.9	-177.2	-65.1	-23.2	0	0	0	113.6	T272 F273 I274	T272-N276 VanDerWaalsContact O-CG 3.3Å; T272-N276 PolarHBondContact O-N 3.16Å; T272-N276 PolarHBondContact O-ND2 3.18Å; F273-N276 PolarHBondContact O-N 2.93Å; I274-N276 VanDerWaalsContact C-N 3.25Å; I274-N276 PolarHBondContact O-N 3.41Å
277	L	87.9	Confident	95.1	Very high	42 Å²	42	61.6 Å²	61.6	22%	0.22	30%	0.296	C	S	.	.			trans	-74.5	0	170.4	-62.7	-178.1	0	0	0	113.2	R39 L41 H187 P246 F273 I274	R39-L277 PolarHBondContact NH1-O 3.33Å; R39-L277 PolarHBondContact NH2-O 3.11Å; L41-L277 HydrophobicContact CD1-CD1 4.27Å; L41-L277 HydrophobicContact CD2-CD1 3.76Å; L41-L277 HydrophobicContact CG-CD1 4.09Å; H187-L277 HydrophobicContact CB-CD1 4.33Å; H187-L277 WeakPolarHBondContact O-CD2 3.15Å; P246-L277 HydrophobicContact CB-CD2 3.86Å; P246-L277 HydrophobicContact CG-CD2 3.75Å; F273-L277 HydrophobicContact CD1-CD1 4.47Å; F273-L277 HydrophobicContact CE1-CD1 4.13Å; F273-L277 HydrophobicContact CE1-CD2 4.4Å; F273-L277 HydrophobicContact CE2-CD2 4.24Å; F273-L277 HydrophobicContact CZ-CD2 4.04Å; F273-L277 PolarHBondContact O-N 3.45Å; I274-L277 HydrophobicContact CG1-CD1 4.4Å; I274-L277 PolarHBondContact O-N 2.65Å

Retrieved 277 of 277 residues in 129.1 ms (Link to these results)

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