A0A077YXR4_TRITR Loading...

Homeobox and LIM domain containing protein

AlphaFold DB , UniProt , Accession A0A077YXR4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 292 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	39.4	Very low	43.1	Very low	152 Å²	152	112.5 Å²	112.5	75%	0.749	59%	0.589	S	S	*	*				0	107.8	0	-65.8	173.9	177.9	0	0	108.6	T3 L171	M1-T3 VanDerWaalsContact C-N 3.31Å; M1-T3 PolarHBondContact O-N 3.36Å; M1-L171 HydrophobicContact CE-CD2 3.54Å; M1-L171 HydrophobicContact CE-CG 3.72Å; M1-L171 HydrophobicContact SD-CD2 3.48Å; M1-L171 WeakPolarHBondContact SD-CD2 3.34Å; M1-L171 HydrophobicContact SD-CG 4.26Å
2	N	35.2	Very low	42.8	Very low	172 Å²	172	124.3 Å²	124.3	92%	0.92	62%	0.619	S	S	*	*			trans	-75.6	80.6	-177.7	-79.3	-10.6	0	0	0	110.9	T4	N2-T4 PolarHBondContact O-N 3.4Å
3	T	44.2	Very low	42.3	Very low	69 Å²	69	119.2 Å²	119.2	42%	0.423	60%	0.6	S	S	.	*			trans	-84	93	174	59.5	0	0	0	0	109.1	M1 K5 Y154	M1-T3 VanDerWaalsContact C-N 3.31Å; M1-T3 PolarHBondContact O-N 3.36Å; T3-K5 PolarHBondContact O-N 2.99Å; T3-K5 VanDerWaalsContact O-N 3.14Å; T3-Y154 WeakPolarHBondContact CB-OH 3.47Å; T3-Y154 VanDerWaalsContact CG2-OH 3.26Å; T3-Y154 WeakPolarHBondContact CG2-OH 3.43Å; T3-Y154 PolarHBondContact OG1-OH 3.5Å
4	T	46.5	Very low	41.5	Very low	84 Å²	84	124.6 Å²	124.6	52%	0.515	62%	0.621	S	S	.	*			trans	-69.4	109.7	178.6	-14.8	0	0	0	0	109.8	N2 R6	N2-T4 PolarHBondContact O-N 3.4Å; T4-R6 HydrophobicContact CG2-CG 4.23Å; T4-R6 PolarHBondContact O-N 3.24Å
5	K	50.3	Low	41.1	Very low	115 Å²	115	122.1 Å²	122.1	50%	0.5	62%	0.615	S	S	.	*			trans	-62.5	119.6	165.8	-174.4	-177.6	-177.2	-161.7	0	108	T3 E138 Y140	T3-K5 PolarHBondContact O-N 2.99Å; T3-K5 VanDerWaalsContact O-N 3.14Å; K5-E138 WeakPolarHBondContact CE-OE1 3.43Å; K5-E138 IonicContact NZ-OE1 3.38Å; K5-E138 PolarHBondContact NZ-OE1 3.1Å; K5-E138 IonicContact NZ-OE2 2.78Å; K5-Y140 HydrophobicContact CB-CE1 4.25Å
6	R	53.2	Low	40.6	Very low	136 Å²	136	118.8 Å²	118.8	51%	0.513	61%	0.613	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-132.8	135.3	-179.9	-64.2	-168.6	-170.3	-137.1	5	111.7	T4	T4-R6 HydrophobicContact CG2-CG 4.23Å; T4-R6 PolarHBondContact O-N 3.24Å
7	K	50	Low	39.9	Very low	152 Å²	152	123.8 Å²	123.8	66%	0.661	63%	0.633	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.1	129.5	170.5	-155.8	171	-173.3	-179.7	0	106.7	P9	K7-P9 VanDerWaalsContact O-CD 3.24Å; K7-P9 WeakPolarHBondContact O-CD 3.2Å
8	C	39.6	Very low	39.7	Very low	36 Å²	36	121.9 Å²	121.9	24%	0.243	62%	0.623	C	S	.	*	P	Polyproline II helix	trans	-63.7	119	-177.7	-113.4	0	0	0	0	110.4	F139	C8-F139 HydrophobicContact CB-CE1 4.02Å; C8-F139 WeakPolarHBondContact SG-CE1 3.24Å; C8-F139 VanDerWaalsContact SG-CZ 3.59Å
9	P	40	Very low	39.7	Very low	102 Å²	102	122.5 Å²	122.5	66%	0.662	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-78.8	133.7	170.7	30.6	-27.8	0	0	0	109.4	K7 S11	K7-P9 VanDerWaalsContact O-CD 3.24Å; K7-P9 WeakPolarHBondContact O-CD 3.2Å; P9-S11 VanDerWaalsContact C-N 3.35Å; P9-S11 PolarHBondContact O-N 2.77Å; P9-S11 PolarHBondContact O-OG 3.26Å
10	N	36.2	Very low	39.6	Very low	151 Å²	151	118.3 Å²	118.3	81%	0.807	61%	0.614	S	S	*	*			trans	-64.4	88.9	179.2	-144.3	9	0	0	0	109
11	S	39.1	Very low	39.9	Very low	69 Å²	69	122.6 Å²	122.6	48%	0.483	62%	0.623	S	S	.	*			trans	-124	99.4	178.6	52.9	0	0	0	0	109.9	P9 T13	P9-S11 VanDerWaalsContact C-N 3.35Å; P9-S11 PolarHBondContact O-N 2.77Å; P9-S11 PolarHBondContact O-OG 3.26Å; S11-T13 PolarHBondContact O-N 3.44Å; S11-T13 PolarHBondContact O-OG1 3.41Å
12	R	39.7	Very low	40.1	Very low	253 Å²	253	122.1 Å²	122.1	96%	0.955	62%	0.619	S	S	*	*			trans	-54.8	94	154.2	-86.2	179.8	164.8	-179.7	-4.4	106.7
13	T	36.9	Very low	40.5	Very low	59 Å²	59	114.9 Å²	114.9	36%	0.362	58%	0.581	S	S	.	*			trans	-96	99	171.9	-39.8	0	0	0	0	105.9	S11 V15	S11-T13 PolarHBondContact O-N 3.44Å; S11-T13 PolarHBondContact O-OG1 3.41Å; T13-V15 HydrophobicContact CG2-CG2 3.96Å; T13-V15 PolarHBondContact O-N 2.93Å; T13-V15 VanDerWaalsContact O-N 3.11Å
14	E	31	Very low	40.5	Very low	194 Å²	194	114.6 Å²	114.6	91%	0.907	59%	0.592	S	S	*	*			trans	-64.8	103.5	162	-77.6	-178.4	145.6	0	0	106.9
15	V	35.2	Very low	40.4	Very low	87 Å²	87	119 Å²	119	53%	0.527	60%	0.604	S	S	.	*			trans	-92.8	116.2	179.1	-169	0	0	0	0	109	T13	T13-V15 HydrophobicContact CG2-CG2 3.96Å; T13-V15 PolarHBondContact O-N 2.93Å; T13-V15 VanDerWaalsContact O-N 3.11Å
16	A	33.5	Very low	40.1	Very low	70 Å²	70	117 Å²	117	58%	0.579	61%	0.61	S	S	*	*			trans	70.3	92.4	156.1	0	0	0	0	0	117.7	I18	A16-I18 HydrophobicContact CB-CG1 4.37Å; A16-I18 PolarHBondContact O-N 3.47Å; A16-I18 VanDerWaalsContact O-N 3.08Å
17	Q	27.6	Very low	39.7	Very low	204 Å²	204	116.5 Å²	116.5	95%	0.953	62%	0.616	S	S	*	*			trans	-50.9	100	150.3	-161	156.7	0.5	0	0	109.8
18	I	37.1	Very low	39.3	Very low	89 Å²	89	116 Å²	116	46%	0.456	62%	0.616	S	S	.	*			trans	-113.3	124.5	169.3	-61.5	178.9	0	0	0	107	A16 G20 F91	A16-I18 HydrophobicContact CB-CG1 4.37Å; A16-I18 PolarHBondContact O-N 3.47Å; A16-I18 VanDerWaalsContact O-N 3.08Å; I18-G20 VanDerWaalsContact C-N 3.31Å; I18-G20 PolarHBondContact O-N 2.98Å; I18-F91 HydrophobicContact CD1-CE1 4.17Å
19	I	39.4	Very low	39.6	Very low	133 Å²	133	117 Å²	117	68%	0.682	63%	0.627	S	S	*	*			trans	-54.6	87.6	-175.4	-57.6	161.3	0	0	0	109.5	R21	I19-R21 HydrophobicContact CG2-CB 4.36Å; I19-R21 HydrophobicContact CG2-CG 3.61Å; I19-R21 PolarHBondContact O-N 2.8Å
20	G	37.8	Very low	39.7	Very low	38 Å²	38	117.9 Å²	117.9	39%	0.392	63%	0.633	S	S	.	*			trans	-76.1	73	166.7	0	0	0	0	0	108.8	I18 H22	I18-G20 VanDerWaalsContact C-N 3.31Å; I18-G20 PolarHBondContact O-N 2.98Å; G20-H22 PolarHBondContact O-N 3.21Å
21	R	45.8	Very low	40	Very low	209 Å²	209	118.1 Å²	118.1	79%	0.789	63%	0.632	S	S	*	*			trans	-69	117	168.3	-87	169.4	-178	-161.8	0.7	107.3	I19 C23	I19-R21 HydrophobicContact CG2-CB 4.36Å; I19-R21 HydrophobicContact CG2-CG 3.61Å; I19-R21 PolarHBondContact O-N 2.8Å; R21-C23 PolarHBondContact O-N 2.92Å
22	H	43.8	Very low	40.2	Very low	143 Å²	143	124.2 Å²	124.2	66%	0.662	65%	0.65	S	S	*	*			trans	-50.7	124	176.8	-66.4	-101.4	0	0	0	110.1	G20 G24	G20-H22 PolarHBondContact O-N 3.21Å; H22-G24 PolarHBondContact O-N 3.38Å
23	C	42.8	Very low	40.2	Very low	19 Å²	19	117.6 Å²	117.6	13%	0.128	64%	0.643	C	S	.	*			trans	-87.3	90.5	163.5	49.8	0	0	0	0	106.9	R21 D75	R21-C23 PolarHBondContact O-N 2.92Å; C23-D75 PolarHBondContact SG-O 3.4Å
24	G	45.3	Very low	40.8	Very low	63 Å²	63	121.1 Å²	121.1	65%	0.649	66%	0.664	S	S	*	*			trans	-173.4	65.4	-175.3	0	0	0	0	0	112.3	H22	H22-G24 PolarHBondContact O-N 3.38Å
25	F	43.7	Very low	42.3	Very low	176 Å²	176	117.1 Å²	117.1	77%	0.772	66%	0.658	S	S	*	*			trans	-124.1	101.9	156	-131.8	-90.6	0	0	0	106.3	L27	F25-L27 VanDerWaalsContact C-N 3.32Å; F25-L27 HydrophobicContact CD1-CD2 3.69Å; F25-L27 HydrophobicContact CD1-CG 4.08Å; F25-L27 HydrophobicContact CE1-CD2 4.11Å; F25-L27 PolarHBondContact O-N 3.23Å
26	A	44.4	Very low	44	Very low	75 Å²	75	116.2 Å²	116.2	62%	0.62	66%	0.655	S	S	*	*			trans	-68.9	95.9	167.6	0	0	0	0	0	106.7	F50	A26-F50 HydrophobicContact CB-CD1 4.45Å
27	L	45.1	Very low	46	Very low	125 Å²	125	115.2 Å²	115.2	65%	0.654	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-86.3	118.1	165.6	-68.8	174	0	0	0	106.9	F25 A29	F25-L27 VanDerWaalsContact C-N 3.32Å; F25-L27 HydrophobicContact CD1-CD2 3.69Å; F25-L27 HydrophobicContact CD1-CG 4.08Å; F25-L27 HydrophobicContact CE1-CD2 4.11Å; F25-L27 PolarHBondContact O-N 3.23Å; L27-A29 PolarHBondContact O-N 3.07Å
28	E	41.5	Very low	48.7	Very low	142 Å²	142	109.2 Å²	109.2	66%	0.664	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-62.2	118.6	166.9	-63.8	-167.6	130.3	0	0	107.7	R49	E28-R49 IonicContact OE1-NH2 3.2Å; E28-R49 PolarHBondContact OE1-NH2 2.93Å
29	A	45.1	Very low	51.1	Low	55 Å²	55	105 Å²	105	46%	0.455	60%	0.601	S	S	.	*	P	Polyproline II helix	trans	-64.4	128.1	177.7	0	0	0	0	0	109.4	L27 I31	L27-A29 PolarHBondContact O-N 3.07Å; A29-I31 PolarHBondContact O-N 3.25Å
30	P	42.6	Very low	53.1	Low	122 Å²	122	100.9 Å²	100.9	79%	0.792	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-63.5	122.6	169	-8.7	21.9	0	0	0	108.7	F32	P30-F32 PolarHBondContact O-N 3.4Å
31	I	42	Very low	55.2	Low	156 Å²	156	104.6 Å²	104.6	80%	0.8	59%	0.592	S	S	*	*	S	Bend	trans	-59.8	122.4	168.5	36.4	170.5	0	0	0	109.9	A29	A29-I31 PolarHBondContact O-N 3.25Å
32	F	43.3	Very low	57.1	Low	196 Å²	196	96.9 Å²	96.9	86%	0.86	57%	0.57	S	S	*	*	S	Bend	trans	79.3	122.5	169.4	-72	-93.7	0	0	0	119.4	P30	P30-F32 PolarHBondContact O-N 3.4Å
33	S	39.9	Very low	58.9	Low	115 Å²	115	97.9 Å²	97.9	80%	0.804	58%	0.575	S	S	*	*	S	Bend	trans	84.9	128.1	167.3	71.1	0	0	0	0	118.3
34	V	50.1	Low	60.8	Low	132 Å²	132	102.9 Å²	102.9	80%	0.8	60%	0.596	S	S	*	*	S	Bend	trans	90.9	90.5	174.6	-157.4	0	0	0	0	116.4
35	S	63.4	Low	62.7	Low	111 Å²	111	103.2 Å²	103.2	78%	0.776	59%	0.587	S	S	*	*			trans	40.8	95.2	165.2	60.9	0	0	0	0	117.7
36	S	69	Low	64.5	Low	68 Å²	68	95.1 Å²	95.1	48%	0.476	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-59.2	133	169.3	-59.2	0	0	0	0	110.5	C38	S36-C38 PolarHBondContact O-N 3.07Å
37	P	76.1	Confident	66.2	Low	49 Å²	49	98.5 Å²	98.5	32%	0.318	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-65	131.7	178.8	27.1	-33.4	0	0	0	110	I46 I51 S58	P37-I46 WeakPolarHBondContact O-CB 3.41Å; P37-I46 WeakPolarHBondContact O-CG1 3.39Å; P37-I46 PolarHBondContact O-N 3.36Å; P37-I51 HydrophobicContact CG-CD1 3.78Å; P37-S58 WeakPolarHBondContact CB-OG 3.39Å
38	C	85.3	Confident	67.8	Low	78 Å²	78	95.6 Å²	95.6	53%	0.527	54%	0.544	S	S	.	.	B	Isolated β-bridge	trans	-76.9	141.5	174.6	-60.7	0	0	0	0	109.9	S36 A40 E44	S36-C38 PolarHBondContact O-N 3.07Å; C38-A40 PolarHBondContact O-N 2.87Å; C38-E44 CarbonylContact C-O 3.55Å; C38-E44 WeakPolarHBondContact CA-O 3.48Å
39	C	86.1	Confident	69.6	Low	1 Å²	1	96.9 Å²	96.9	1%	0.007	54%	0.542	C	S	.	.	B	Isolated β-bridge	trans	-71.5	122.3	176	176.5	0	0	0	0	110.2	K41 C42 E43 E44 I46 S58 H60 C63	C39-K41 PolarHBondContact O-N 2.62Å; C39-C42 WeakPolarHBondContact CB-SG 3.47Å; C39-C42 PolarHBondContact O-N 3.16Å; C39-E43 WeakPolarHBondContact O-CA 3.47Å; C39-E43 PolarHBondContact O-N 3.02Å; C39-E44 PolarHBondContact N-O 3.5Å; C39-I46 HydrophobicContact CB-CD1 4.03Å; C39-I46 HydrophobicContact CB-CG1 3.8Å; C39-S58 CarbonylContact C-O 3.54Å; C39-S58 VanDerWaalsContact CA-O 3.26Å; C39-S58 WeakPolarHBondContact CA-O 3.26Å; C39-H60 WeakPolarHBondContact CB-ND1 3.45Å; C39-C63 VanDerWaalsContact SG-CB 3.59Å
40	A	83	Confident	71.1	Confident	45 Å²	45	99.3 Å²	99.3	37%	0.372	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-5.8	-178.1	0	0	0	0	0	114.9	C38 Q57 S58 Y59	C38-A40 PolarHBondContact O-N 2.87Å; A40-Q57 HydrophobicContact CB-CB 3.78Å; A40-Q57 HydrophobicContact CB-CG 3.87Å; A40-S58 PolarHBondContact N-O 3.2Å; A40-Y59 HydrophobicContact CB-CE1 3.92Å; A40-Y59 HydrophobicContact CB-CE2 4.31Å
41	K	81.2	Confident	72.8	Confident	116 Å²	116	95.8 Å²	95.8	50%	0.504	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-41.1	178.2	-173.9	-178	177.6	-165.5	0	114.1	C39 Y59 C63	C39-K41 PolarHBondContact O-N 2.62Å; K41-Y59 HydrophobicContact CB-CD1 4.1Å; K41-Y59 HydrophobicContact CB-CE1 4.09Å; K41-C63 HydrophobicContact CB-CB 4.21Å; K41-C63 HydrophobicContact CD-CB 3.91Å; K41-C63 WeakPolarHBondContact CD-O 3.37Å; K41-C63 PolarHBondContact NZ-O 3.18Å
42	C	85.8	Confident	74.6	Confident	48 Å²	48	91 Å²	91	32%	0.324	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-5.4	-178.5	56.1	0	0	0	0	113	C39 E44 H60 C63	C39-C42 WeakPolarHBondContact CB-SG 3.47Å; C39-C42 PolarHBondContact O-N 3.16Å; C42-E44 PolarHBondContact O-N 3.35Å; C42-H60 PolarHBondContact SG-CE1 3.13Å; C42-H60 PolarHBondContact SG-ND1 2.88Å; C42-C63 VanDerWaalsContact SG-SG 3.69Å
43	E	81.9	Confident	76.3	Confident	164 Å²	164	88.2 Å²	88.2	77%	0.766	48%	0.478	S	S	*	.			trans	62	3.1	-179.3	-58.4	177.5	-176.3	0	0	114.6	C39	C39-E43 WeakPolarHBondContact O-CA 3.47Å; C39-E43 PolarHBondContact O-N 3.02Å
44	E	83.1	Confident	78.1	Confident	124 Å²	124	83.4 Å²	83.4	58%	0.579	44%	0.443	S	S	*	.			trans	-82.2	149	176.6	-68.1	178.8	172.9	0	0	112.3	C38 C39 C42 I46	C38-E44 CarbonylContact C-O 3.55Å; C38-E44 WeakPolarHBondContact CA-O 3.48Å; C39-E44 PolarHBondContact N-O 3.5Å; C42-E44 PolarHBondContact O-N 3.35Å; E44-I46 PolarHBondContact O-N 2.8Å
45	P	83.9	Confident	79.4	Confident	70 Å²	70	83.1 Å²	83.1	46%	0.455	44%	0.437	S	S	.	.	B	Isolated β-bridge	trans	-64.7	131.8	175.8	27.4	-34	0	0	0	110.9	L47	P45-L47 PolarHBondContact O-N 2.98Å
46	I	82.5	Confident	80.1	Confident	5 Å²	5	85 Å²	85	3%	0.026	44%	0.438	C	S	.	.			trans	-78.2	108.8	179.6	-57.7	169	0	0	0	109.4	P37 C39 E44 D48 I51 S58 H60	P37-I46 WeakPolarHBondContact O-CB 3.41Å; P37-I46 WeakPolarHBondContact O-CG1 3.39Å; P37-I46 PolarHBondContact O-N 3.36Å; C39-I46 HydrophobicContact CB-CD1 4.03Å; C39-I46 HydrophobicContact CB-CG1 3.8Å; E44-I46 PolarHBondContact O-N 2.8Å; I46-D48 HydrophobicContact CG2-CB 4.02Å; I46-I51 HydrophobicContact CB-CD1 4.44Å; I46-I51 HydrophobicContact CD1-CG2 3.85Å; I46-I51 HydrophobicContact CG2-CB 4.48Å; I46-I51 HydrophobicContact CG2-CD1 4.05Å; I46-I51 HydrophobicContact CG2-CG1 3.75Å; I46-I51 HydrophobicContact CG2-CG2 4.35Å; I46-S58 VanDerWaalsContact CD1-CB 3.47Å; I46-H60 WeakPolarHBondContact CA-NE2 3.44Å
47	L	80.4	Confident	80.7	Confident	147 Å²	147	85 Å²	85	77%	0.77	43%	0.43	S	S	*	.			trans	-98.6	-0.3	175.8	-57.4	179	0	0	0	112.7	P45	P45-L47 PolarHBondContact O-N 2.98Å
48	D	77.8	Confident	81.1	Confident	64 Å²	64	83.5 Å²	83.5	34%	0.342	42%	0.421	S	S	.	.	S	Bend	trans	-66.1	145.4	179	-71.8	-17	0	0	0	111.6	I46 F50 H60	I46-D48 HydrophobicContact CG2-CB 4.02Å; D48-F50 PolarHBondContact O-N 3.04Å; D48-H60 IonicContact OD2-CD2 3.4Å; D48-H60 PolarHBondContact OD2-CD2 3.08Å
49	R	79.4	Confident	81	Confident	168 Å²	168	80.3 Å²	80.3	63%	0.634	40%	0.398	S	S	*	.	S	Bend	trans	-58.8	-30.9	172.1	-178.5	175.8	179.1	175.7	1.2	112.5	E28	E28-R49 IonicContact OE1-NH2 3.2Å; E28-R49 PolarHBondContact OE1-NH2 2.93Å
50	F	77.3	Confident	80.9	Confident	107 Å²	107	81.5 Å²	81.5	47%	0.469	40%	0.404	S	S	.	.	S	Bend	trans	-118	122.4	-177.5	-60.4	-73.1	0	0	0	110.1	A26 D48	A26-F50 HydrophobicContact CB-CD1 4.45Å; D48-F50 PolarHBondContact O-N 3.04Å
51	I	78.6	Confident	80.9	Confident	47 Å²	47	81.7 Å²	81.7	24%	0.241	40%	0.403	C	S	.	.			trans	-111.3	126.2	179.9	-51.2	-174	0	0	0	108.5	P37 I46	P37-I51 HydrophobicContact CG-CD1 3.78Å; I46-I51 HydrophobicContact CB-CD1 4.44Å; I46-I51 HydrophobicContact CD1-CG2 3.85Å; I46-I51 HydrophobicContact CG2-CB 4.48Å; I46-I51 HydrophobicContact CG2-CD1 4.05Å; I46-I51 HydrophobicContact CG2-CG1 3.75Å; I46-I51 HydrophobicContact CG2-CG2 4.35Å
52	F	78.9	Confident	80.9	Confident	55 Å²	55	82.4 Å²	82.4	24%	0.241	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	112.6	171.2	-74.8	-89.2	0	0	0	109.5	Y59 L64	F52-Y59 PolarHBondContact N-O 2.68Å; F52-Y59 VanDerWaalsContact N-O 3.16Å; F52-Y59 PolarHBondContact O-N 3.34Å; F52-L64 HydrophobicContact CB-CD2 3.82Å; F52-L64 HydrophobicContact CD1-CD2 3.84Å; F52-L64 HydrophobicContact CG-CD2 3.87Å
53	K	79.5	Confident	80.8	Confident	139 Å²	139	81.1 Å²	81.1	60%	0.604	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.5	118.6	173.5	-168.2	174.9	-179.9	179.7	0	110.1	L55	K53-L55 WeakPolarHBondContact CE-O 3.02Å
54	V	77.5	Confident	80.9	Confident	13 Å²	13	73.4 Å²	73.4	8%	0.079	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	110.1	176.7	-177.3	0	0	0	0	108	D56 Q57 Y59 L64 C77 I84	V54-D56 PolarHBondContact O-N 3.21Å; V54-D56 VanDerWaalsContact O-N 3.13Å; V54-Q57 PolarHBondContact N-O 2.91Å; V54-Q57 PolarHBondContact O-N 3.02Å; V54-Y59 HydrophobicContact CB-CD2 4.33Å; V54-Y59 HydrophobicContact CB-CE2 4.17Å; V54-Y59 HydrophobicContact CG2-CD2 4.25Å; V54-L64 HydrophobicContact CG2-CD1 3.84Å; V54-L64 HydrophobicContact CG2-CD2 4.27Å; V54-C77 VanDerWaalsContact CG2-SG 3.53Å; V54-I84 HydrophobicContact CB-CD1 4.42Å; V54-I84 HydrophobicContact CG1-CD1 4.34Å; V54-I84 HydrophobicContact CG2-CD1 4.41Å
55	L	76.7	Confident	81.1	Confident	126 Å²	126	72.1 Å²	72.1	66%	0.66	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	-110.8	-169.5	-54.4	169.7	0	0	0	110.1	K53	K53-L55 WeakPolarHBondContact CE-O 3.02Å
56	D	78.9	Confident	81.3	Confident	150 Å²	150	68.9 Å²	68.9	80%	0.802	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.1	6.2	179.8	-62.8	-47.6	0	0	0	113.3	V54	V54-D56 PolarHBondContact O-N 3.21Å; V54-D56 VanDerWaalsContact O-N 3.13Å
57	Q	81.6	Confident	81.5	Confident	68 Å²	68	74.7 Å²	74.7	32%	0.318	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	140.4	-179.4	-71.1	177.8	-19.1	0	0	111.3	A40 V54 Y59	A40-Q57 HydrophobicContact CB-CB 3.78Å; A40-Q57 HydrophobicContact CB-CG 3.87Å; V54-Q57 PolarHBondContact N-O 2.91Å; V54-Q57 PolarHBondContact O-N 3.02Å; Q57-Y59 HydrophobicContact CB-CD2 4.39Å; Q57-Y59 HydrophobicContact CB-CE2 3.52Å; Q57-Y59 PolarHBondContact OE1-OH 3.28Å
58	S	84.2	Confident	81.7	Confident	18 Å²	18	69.5 Å²	69.5	13%	0.126	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	143	177.5	-52.5	0	0	0	0	110.4	P37 C39 A40 I46	P37-S58 WeakPolarHBondContact CB-OG 3.39Å; C39-S58 CarbonylContact C-O 3.54Å; C39-S58 VanDerWaalsContact CA-O 3.26Å; C39-S58 WeakPolarHBondContact CA-O 3.26Å; A40-S58 PolarHBondContact N-O 3.2Å; I46-S58 VanDerWaalsContact CD1-CB 3.47Å
59	Y	83.6	Confident	82.2	Confident	12 Å²	12	68.8 Å²	68.8	5%	0.047	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	143	-179.2	-64.7	-92.8	0	0	0	111.1	A40 K41 F52 V54 Q57 L64 I84	A40-Y59 HydrophobicContact CB-CE1 3.92Å; A40-Y59 HydrophobicContact CB-CE2 4.31Å; K41-Y59 HydrophobicContact CB-CD1 4.1Å; K41-Y59 HydrophobicContact CB-CE1 4.09Å; F52-Y59 PolarHBondContact N-O 2.68Å; F52-Y59 VanDerWaalsContact N-O 3.16Å; F52-Y59 PolarHBondContact O-N 3.34Å; V54-Y59 HydrophobicContact CB-CD2 4.33Å; V54-Y59 HydrophobicContact CB-CE2 4.17Å; V54-Y59 HydrophobicContact CG2-CD2 4.25Å; Q57-Y59 HydrophobicContact CB-CD2 4.39Å; Q57-Y59 HydrophobicContact CB-CE2 3.52Å; Q57-Y59 PolarHBondContact OE1-OH 3.28Å; Y59-L64 HydrophobicContact CD2-CD1 4.28Å; Y59-L64 HydrophobicContact CG-CD1 4.2Å; Y59-I84 HydrophobicContact CD1-CD1 4.37Å; Y59-I84 HydrophobicContact CD2-CD1 4.05Å; Y59-I84 HydrophobicContact CE1-CD1 3.81Å; Y59-I84 HydrophobicContact CE2-CD1 3.47Å; Y59-I84 VanDerWaalsContact CE2-CD1 3.47Å; Y59-I84 HydrophobicContact CG-CD1 4.47Å; Y59-I84 WeakPolarHBondContact OH-CD1 3.49Å
60	H	82.4	Confident	82.4	Confident	25 Å²	25	68.6 Å²	68.6	12%	0.116	33%	0.333	C	S	.	.			trans	-60.8	151.7	162.5	-60.6	114.1	0	0	0	110.2	C39 C42 I46 D48 Q62 C63 L64	C39-H60 WeakPolarHBondContact CB-ND1 3.45Å; C42-H60 PolarHBondContact SG-CE1 3.13Å; C42-H60 PolarHBondContact SG-ND1 2.88Å; I46-H60 WeakPolarHBondContact CA-NE2 3.44Å; D48-H60 IonicContact OD2-CD2 3.4Å; D48-H60 PolarHBondContact OD2-CD2 3.08Å; H60-Q62 PolarHBondContact O-N 2.86Å; H60-C63 HydrophobicContact CB-CB 3.76Å; H60-C63 PolarHBondContact O-N 2.86Å; H60-L64 PolarHBondContact O-N 3.34Å
61	S	83.2	Confident	82.8	Confident	50 Å²	50	69.1 Å²	69.1	35%	0.35	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-42.5	173	58.3	0	0	0	0	112.5
62	Q	82	Confident	83	Confident	131 Å²	131	71.1 Å²	71.1	61%	0.612	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-22	178.3	-57.6	178.9	12.4	0	0	113.2	H60 R65	H60-Q62 PolarHBondContact O-N 2.86Å; Q62-R65 WeakPolarHBondContact O-CD 3.45Å; Q62-R65 WeakPolarHBondContact O-CG 3.45Å; Q62-R65 PolarHBondContact O-NE 3.15Å; Q62-R65 VanDerWaalsContact O-NE 3.08Å
63	C	83.7	Confident	83.2	Confident	21 Å²	21	69.3 Å²	69.3	14%	0.142	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-30.6	179.6	-78.4	0	0	0	0	111.9	C39 K41 C42 H60 R65	C39-C63 VanDerWaalsContact SG-CB 3.59Å; K41-C63 HydrophobicContact CB-CB 4.21Å; K41-C63 HydrophobicContact CD-CB 3.91Å; K41-C63 WeakPolarHBondContact CD-O 3.37Å; K41-C63 PolarHBondContact NZ-O 3.18Å; C42-C63 VanDerWaalsContact SG-SG 3.69Å; H60-C63 HydrophobicContact CB-CB 3.76Å; H60-C63 PolarHBondContact O-N 2.86Å; C63-R65 PolarHBondContact O-N 2.89Å
64	L	83.5	Confident	82.8	Confident	1 Å²	1	69.7 Å²	69.7	1%	0.005	34%	0.342	C	S	.	.			trans	-72	76.8	179	-169.9	64.9	0	0	0	111.7	F52 V54 Y59 H60 L73 I84	F52-L64 HydrophobicContact CB-CD2 3.82Å; F52-L64 HydrophobicContact CD1-CD2 3.84Å; F52-L64 HydrophobicContact CG-CD2 3.87Å; V54-L64 HydrophobicContact CG2-CD1 3.84Å; V54-L64 HydrophobicContact CG2-CD2 4.27Å; Y59-L64 HydrophobicContact CD2-CD1 4.28Å; Y59-L64 HydrophobicContact CG-CD1 4.2Å; H60-L64 PolarHBondContact O-N 3.34Å; L64-L73 HydrophobicContact CD2-CB 4.46Å; L64-L73 VanDerWaalsContact CD2-O 3.26Å; L64-L73 WeakPolarHBondContact CD2-O 3.39Å; L64-L73 HydrophobicContact CG-CB 4.21Å; L64-L73 PolarHBondContact O-N 2.79Å; L64-I84 HydrophobicContact CD1-CD1 3.37Å; L64-I84 HydrophobicContact CD1-CG2 4.04Å
65	R	87.1	Confident	82.6	Confident	98 Å²	98	74 Å²	74	37%	0.37	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-122.2	146.4	-179.6	-70.8	176.9	178.9	175.3	5.3	110.7	Q62 C63 Y67 K70 E71 E72	Q62-R65 WeakPolarHBondContact O-CD 3.45Å; Q62-R65 WeakPolarHBondContact O-CG 3.45Å; Q62-R65 PolarHBondContact O-NE 3.15Å; Q62-R65 VanDerWaalsContact O-NE 3.08Å; C63-R65 PolarHBondContact O-N 2.89Å; R65-Y67 PolarHBondContact O-N 2.93Å; R65-K70 WeakPolarHBondContact CD-O 3.1Å; R65-E71 CarbonylContact C-O 3.6Å; R65-E71 WeakPolarHBondContact CA-O 3.19Å; R65-E72 HydrophobicContact CG-CB 4.45Å; R65-E72 HydrophobicContact CG-CG 3.73Å; R65-E72 IonicContact CZ-OE1 2.8Å; R65-E72 IonicContact NE-OE1 2.79Å; R65-E72 PolarHBondContact NE-OE1 3.14Å; R65-E72 IonicContact NH2-OE1 3.2Å; R65-E72 PolarHBondContact NH2-OE1 3.03Å
66	C	88.3	Confident	82.6	Confident	1 Å²	1	72 Å²	72	1%	0.007	35%	0.351	C	S	.	.			trans	-59.6	130.9	174.1	179.6	0	0	0	0	110.9	S68 C69 K70 E71 L73 I84 C86 D89	C66-S68 PolarHBondContact O-N 2.98Å; C66-S68 PolarHBondContact SG-N 2.92Å; C66-C69 WeakPolarHBondContact CB-SG 3.26Å; C66-K70 WeakPolarHBondContact O-CA 3.38Å; C66-K70 PolarHBondContact O-N 3.28Å; C66-E71 PolarHBondContact N-O 2.98Å; C66-L73 HydrophobicContact CB-CD1 4.42Å; C66-I84 CarbonylContact C-O 3.59Å; C66-C86 HydrophobicContact CB-CB 3.93Å; C66-C86 PolarHBondContact SG-N 3.3Å; C66-D89 PolarHBondContact SG-OD2 2.65Å
67	Y	87	Confident	82.8	Confident	127 Å²	127	66 Å²	66	50%	0.498	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-26.2	177.2	-174.8	-95.1	0	0	0	113	R65 R83 I84 Y85	R65-Y67 PolarHBondContact O-N 2.93Å; Y67-R83 HydrophobicContact CD2-CG 4.29Å; Y67-R83 HydrophobicContact CG-CB 4.47Å; Y67-R83 HydrophobicContact CG-CG 4.43Å; Y67-R83 PolarHBondContact OH-NH2 2.93Å; Y67-I84 WeakPolarHBondContact CB-O 3.33Å; Y67-I84 PolarHBondContact N-O 2.79Å; Y67-Y85 HydrophobicContact CD1-CE1 4.32Å
68	S	85	Confident	82.9	Confident	39 Å²	39	64.1 Å²	64.1	27%	0.273	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-55.1	-176.8	-56.4	0	0	0	0	113	C66 D89 K93	C66-S68 PolarHBondContact O-N 2.98Å; C66-S68 PolarHBondContact SG-N 2.92Å; S68-D89 VanDerWaalsContact CB-OD2 3.25Å; S68-D89 WeakPolarHBondContact CB-OD2 3.42Å; S68-K93 PolarHBondContact OG-NZ 3.4Å
69	C	87	Confident	82.8	Confident	49 Å²	49	65.2 Å²	65.2	33%	0.331	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-11.1	178.4	66.8	0	0	0	0	115.5	C66 E71 D89	C66-C69 WeakPolarHBondContact CB-SG 3.26Å; C69-E71 HydrophobicContact CB-CG 4.21Å; C69-E71 PolarHBondContact O-N 3.33Å; C69-E71 VanDerWaalsContact O-N 3.14Å; C69-E71 PolarHBondContact SG-OE2 2.79Å; C69-E71 VanDerWaalsContact SG-OE2 3.32Å; C69-D89 WeakPolarHBondContact CB-OD2 3.41Å; C69-D89 PolarHBondContact N-OD2 3.41Å; C69-D89 PolarHBondContact SG-OD2 2.8Å; C69-D89 VanDerWaalsContact SG-OD2 3.39Å
70	K	85.1	Confident	82.7	Confident	163 Å²	163	68.3 Å²	68.3	71%	0.709	33%	0.332	S	S	*	.			trans	60.9	8.9	-174.5	-56.1	-177.9	-178.9	-177.6	0	115.8	R65 C66	R65-K70 WeakPolarHBondContact CD-O 3.1Å; C66-K70 WeakPolarHBondContact O-CA 3.38Å; C66-K70 PolarHBondContact O-N 3.28Å
71	E	84.2	Confident	82.6	Confident	118 Å²	118	73.8 Å²	73.8	55%	0.551	36%	0.358	S	S	*	.			trans	-69	144.4	174.5	-65.7	175	156.4	0	0	111.7	R65 C66 C69	R65-E71 CarbonylContact C-O 3.6Å; R65-E71 WeakPolarHBondContact CA-O 3.19Å; C66-E71 PolarHBondContact N-O 2.98Å; C69-E71 HydrophobicContact CB-CG 4.21Å; C69-E71 PolarHBondContact O-N 3.33Å; C69-E71 VanDerWaalsContact O-N 3.14Å; C69-E71 PolarHBondContact SG-OE2 2.79Å; C69-E71 VanDerWaalsContact SG-OE2 3.32Å
72	E	83.8	Confident	82.4	Confident	90 Å²	90	75.8 Å²	75.8	42%	0.421	37%	0.372	S	S	.	.	B	Isolated β-bridge	trans	-71.1	125.5	175.6	-66.9	179.3	173	0	0	110.6	R65	R65-E72 HydrophobicContact CG-CB 4.45Å; R65-E72 HydrophobicContact CG-CG 3.73Å; R65-E72 IonicContact CZ-OE1 2.8Å; R65-E72 IonicContact NE-OE1 2.79Å; R65-E72 PolarHBondContact NE-OE1 3.14Å; R65-E72 IonicContact NH2-OE1 3.2Å; R65-E72 PolarHBondContact NH2-OE1 3.03Å
73	L	82.3	Confident	82.4	Confident	17 Å²	17	74.9 Å²	74.9	9%	0.089	36%	0.362	C	S	.	.			trans	-97.5	106.4	-177.4	-57.6	172.5	0	0	0	109	L64 C66 C77 I84 C86	L64-L73 HydrophobicContact CD2-CB 4.46Å; L64-L73 VanDerWaalsContact CD2-O 3.26Å; L64-L73 WeakPolarHBondContact CD2-O 3.39Å; L64-L73 HydrophobicContact CG-CB 4.21Å; L64-L73 PolarHBondContact O-N 2.79Å; C66-L73 HydrophobicContact CB-CD1 4.42Å; L73-C77 HydrophobicContact CB-CB 4.13Å; L73-C77 HydrophobicContact CD1-CB 3.61Å; L73-C77 HydrophobicContact CG-CB 4.46Å; L73-I84 HydrophobicContact CD1-CG2 3.51Å; L73-C86 HydrophobicContact CD2-CB 3.5Å; L73-C86 VanDerWaalsContact CD2-CB 3.5Å
74	Q	72.3	Confident	82.4	Confident	146 Å²	146	74.4 Å²	74.4	68%	0.682	36%	0.358	S	S	*	.	S	Bend	trans	-97.1	-33.2	-177.1	-64.2	-179.7	-10.9	0	0	113.5
75	D	72.9	Confident	82.5	Confident	105 Å²	105	74.7 Å²	74.7	56%	0.561	36%	0.359	S	S	*	.	S	Bend	trans	-112.1	-46.7	-170	-178.5	39.5	0	0	0	114.1	C23	C23-D75 PolarHBondContact SG-O 3.4Å
76	K	77.7	Confident	82.4	Confident	83 Å²	83	70.4 Å²	70.4	36%	0.361	34%	0.344	S	S	.	.			trans	-141.6	127.7	-179.4	-60.8	-177	-171.2	-170.7	0	111
77	C	82.8	Confident	82.1	Confident	23 Å²	23	73.4 Å²	73.4	16%	0.155	36%	0.358	C	S	.	.			trans	-125.4	152.6	175.3	63.2	0	0	0	0	110.6	V54 L73 I84	V54-C77 VanDerWaalsContact CG2-SG 3.53Å; L73-C77 HydrophobicContact CB-CB 4.13Å; L73-C77 HydrophobicContact CD1-CB 3.61Å; L73-C77 HydrophobicContact CG-CB 4.46Å; C77-I84 HydrophobicContact CB-CG2 3.65Å
78	Y	82.3	Confident	81.7	Confident	29 Å²	29	72.2 Å²	72.2	11%	0.114	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	116.7	179	-65.1	-100.9	0	0	0	108.8	Y85 K87 F90 F91	Y78-Y85 PolarHBondContact N-O 3.2Å; Y78-Y85 PolarHBondContact O-N 3.05Å; Y78-K87 HydrophobicContact CD2-CB 4.33Å; Y78-K87 VanDerWaalsContact CE2-CA 3.47Å; Y78-K87 HydrophobicContact CE2-CB 3.68Å; Y78-K87 HydrophobicContact CE2-CG 3.76Å; Y78-F90 VanDerWaalsContact CB-CD2 3.42Å; Y78-F90 VanDerWaalsContact CB-CG 3.42Å; Y78-F90 AromaticContact CD1-CD1 3.59Å; Y78-F90 HydrophobicContact CD1-CD1 3.59Å; Y78-F90 HydrophobicContact CD1-CD2 4.49Å; Y78-F90 AromaticContact CD1-CE1 3.85Å; Y78-F90 HydrophobicContact CD1-CE1 3.85Å; Y78-F90 AromaticContact CD1-CG 3.94Å; Y78-F90 HydrophobicContact CD1-CG 3.94Å; Y78-F90 HydrophobicContact CD1-CZ 4.39Å; Y78-F90 HydrophobicContact CD2-CB 4.28Å; Y78-F90 HydrophobicContact CE1-CD1 4.28Å; Y78-F90 HydrophobicContact CG-CB 3.92Å; Y78-F90 AromaticContact CG-CD1 3.88Å; Y78-F90 HydrophobicContact CG-CD1 3.88Å; Y78-F90 HydrophobicContact CG-CD2 4.21Å; Y78-F90 HydrophobicContact CG-CE1 4.46Å; Y78-F90 AromaticContact CG-CG 3.73Å; Y78-F90 HydrophobicContact CG-CG 3.73Å; Y78-F91 HydrophobicContact CE1-CE2 4.03Å; Y78-F91 HydrophobicContact CE1-CZ 4.06Å; Y78-F91 HydrophobicContact CE2-CE2 4.44Å; Y78-F91 AromaticContact CZ-CE2 3.83Å
79	S	83.6	Confident	81.6	Confident	41 Å²	41	70.6 Å²	70.6	29%	0.287	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	132.4	177.9	-176.4	0	0	0	0	110.7	R83	S79-R83 WeakPolarHBondContact CA-O 3.29Å
80	K	81.2	Confident	81.5	Confident	77 Å²	77	69.5 Å²	69.5	34%	0.335	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	132.2	169.7	-177.9	169.3	179.3	-176.6	0	109.6	S82 R83 Y85 F90 F94	K80-S82 VanDerWaalsContact C-N 3.29Å; K80-S82 PolarHBondContact O-N 3.39Å; K80-R83 PolarHBondContact N-O 3.39Å; K80-R83 PolarHBondContact O-N 3.32Å; K80-Y85 HydrophobicContact CB-CE2 4.44Å; K80-F90 HydrophobicContact CB-CE2 4.01Å; K80-F90 HydrophobicContact CD-CE2 4.3Å; K80-F94 HydrophobicContact CB-CE2 4.39Å; K80-F94 HydrophobicContact CD-CD1 3.81Å; K80-F94 HydrophobicContact CD-CD2 3.89Å; K80-F94 HydrophobicContact CD-CE1 3.73Å; K80-F94 HydrophobicContact CD-CE2 3.84Å; K80-F94 HydrophobicContact CD-CG 3.86Å; K80-F94 HydrophobicContact CD-CZ 3.74Å; K80-F94 HydrophobicContact CG-CE2 4.48Å; K80-F94 HydrophobicContact CG-CZ 4.36Å
81	E	80.5	Confident	81.3	Confident	141 Å²	141	63 Å²	63	66%	0.659	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	45.3	-179.4	-63.7	160.8	-153	0	0	112.5	R83	E81-R83 PolarHBondContact O-N 2.98Å
82	S	77.3	Confident	81	Confident	92 Å²	92	62.9 Å²	62.9	64%	0.643	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	15	-177.6	-51.2	0	0	0	0	115	K80	K80-S82 VanDerWaalsContact C-N 3.29Å; K80-S82 PolarHBondContact O-N 3.39Å
83	R	83.4	Confident	80.7	Confident	111 Å²	111	63 Å²	63	42%	0.419	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	138.4	174.2	-66.6	179.3	178	174.4	0	110.7	Y67 S79 K80 E81 Y85	Y67-R83 HydrophobicContact CD2-CG 4.29Å; Y67-R83 HydrophobicContact CG-CB 4.47Å; Y67-R83 HydrophobicContact CG-CG 4.43Å; Y67-R83 PolarHBondContact OH-NH2 2.93Å; S79-R83 WeakPolarHBondContact CA-O 3.29Å; K80-R83 PolarHBondContact N-O 3.39Å; K80-R83 PolarHBondContact O-N 3.32Å; E81-R83 PolarHBondContact O-N 2.98Å; R83-Y85 HydrophobicContact CB-CE2 3.67Å; R83-Y85 WeakPolarHBondContact O-CD2 3.25Å; R83-Y85 WeakPolarHBondContact O-CE2 3.34Å
84	I	83.8	Confident	80.7	Confident	11 Å²	11	65.7 Å²	65.7	6%	0.056	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	132	-179.7	-56.2	-173.6	0	0	0	109.8	V54 Y59 L64 C66 Y67 L73 C77	V54-I84 HydrophobicContact CB-CD1 4.42Å; V54-I84 HydrophobicContact CG1-CD1 4.34Å; V54-I84 HydrophobicContact CG2-CD1 4.41Å; Y59-I84 HydrophobicContact CD1-CD1 4.37Å; Y59-I84 HydrophobicContact CD2-CD1 4.05Å; Y59-I84 HydrophobicContact CE1-CD1 3.81Å; Y59-I84 HydrophobicContact CE2-CD1 3.47Å; Y59-I84 VanDerWaalsContact CE2-CD1 3.47Å; Y59-I84 HydrophobicContact CG-CD1 4.47Å; Y59-I84 WeakPolarHBondContact OH-CD1 3.49Å; L64-I84 HydrophobicContact CD1-CD1 3.37Å; L64-I84 HydrophobicContact CD1-CG2 4.04Å; C66-I84 CarbonylContact C-O 3.59Å; Y67-I84 WeakPolarHBondContact CB-O 3.33Å; Y67-I84 PolarHBondContact N-O 2.79Å; L73-I84 HydrophobicContact CD1-CG2 3.51Å; C77-I84 HydrophobicContact CB-CG2 3.65Å
85	Y	85.5	Confident	81.1	Confident	7 Å²	7	59.7 Å²	59.7	3%	0.027	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	149.6	179.7	-59.5	-87.9	0	0	0	110.6	Y67 Y78 K80 R83 D89 F90 K93 F94	Y67-Y85 HydrophobicContact CD1-CE1 4.32Å; Y78-Y85 PolarHBondContact N-O 3.2Å; Y78-Y85 PolarHBondContact O-N 3.05Å; K80-Y85 HydrophobicContact CB-CE2 4.44Å; R83-Y85 HydrophobicContact CB-CE2 3.67Å; R83-Y85 WeakPolarHBondContact O-CD2 3.25Å; R83-Y85 WeakPolarHBondContact O-CE2 3.34Å; Y85-D89 HydrophobicContact CD1-CB 4.44Å; Y85-F90 HydrophobicContact CD2-CD2 4.34Å; Y85-K93 HydrophobicContact CE1-CD 4.09Å; Y85-F94 HydrophobicContact CD2-CE2 4.14Å; Y85-F94 HydrophobicContact CE1-CE2 4.45Å; Y85-F94 AromaticContact CE2-CE2 3.76Å; Y85-F94 HydrophobicContact CE2-CE2 3.76Å; Y85-F94 HydrophobicContact CE2-CZ 4.33Å; Y85-F94 AromaticContact CZ-CE2 3.92Å
86	C	85.2	Confident	81.6	Confident	8 Å²	8	57.6 Å²	57.6	5%	0.054	28%	0.282	C	S	.	.			trans	-67.7	161.4	165.1	77.6	0	0	0	0	109.5	C66 L73 N88 D89 F90	C66-C86 HydrophobicContact CB-CB 3.93Å; C66-C86 PolarHBondContact SG-N 3.3Å; L73-C86 HydrophobicContact CD2-CB 3.5Å; L73-C86 VanDerWaalsContact CD2-CB 3.5Å; C86-N88 VanDerWaalsContact C-N 3.26Å; C86-N88 PolarHBondContact O-N 2.86Å; C86-D89 PolarHBondContact O-N 3.1Å; C86-D89 VanDerWaalsContact SG-CB 3.55Å; C86-D89 PolarHBondContact SG-N 3.46Å; C86-D89 PolarHBondContact SG-OD2 3.44Å; C86-D89 VanDerWaalsContact SG-OD2 3.4Å; C86-F90 WeakPolarHBondContact O-CB 3.41Å; C86-F90 PolarHBondContact O-N 3.11Å
87	K	81.1	Confident	82	Confident	65 Å²	65	58.9 Å²	58.9	28%	0.283	29%	0.288	S	S	.	.	H	α-helix	trans	-47.1	-52.7	175.7	-170	-178.2	178.7	-174.3	0	111.1	Y78 F90 F91	Y78-K87 HydrophobicContact CD2-CB 4.33Å; Y78-K87 VanDerWaalsContact CE2-CA 3.47Å; Y78-K87 HydrophobicContact CE2-CB 3.68Å; Y78-K87 HydrophobicContact CE2-CG 3.76Å; K87-F90 PolarHBondContact O-N 3.43Å; K87-F91 HydrophobicContact CG-CD2 3.81Å; K87-F91 HydrophobicContact CG-CE2 3.66Å; K87-F91 WeakPolarHBondContact O-CD2 2.98Å; K87-F91 PolarHBondContact O-N 3.12Å; K87-F91 VanDerWaalsContact O-N 3.1Å
88	N	79.7	Confident	82.3	Confident	102 Å²	102	57.8 Å²	57.8	55%	0.545	28%	0.281	S	S	.	.	H	α-helix	trans	-64.7	-45.7	-174.4	-62.5	-26.2	0	0	0	112.5	C86 F91 R92	C86-N88 VanDerWaalsContact C-N 3.26Å; C86-N88 PolarHBondContact O-N 2.86Å; N88-F91 PolarHBondContact O-N 2.83Å; N88-R92 VanDerWaalsContact O-CB 3.25Å; N88-R92 WeakPolarHBondContact O-CB 3.33Å; N88-R92 PolarHBondContact O-N 3.44Å
89	D	82.8	Confident	82.6	Confident	4 Å²	4	57.9 Å²	57.9	2%	0.021	29%	0.287	C	S	.	.	H	α-helix	trans	-70.6	-35.8	-178.2	-71	-24.2	0	0	0	112.1	C66 S68 C69 Y85 C86 R92 K93	C66-D89 PolarHBondContact SG-OD2 2.65Å; S68-D89 VanDerWaalsContact CB-OD2 3.25Å; S68-D89 WeakPolarHBondContact CB-OD2 3.42Å; C69-D89 WeakPolarHBondContact CB-OD2 3.41Å; C69-D89 PolarHBondContact N-OD2 3.41Å; C69-D89 PolarHBondContact SG-OD2 2.8Å; C69-D89 VanDerWaalsContact SG-OD2 3.39Å; Y85-D89 HydrophobicContact CD1-CB 4.44Å; C86-D89 PolarHBondContact O-N 3.1Å; C86-D89 VanDerWaalsContact SG-CB 3.55Å; C86-D89 PolarHBondContact SG-N 3.46Å; C86-D89 PolarHBondContact SG-OD2 3.44Å; C86-D89 VanDerWaalsContact SG-OD2 3.4Å; D89-R92 PolarHBondContact O-N 2.93Å; D89-R92 IonicContact OD1-CZ 3.89Å; D89-R92 IonicContact OD1-NH1 2.79Å; D89-R92 PolarHBondContact OD1-NH1 3.08Å; D89-R92 IonicContact OD1-NH2 3.38Å; D89-R92 PolarHBondContact OD1-NH2 2.8Å; D89-K93 WeakPolarHBondContact O-CB 3.25Å; D89-K93 PolarHBondContact O-N 3.25Å
90	F	84.9	Confident	82.7	Confident	26 Å²	26	58.8 Å²	58.8	11%	0.114	30%	0.297	C	S	.	.	H	α-helix	trans	-60.3	-50.4	173.7	-175.4	-97.8	0	0	0	110.7	Y78 K80 Y85 C86 K87 K93 F94	Y78-F90 VanDerWaalsContact CB-CD2 3.42Å; Y78-F90 VanDerWaalsContact CB-CG 3.42Å; Y78-F90 AromaticContact CD1-CD1 3.59Å; Y78-F90 HydrophobicContact CD1-CD1 3.59Å; Y78-F90 HydrophobicContact CD1-CD2 4.49Å; Y78-F90 AromaticContact CD1-CE1 3.85Å; Y78-F90 HydrophobicContact CD1-CE1 3.85Å; Y78-F90 AromaticContact CD1-CG 3.94Å; Y78-F90 HydrophobicContact CD1-CG 3.94Å; Y78-F90 HydrophobicContact CD1-CZ 4.39Å; Y78-F90 HydrophobicContact CD2-CB 4.28Å; Y78-F90 HydrophobicContact CE1-CD1 4.28Å; Y78-F90 HydrophobicContact CG-CB 3.92Å; Y78-F90 AromaticContact CG-CD1 3.88Å; Y78-F90 HydrophobicContact CG-CD1 3.88Å; Y78-F90 HydrophobicContact CG-CD2 4.21Å; Y78-F90 HydrophobicContact CG-CE1 4.46Å; Y78-F90 AromaticContact CG-CG 3.73Å; Y78-F90 HydrophobicContact CG-CG 3.73Å; K80-F90 HydrophobicContact CB-CE2 4.01Å; K80-F90 HydrophobicContact CD-CE2 4.3Å; Y85-F90 HydrophobicContact CD2-CD2 4.34Å; C86-F90 WeakPolarHBondContact O-CB 3.41Å; C86-F90 PolarHBondContact O-N 3.11Å; K87-F90 PolarHBondContact O-N 3.43Å; F90-K93 PolarHBondContact O-N 2.9Å; F90-F94 AromaticContact CD2-CD2 3.74Å; F90-F94 HydrophobicContact CD2-CD2 3.74Å; F90-F94 HydrophobicContact CD2-CE2 4.36Å; F90-F94 AromaticContact CE2-CD2 3.9Å; F90-F94 HydrophobicContact CE2-CD2 3.9Å; F90-F94 HydrophobicContact CG-CD2 4.39Å; F90-F94 WeakPolarHBondContact O-CA 3.32Å; F90-F94 WeakPolarHBondContact O-CB 3.41Å; F90-F94 PolarHBondContact O-N 2.85Å
91	F	80.6	Confident	83.1	Confident	26 Å²	26	57.6 Å²	57.6	11%	0.114	30%	0.298	C	S	.	.	H	α-helix	trans	-69.4	-32.1	177.9	-72.1	-68	0	0	0	112.7	I18 Y78 K87 N88 G95 P107	I18-F91 HydrophobicContact CD1-CE1 4.17Å; Y78-F91 HydrophobicContact CE1-CE2 4.03Å; Y78-F91 HydrophobicContact CE1-CZ 4.06Å; Y78-F91 HydrophobicContact CE2-CE2 4.44Å; Y78-F91 AromaticContact CZ-CE2 3.83Å; K87-F91 HydrophobicContact CG-CD2 3.81Å; K87-F91 HydrophobicContact CG-CE2 3.66Å; K87-F91 WeakPolarHBondContact O-CD2 2.98Å; K87-F91 PolarHBondContact O-N 3.12Å; K87-F91 VanDerWaalsContact O-N 3.1Å; N88-F91 PolarHBondContact O-N 2.83Å; F91-G95 CarbonylContact O-C 3.58Å; F91-G95 WeakPolarHBondContact O-CA 3.48Å; F91-G95 PolarHBondContact O-N 3.24Å; F91-P107 HydrophobicContact CB-CG 4.4Å; F91-P107 HydrophobicContact CD1-CG 3.53Å; F91-P107 HydrophobicContact CD2-CG 3.39Å; F91-P107 HydrophobicContact CE1-CB 4.4Å; F91-P107 HydrophobicContact CE1-CG 3.5Å; F91-P107 VanDerWaalsContact CE1-CG 3.5Å; F91-P107 HydrophobicContact CE2-CG 3.44Å; F91-P107 VanDerWaalsContact CE2-CG 3.44Å; F91-P107 HydrophobicContact CG-CG 3.49Å; F91-P107 VanDerWaalsContact CG-CG 3.49Å; F91-P107 HydrophobicContact CZ-CB 4.33Å; F91-P107 HydrophobicContact CZ-CG 3.49Å; F91-P107 VanDerWaalsContact CZ-CG 3.49Å
92	R	78.2	Confident	83.2	Confident	117 Å²	117	58.7 Å²	58.7	44%	0.442	30%	0.301	S	S	.	.	H	α-helix	trans	-68.1	-39.3	175.9	-168.4	172.2	70.6	-128.5	-6.1	112.3	N88 D89 K97	N88-R92 VanDerWaalsContact O-CB 3.25Å; N88-R92 WeakPolarHBondContact O-CB 3.33Å; N88-R92 PolarHBondContact O-N 3.44Å; D89-R92 PolarHBondContact O-N 2.93Å; D89-R92 IonicContact OD1-CZ 3.89Å; D89-R92 IonicContact OD1-NH1 2.79Å; D89-R92 PolarHBondContact OD1-NH1 3.08Å; D89-R92 IonicContact OD1-NH2 3.38Å; D89-R92 PolarHBondContact OD1-NH2 2.8Å; R92-K97 WeakPolarHBondContact O-CE 3.1Å
93	K	77.2	Confident	83.5	Confident	93 Å²	93	59.6 Å²	59.6	40%	0.404	30%	0.295	S	S	.	.	H	α-helix	trans	-83.5	-45	-179.5	-75.7	-175.3	168.8	178.5	0	113	S68 Y85 D89 F90	S68-K93 PolarHBondContact OG-NZ 3.4Å; Y85-K93 HydrophobicContact CE1-CD 4.09Å; D89-K93 WeakPolarHBondContact O-CB 3.25Å; D89-K93 PolarHBondContact O-N 3.25Å; F90-K93 PolarHBondContact O-N 2.9Å
94	F	81.7	Confident	83.5	Confident	73 Å²	73	55.2 Å²	55.2	32%	0.32	29%	0.285	S	S	.	.	H	α-helix	trans	-115.9	-8.9	-169.4	-53.9	-65.8	0	0	0	114.3	K80 Y85 F90	K80-F94 HydrophobicContact CB-CE2 4.39Å; K80-F94 HydrophobicContact CD-CD1 3.81Å; K80-F94 HydrophobicContact CD-CD2 3.89Å; K80-F94 HydrophobicContact CD-CE1 3.73Å; K80-F94 HydrophobicContact CD-CE2 3.84Å; K80-F94 HydrophobicContact CD-CG 3.86Å; K80-F94 HydrophobicContact CD-CZ 3.74Å; K80-F94 HydrophobicContact CG-CE2 4.48Å; K80-F94 HydrophobicContact CG-CZ 4.36Å; Y85-F94 HydrophobicContact CD2-CE2 4.14Å; Y85-F94 HydrophobicContact CE1-CE2 4.45Å; Y85-F94 AromaticContact CE2-CE2 3.76Å; Y85-F94 HydrophobicContact CE2-CE2 3.76Å; Y85-F94 HydrophobicContact CE2-CZ 4.33Å; Y85-F94 AromaticContact CZ-CE2 3.92Å; F90-F94 AromaticContact CD2-CD2 3.74Å; F90-F94 HydrophobicContact CD2-CD2 3.74Å; F90-F94 HydrophobicContact CD2-CE2 4.36Å; F90-F94 AromaticContact CE2-CD2 3.9Å; F90-F94 HydrophobicContact CE2-CD2 3.9Å; F90-F94 HydrophobicContact CG-CD2 4.39Å; F90-F94 WeakPolarHBondContact O-CA 3.32Å; F90-F94 WeakPolarHBondContact O-CB 3.41Å; F90-F94 PolarHBondContact O-N 2.85Å
95	G	80	Confident	83.4	Confident	20 Å²	20	55.5 Å²	55.5	21%	0.206	29%	0.286	C	S	.	.	S	Bend	trans	-83.7	-179.9	176.1	0	0	0	0	0	113.1	F91 K97	F91-G95 CarbonylContact O-C 3.58Å; F91-G95 WeakPolarHBondContact O-CA 3.48Å; F91-G95 PolarHBondContact O-N 3.24Å; G95-K97 PolarHBondContact O-N 2.91Å
96	T	85.1	Confident	83.2	Confident	60 Å²	60	59.1 Å²	59.1	37%	0.368	31%	0.308	S	S	.	.			trans	-63.2	129.1	177.5	-50.3	0	0	0	0	110.5	I105 V118	T96-I105 HydrophobicContact CG2-CD1 4.2Å; T96-I105 WeakPolarHBondContact O-CB 3.05Å; T96-I105 PolarHBondContact O-N 3.31Å; T96-V118 HydrophobicContact CG2-CB 3.76Å; T96-V118 HydrophobicContact CG2-CG1 4.22Å; T96-V118 HydrophobicContact CG2-CG2 3.7Å
97	K	86.1	Confident	82.4	Confident	110 Å²	110	61.7 Å²	61.7	48%	0.478	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-104.1	145.6	178.5	-58.8	-175.7	-175.2	-173.4	0	110.5	R92 G95 A99 E103	R92-K97 WeakPolarHBondContact O-CE 3.1Å; G95-K97 PolarHBondContact O-N 2.91Å; K97-A99 PolarHBondContact O-N 2.93Å; K97-E103 WeakPolarHBondContact CA-O 3.39Å
98	C	89	Confident	82.2	Confident	1 Å²	1	68.8 Å²	68.8	1%	0.007	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-68.9	125.3	173.3	175.9	0	0	0	0	109.9	A100 C101 K102 E103 I105 V118 H120	C98-A100 PolarHBondContact O-N 3.29Å; C98-C101 VanDerWaalsContact CB-SG 3.53Å; C98-C101 VanDerWaalsContact SG-SG 3.65Å; C98-K102 WeakPolarHBondContact O-CA 3.13Å; C98-K102 PolarHBondContact O-N 2.91Å; C98-E103 PolarHBondContact N-O 3.23Å; C98-I105 HydrophobicContact CB-CD1 4.24Å; C98-I105 HydrophobicContact CB-CG1 4.22Å; C98-V118 CarbonylContact C-O 3.52Å; C98-V118 VanDerWaalsContact CA-O 3.26Å; C98-V118 WeakPolarHBondContact CA-O 3.48Å; C98-H120 VanDerWaalsContact CB-CE1 3.48Å; C98-H120 WeakPolarHBondContact CB-CE1 3.26Å; C98-H120 WeakPolarHBondContact CB-ND1 3.46Å
99	A	87.6	Confident	82.3	Confident	30 Å²	30	66.2 Å²	66.2	25%	0.248	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-23.8	-179.2	0	0	0	0	0	113.7	K97 H117 V118 Y119	K97-A99 PolarHBondContact O-N 2.93Å; A99-H117 HydrophobicContact CB-CB 3.83Å; A99-V118 PolarHBondContact N-O 3.48Å; A99-Y119 HydrophobicContact CB-CD1 4.23Å; A99-Y119 HydrophobicContact CB-CE1 3.55Å; A99-Y119 HydrophobicContact CB-CE2 4.45Å
100	A	87	Confident	82.5	Confident	60 Å²	60	71.2 Å²	71.2	50%	0.496	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-53.6	178.2	0	0	0	0	0	113.7	C98 Y119 C123	C98-A100 PolarHBondContact O-N 3.29Å; A100-Y119 HydrophobicContact CB-CD1 3.82Å; A100-Y119 HydrophobicContact CB-CE1 4.15Å; A100-C123 HydrophobicContact CB-CB 3.93Å
101	C	87.8	Confident	82.7	Confident	53 Å²	53	72 Å²	72	36%	0.358	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-8.5	-177.4	67.2	0	0	0	0	114.5	C98 E103 H120	C98-C101 VanDerWaalsContact CB-SG 3.53Å; C98-C101 VanDerWaalsContact SG-SG 3.65Å; C101-E103 PolarHBondContact O-N 3.02Å; C101-E103 VanDerWaalsContact O-N 3.12Å; C101-H120 PolarHBondContact SG-CE1 2.72Å; C101-H120 PolarHBondContact SG-ND1 3.02Å
102	K	84.1	Confident	83.1	Confident	164 Å²	164	73.1 Å²	73.1	71%	0.713	38%	0.381	S	S	*	.			trans	64.1	4.7	-177.7	-54.1	-178.8	-178.8	-177.4	0	115.7	C98	C98-K102 WeakPolarHBondContact O-CA 3.13Å; C98-K102 PolarHBondContact O-N 2.91Å
103	E	82.8	Confident	83.5	Confident	110 Å²	110	72 Å²	72	51%	0.514	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-77.5	152.9	174.8	-67.6	-58.2	145.8	0	0	112.5	K97 C98 C101	K97-E103 WeakPolarHBondContact CA-O 3.39Å; C98-E103 PolarHBondContact N-O 3.23Å; C101-E103 PolarHBondContact O-N 3.02Å; C101-E103 VanDerWaalsContact O-N 3.12Å
104	G	82.5	Confident	83.9	Confident	20 Å²	20	67.9 Å²	67.9	21%	0.206	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-69.7	135	178.1	0	0	0	0	0	112.2
105	I	83.6	Confident	84	Confident	16 Å²	16	69.7 Å²	69.7	8%	0.082	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-88.2	129.9	-179.9	-61.3	-178.6	0	0	0	109.6	T96 C98 S109 V111 V118	T96-I105 HydrophobicContact CG2-CD1 4.2Å; T96-I105 WeakPolarHBondContact O-CB 3.05Å; T96-I105 PolarHBondContact O-N 3.31Å; C98-I105 HydrophobicContact CB-CD1 4.24Å; C98-I105 HydrophobicContact CB-CG1 4.22Å; I105-S109 WeakPolarHBondContact CG2-OG 3.5Å; I105-V111 HydrophobicContact CD1-CG1 4.02Å; I105-V111 HydrophobicContact CG2-CG1 3.36Å; I105-V118 HydrophobicContact CD1-CB 3.89Å; I105-V118 HydrophobicContact CD1-CG1 3.39Å
106	V	79.6	Confident	84.2	Confident	83 Å²	83	74.9 Å²	74.9	50%	0.503	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-70.8	135.7	-179.1	-178.1	0	0	0	0	110.6	R108 S109	V106-R108 PolarHBondContact O-N 2.85Å; V106-S109 PolarHBondContact O-N 3.21Å; V106-S109 PolarHBondContact O-OG 3.42Å
107	P	70.2	Confident	84.2	Confident	63 Å²	63	75.3 Å²	75.3	41%	0.409	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	15.8	-176.2	-24.9	32.7	0	0	0	118.7	F91	F91-P107 HydrophobicContact CB-CG 4.4Å; F91-P107 HydrophobicContact CD1-CG 3.53Å; F91-P107 HydrophobicContact CD2-CG 3.39Å; F91-P107 HydrophobicContact CE1-CB 4.4Å; F91-P107 HydrophobicContact CE1-CG 3.5Å; F91-P107 VanDerWaalsContact CE1-CG 3.5Å; F91-P107 HydrophobicContact CE2-CG 3.44Å; F91-P107 VanDerWaalsContact CE2-CG 3.44Å; F91-P107 HydrophobicContact CG-CG 3.49Å; F91-P107 VanDerWaalsContact CG-CG 3.49Å; F91-P107 HydrophobicContact CZ-CB 4.33Å; F91-P107 HydrophobicContact CZ-CG 3.49Å; F91-P107 VanDerWaalsContact CZ-CG 3.49Å
108	R	75.8	Confident	84.4	Confident	214 Å²	214	70.9 Å²	70.9	81%	0.808	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.4	-4.1	174.6	-67.4	-172.9	173.7	124.3	-2.8	113.1	V106	V106-R108 PolarHBondContact O-N 2.85Å
109	S	82.5	Confident	84.4	Confident	48 Å²	48	70.9 Å²	70.9	34%	0.336	37%	0.374	S	S	.	.	S	Bend	trans	-72.3	138.7	179	58.6	0	0	0	0	109.6	I105 V106 V111	I105-S109 WeakPolarHBondContact CG2-OG 3.5Å; V106-S109 PolarHBondContact O-N 3.21Å; V106-S109 PolarHBondContact O-OG 3.42Å; S109-V111 PolarHBondContact O-N 3.01Å
110	V	86.6	Confident	84.5	Confident	109 Å²	109	71.4 Å²	71.4	66%	0.661	37%	0.372	S	S	*	.			trans	-65.5	134.7	168.6	-176.4	0	0	0	0	108.4	L121	V110-L121 HydrophobicContact CB-CD1 3.96Å; V110-L121 HydrophobicContact CB-CG 4.41Å; V110-L121 HydrophobicContact CG1-CD1 4.1Å; V110-L121 HydrophobicContact CG1-CD2 4.02Å; V110-L121 HydrophobicContact CG1-CG 4.3Å
111	V	89.4	Confident	84.5	Confident	41 Å²	41	72.3 Å²	72.3	25%	0.248	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	158.5	-178.1	-68.9	0	0	0	0	110.9	I105 S109 V118 Y119	I105-V111 HydrophobicContact CD1-CG1 4.02Å; I105-V111 HydrophobicContact CG2-CG1 3.36Å; S109-V111 PolarHBondContact O-N 3.01Å; V111-V118 HydrophobicContact CB-CG1 3.68Å; V111-V118 HydrophobicContact CG1-CG1 4.02Å; V111-V118 HydrophobicContact CG2-CG1 3.74Å; V111-Y119 WeakPolarHBondContact CA-O 3.02Å; V111-Y119 WeakPolarHBondContact CB-O 3.26Å
112	R	88.4	Confident	84.6	Confident	50 Å²	50	76.8 Å²	76.8	19%	0.189	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	136.2	166.3	-64.5	-161.7	171.7	133.5	-14	109.9	V118 Y119 L121 F124 M133	R112-V118 CarbonylContact O-C 3.5Å; R112-V118 WeakPolarHBondContact O-CA 3.06Å; R112-Y119 PolarHBondContact N-O 3.27Å; R112-Y119 PolarHBondContact O-N 3.31Å; R112-L121 HydrophobicContact CG-CD2 3.89Å; R112-L121 PolarHBondContact NH1-O 3.13Å; R112-F124 HydrophobicContact CB-CB 4.15Å; R112-F124 HydrophobicContact CB-CD2 3.55Å; R112-F124 HydrophobicContact CB-CE2 4.02Å; R112-F124 HydrophobicContact CB-CG 3.84Å; R112-F124 HydrophobicContact CG-CB 4.19Å; R112-F124 HydrophobicContact CG-CD1 4.45Å; R112-F124 HydrophobicContact CG-CD2 4.31Å; R112-F124 HydrophobicContact CG-CG 4.09Å; R112-M133 PolarHBondContact NH1-O 2.7Å; R112-M133 PolarHBondContact NH2-O 3.3Å
113	K	86.5	Confident	84.9	Confident	93 Å²	93	70.2 Å²	70.2	40%	0.404	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	127.8	176.5	-171.7	175.6	178.5	-177	0	109.1	H115 H117	K113-H115 WeakPolarHBondContact CE-O 3.39Å; K113-H117 WeakPolarHBondContact CA-O 3.11Å
114	A	85.7	Confident	85.2	Confident	7 Å²	7	65.1 Å²	65.1	6%	0.058	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	108.3	170.4	0	0	0	0	0	108.6	D116 H117 Y119 F124 F139 L148	A114-D116 PolarHBondContact O-N 3.01Å; A114-H117 PolarHBondContact N-O 3.46Å; A114-H117 PolarHBondContact O-N 3.29Å; A114-Y119 HydrophobicContact CB-CE2 4.01Å; A114-F124 HydrophobicContact CB-CE2 4.12Å; A114-F139 HydrophobicContact CB-CE2 3.9Å; A114-F139 HydrophobicContact CB-CZ 4.05Å; A114-L148 HydrophobicContact CB-CD2 4.22Å
115	H	83	Confident	85.7	Confident	112 Å²	112	68 Å²	68	52%	0.519	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	-119.3	-172.3	-154.9	-73.9	0	0	0	110.9	K113 L141	K113-H115 WeakPolarHBondContact CE-O 3.39Å; H115-L141 HydrophobicContact CB-CD2 4.17Å
116	D	84.5	Confident	86	Confident	129 Å²	129	67.3 Å²	67.3	69%	0.69	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-1.9	179.4	-57.3	-39	0	0	0	113.3	A114	A114-D116 PolarHBondContact O-N 3.01Å
117	H	86.5	Confident	86.4	Confident	68 Å²	68	66 Å²	66	32%	0.315	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	139.5	-177.2	-60.1	80.5	0	0	0	110.9	A99 K113 A114 Y119	A99-H117 HydrophobicContact CB-CB 3.83Å; K113-H117 WeakPolarHBondContact CA-O 3.11Å; A114-H117 PolarHBondContact N-O 3.46Å; A114-H117 PolarHBondContact O-N 3.29Å; H117-Y119 HydrophobicContact CB-CE2 3.47Å; H117-Y119 VanDerWaalsContact CB-CE2 3.47Å; H117-Y119 WeakPolarHBondContact CB-OH 3.48Å
118	V	88.9	Confident	87.2	Confident	17 Å²	17	67.1 Å²	67.1	10%	0.103	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	141.4	177.4	-170	0	0	0	0	109.3	T96 C98 A99 I105 V111 R112	T96-V118 HydrophobicContact CG2-CB 3.76Å; T96-V118 HydrophobicContact CG2-CG1 4.22Å; T96-V118 HydrophobicContact CG2-CG2 3.7Å; C98-V118 CarbonylContact C-O 3.52Å; C98-V118 VanDerWaalsContact CA-O 3.26Å; C98-V118 WeakPolarHBondContact CA-O 3.48Å; A99-V118 PolarHBondContact N-O 3.48Å; I105-V118 HydrophobicContact CD1-CB 3.89Å; I105-V118 HydrophobicContact CD1-CG1 3.39Å; V111-V118 HydrophobicContact CB-CG1 3.68Å; V111-V118 HydrophobicContact CG1-CG1 4.02Å; V111-V118 HydrophobicContact CG2-CG1 3.74Å; R112-V118 CarbonylContact O-C 3.5Å; R112-V118 WeakPolarHBondContact O-CA 3.06Å
119	Y	89.3	Confident	87.9	Confident	1 Å²	1	59.2 Å²	59.2	0%	0.004	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	146.9	-176.5	-54.8	-96.3	0	0	0	110.6	A99 A100 V111 R112 A114 H117 F124 L141 G146 L148	A99-Y119 HydrophobicContact CB-CD1 4.23Å; A99-Y119 HydrophobicContact CB-CE1 3.55Å; A99-Y119 HydrophobicContact CB-CE2 4.45Å; A100-Y119 HydrophobicContact CB-CD1 3.82Å; A100-Y119 HydrophobicContact CB-CE1 4.15Å; V111-Y119 WeakPolarHBondContact CA-O 3.02Å; V111-Y119 WeakPolarHBondContact CB-O 3.26Å; R112-Y119 PolarHBondContact N-O 3.27Å; R112-Y119 PolarHBondContact O-N 3.31Å; A114-Y119 HydrophobicContact CB-CE2 4.01Å; H117-Y119 HydrophobicContact CB-CE2 3.47Å; H117-Y119 VanDerWaalsContact CB-CE2 3.47Å; H117-Y119 WeakPolarHBondContact CB-OH 3.48Å; Y119-F124 AromaticContact CD2-CD2 3.91Å; Y119-F124 HydrophobicContact CD2-CD2 3.91Å; Y119-F124 HydrophobicContact CD2-CE2 4.23Å; Y119-F124 HydrophobicContact CG-CD2 4Å; Y119-L141 WeakPolarHBondContact OH-CD1 3.21Å; Y119-G146 PolarHBondContact OH-O 3.34Å; Y119-L148 HydrophobicContact CD1-CD1 3.95Å; Y119-L148 HydrophobicContact CD2-CD1 4.35Å; Y119-L148 HydrophobicContact CE1-CD1 3.88Å; Y119-L148 HydrophobicContact CE1-CG 4.28Å; Y119-L148 HydrophobicContact CE2-CD1 4.31Å; Y119-L148 HydrophobicContact CG-CD1 4.2Å
120	H	89.9	Confident	88.1	Confident	42 Å²	42	63.2 Å²	63.2	19%	0.194	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	152.6	161.4	-57.2	116.9	0	0	0	109.8	C98 C101 Q122 C123 F124	C98-H120 VanDerWaalsContact CB-CE1 3.48Å; C98-H120 WeakPolarHBondContact CB-CE1 3.26Å; C98-H120 WeakPolarHBondContact CB-ND1 3.46Å; C101-H120 PolarHBondContact SG-CE1 2.72Å; C101-H120 PolarHBondContact SG-ND1 3.02Å; H120-Q122 VanDerWaalsContact C-N 3.27Å; H120-Q122 PolarHBondContact O-N 2.83Å; H120-C123 HydrophobicContact CB-CB 3.9Å; H120-C123 PolarHBondContact O-N 2.68Å; H120-F124 PolarHBondContact O-N 3.21Å; H120-F124 VanDerWaalsContact O-N 3.1Å
121	L	87.9	Confident	88.2	Confident	78 Å²	78	62.9 Å²	62.9	41%	0.408	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-48.6	175.3	-71.8	175	0	0	0	111.8	V110 R112 C123 F124	V110-L121 HydrophobicContact CB-CD1 3.96Å; V110-L121 HydrophobicContact CB-CG 4.41Å; V110-L121 HydrophobicContact CG1-CD1 4.1Å; V110-L121 HydrophobicContact CG1-CD2 4.02Å; V110-L121 HydrophobicContact CG1-CG 4.3Å; R112-L121 HydrophobicContact CG-CD2 3.89Å; R112-L121 PolarHBondContact NH1-O 3.13Å; L121-C123 VanDerWaalsContact C-N 3.32Å; L121-C123 PolarHBondContact O-N 2.88Å; L121-F124 PolarHBondContact O-N 3.44Å
122	Q	88.9	Confident	88.2	Confident	148 Å²	148	66.6 Å²	66.6	69%	0.692	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-25.8	179	-64.4	169.3	-8.8	0	0	113.3	H120 F124	H120-Q122 VanDerWaalsContact C-N 3.27Å; H120-Q122 PolarHBondContact O-N 2.83Å; Q122-F124 VanDerWaalsContact C-N 3.32Å
123	C	89.6	Confident	88.1	Confident	25 Å²	25	64.4 Å²	64.4	17%	0.169	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-11.7	178.4	-67.2	0	0	0	0	112.7	A100 H120 L121 K125	A100-C123 HydrophobicContact CB-CB 3.93Å; H120-C123 HydrophobicContact CB-CB 3.9Å; H120-C123 PolarHBondContact O-N 2.68Å; L121-C123 VanDerWaalsContact C-N 3.32Å; L121-C123 PolarHBondContact O-N 2.88Å; C123-K125 PolarHBondContact O-N 2.79Å
124	F	90.8	Very high	88	Confident	3 Å²	3	62.5 Å²	62.5	1%	0.013	33%	0.327	C	S	.	.			trans	-82.9	68.2	178.8	-162.9	-95.9	0	0	0	110.3	R112 A114 Y119 H120 L121 Q122 M133 F139 L148	R112-F124 HydrophobicContact CB-CB 4.15Å; R112-F124 HydrophobicContact CB-CD2 3.55Å; R112-F124 HydrophobicContact CB-CE2 4.02Å; R112-F124 HydrophobicContact CB-CG 3.84Å; R112-F124 HydrophobicContact CG-CB 4.19Å; R112-F124 HydrophobicContact CG-CD1 4.45Å; R112-F124 HydrophobicContact CG-CD2 4.31Å; R112-F124 HydrophobicContact CG-CG 4.09Å; A114-F124 HydrophobicContact CB-CE2 4.12Å; Y119-F124 AromaticContact CD2-CD2 3.91Å; Y119-F124 HydrophobicContact CD2-CD2 3.91Å; Y119-F124 HydrophobicContact CD2-CE2 4.23Å; Y119-F124 HydrophobicContact CG-CD2 4Å; H120-F124 PolarHBondContact O-N 3.21Å; H120-F124 VanDerWaalsContact O-N 3.1Å; L121-F124 PolarHBondContact O-N 3.44Å; Q122-F124 VanDerWaalsContact C-N 3.32Å; F124-M133 HydrophobicContact CD1-CB 3.84Å; F124-M133 HydrophobicContact CD1-CE 3.47Å; F124-M133 VanDerWaalsContact CD1-CE 3.47Å; F124-M133 HydrophobicContact CD2-CE 4.43Å; F124-M133 HydrophobicContact CE1-CB 3.8Å; F124-M133 HydrophobicContact CE1-CE 3.36Å; F124-M133 HydrophobicContact CE1-SD 4.37Å; F124-M133 HydrophobicContact CE2-CE 4.33Å; F124-M133 HydrophobicContact CG-CE 4.02Å; F124-M133 HydrophobicContact CZ-CE 3.82Å; F124-M133 PolarHBondContact O-N 2.87Å; F124-F139 HydrophobicContact CE1-CD1 4.35Å; F124-F139 HydrophobicContact CE1-CE1 4.33Å; F124-F139 HydrophobicContact CE2-CZ 4.47Å; F124-F139 HydrophobicContact CZ-CD1 4.08Å; F124-F139 HydrophobicContact CZ-CD2 4.38Å; F124-F139 AromaticContact CZ-CE1 3.75Å; F124-F139 HydrophobicContact CZ-CE1 3.75Å; F124-F139 HydrophobicContact CZ-CE2 4.06Å; F124-F139 HydrophobicContact CZ-CG 4.4Å; F124-F139 AromaticContact CZ-CZ 3.73Å; F124-F139 HydrophobicContact CZ-CZ 3.73Å; F124-L148 HydrophobicContact CB-CD1 4.42Å; F124-L148 HydrophobicContact CD2-CD1 3.28Å; F124-L148 HydrophobicContact CD2-CD2 4.48Å; F124-L148 HydrophobicContact CE2-CD1 3.51Å; F124-L148 HydrophobicContact CE2-CD2 3.85Å; F124-L148 HydrophobicContact CE2-CG 4.34Å; F124-L148 HydrophobicContact CG-CD1 3.83Å; F124-L148 HydrophobicContact CZ-CD1 4.23Å; F124-L148 HydrophobicContact CZ-CD2 4.23Å
125	K	91.5	Very high	88.1	Confident	81 Å²	81	66.9 Å²	66.9	35%	0.352	35%	0.352	S	S	.	.	B	Isolated β-bridge	trans	-126.7	154.7	-177.5	61.8	178.9	-176.7	167.5	0	111.5	C123 E130 R131	C123-K125 PolarHBondContact O-N 2.79Å; K125-E130 HydrophobicContact CD-CB 4.49Å; K125-E130 IonicContact NZ-OE2 2.75Å; K125-E130 PolarHBondContact NZ-OE2 3.4Å; K125-R131 CarbonylContact C-O 3.52Å; K125-R131 WeakPolarHBondContact CA-O 3.37Å; K125-R131 WeakPolarHBondContact CB-O 3.4Å
126	C	91.1	Very high	88.1	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.007	35%	0.345	C	S	.	.			trans	-64.4	133.6	177	-176.7	0	0	0	0	110.8	V128 C129 E130 R131 L148 C150 D153	C126-V128 PolarHBondContact O-N 3.42Å; C126-V128 PolarHBondContact SG-N 3.03Å; C126-V128 VanDerWaalsContact SG-N 3.37Å; C126-C129 WeakPolarHBondContact CB-SG 3.46Å; C126-E130 WeakPolarHBondContact O-CA 3.42Å; C126-E130 PolarHBondContact O-N 3.4Å; C126-R131 PolarHBondContact N-O 3.06Å; C126-L148 CarbonylContact C-O 3.51Å; C126-L148 WeakPolarHBondContact CA-O 3.27Å; C126-C150 HydrophobicContact CB-CB 4.13Å; C126-C150 PolarHBondContact SG-N 3.07Å; C126-D153 PolarHBondContact SG-OD2 3.25Å
127	A	88.3	Confident	88.2	Confident	57 Å²	57	60.3 Å²	60.3	47%	0.471	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-9.5	176.6	0	0	0	0	0	114.1	K147 L148	A127-K147 HydrophobicContact CB-CB 4.14Å; A127-K147 HydrophobicContact CB-CD 4.01Å; A127-K147 HydrophobicContact CB-CG 4.39Å; A127-L148 PolarHBondContact N-O 3.37Å
128	V	86.5	Confident	88.3	Confident	86 Å²	86	59.8 Å²	59.8	52%	0.521	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-59	-178.5	-179.8	0	0	0	0	111	C126 V149 D153	C126-V128 PolarHBondContact O-N 3.42Å; C126-V128 PolarHBondContact SG-N 3.03Å; C126-V128 VanDerWaalsContact SG-N 3.37Å; V128-V149 HydrophobicContact CG2-CG1 4.3Å; V128-D153 HydrophobicContact CB-CB 3.91Å; V128-D153 WeakPolarHBondContact CB-OD2 3.48Å; V128-D153 HydrophobicContact CG1-CB 4.06Å; V128-D153 HydrophobicContact CG2-CB 4.27Å
129	C	89.4	Confident	88.3	Confident	48 Å²	48	59.7 Å²	59.7	32%	0.324	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-1.7	179.4	66	0	0	0	0	115.3	C126 R131 D153	C126-C129 WeakPolarHBondContact CB-SG 3.46Å; C129-R131 PolarHBondContact O-N 2.66Å; C129-R131 WeakPolarHBondContact SG-CB 3.39Å; C129-D153 WeakPolarHBondContact CB-OD2 3.37Å; C129-D153 PolarHBondContact N-OD2 3.03Å; C129-D153 PolarHBondContact SG-OD2 3.38Å
130	E	87.9	Confident	88.2	Confident	131 Å²	131	60.9 Å²	60.9	61%	0.612	33%	0.33	S	S	*	.			trans	57.1	11.4	-176.9	-62.4	-156.8	-148.8	0	0	116.2	K125 C126 E132	K125-E130 HydrophobicContact CD-CB 4.49Å; K125-E130 IonicContact NZ-OE2 2.75Å; K125-E130 PolarHBondContact NZ-OE2 3.4Å; C126-E130 WeakPolarHBondContact O-CA 3.42Å; C126-E130 PolarHBondContact O-N 3.4Å; E130-E132 PolarHBondContact O-N 3.06Å
131	R	88.1	Confident	88.1	Confident	103 Å²	103	61.2 Å²	61.2	39%	0.389	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-71.8	129.4	178.7	-166.7	-168.8	-44.8	141.2	3.4	111.1	K125 C126 C129 M133 E152	K125-R131 CarbonylContact C-O 3.52Å; K125-R131 WeakPolarHBondContact CA-O 3.37Å; K125-R131 WeakPolarHBondContact CB-O 3.4Å; C126-R131 PolarHBondContact N-O 3.06Å; C129-R131 PolarHBondContact O-N 2.66Å; C129-R131 WeakPolarHBondContact SG-CB 3.39Å; R131-M133 PolarHBondContact O-N 2.94Å; R131-E152 IonicContact CZ-OE2 3.28Å; R131-E152 IonicContact NH1-OE1 2.65Å; R131-E152 IonicContact NH1-OE2 3.08Å; R131-E152 PolarHBondContact NH1-OE2 3.46Å; R131-E152 IonicContact NH2-OE2 3.05Å; R131-E152 PolarHBondContact NH2-OE2 3.01Å
132	E	89.5	Confident	87.9	Confident	118 Å²	118	59.2 Å²	59.2	55%	0.551	32%	0.322	S	S	*	.	B	Isolated β-bridge	trans	-64	129	169.5	-62.5	-173	174.5	0	0	110	E130	E130-E132 PolarHBondContact O-N 3.06Å
133	M	85.5	Confident	87.3	Confident	4 Å²	4	58 Å²	58	2%	0.02	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-93	122	-177.5	-56.4	174.7	-70.7	0	0	109.5	R112 F124 R131 D137 F139 L148	R112-M133 PolarHBondContact NH1-O 2.7Å; R112-M133 PolarHBondContact NH2-O 3.3Å; F124-M133 HydrophobicContact CD1-CB 3.84Å; F124-M133 HydrophobicContact CD1-CE 3.47Å; F124-M133 VanDerWaalsContact CD1-CE 3.47Å; F124-M133 HydrophobicContact CD2-CE 4.43Å; F124-M133 HydrophobicContact CE1-CB 3.8Å; F124-M133 HydrophobicContact CE1-CE 3.36Å; F124-M133 HydrophobicContact CE1-SD 4.37Å; F124-M133 HydrophobicContact CE2-CE 4.33Å; F124-M133 HydrophobicContact CG-CE 4.02Å; F124-M133 HydrophobicContact CZ-CE 3.82Å; F124-M133 PolarHBondContact O-N 2.87Å; R131-M133 PolarHBondContact O-N 2.94Å; M133-D137 WeakPolarHBondContact CA-OD2 3.48Å; M133-D137 HydrophobicContact CB-CB 4.14Å; M133-F139 HydrophobicContact CE-CB 4.21Å; M133-F139 HydrophobicContact CE-CG 4.34Å; M133-F139 HydrophobicContact SD-CB 3.35Å; M133-F139 WeakPolarHBondContact SD-CB 3.36Å; M133-F139 HydrophobicContact SD-CG 4.03Å; M133-L148 HydrophobicContact CE-CB 3.41Å; M133-L148 VanDerWaalsContact CE-CB 3.41Å; M133-L148 HydrophobicContact CE-CD1 3.64Å; M133-L148 HydrophobicContact CE-CD2 4.22Å; M133-L148 HydrophobicContact CE-CG 3.95Å; M133-L148 HydrophobicContact SD-CB 4.47Å
134	A	86.2	Confident	86.5	Confident	54 Å²	54	64.5 Å²	64.5	45%	0.446	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-79.5	169.7	-179.1	0	0	0	0	0	112.5	G136 D137	A134-G136 PolarHBondContact O-N 3.04Å; A134-G136 VanDerWaalsContact O-N 3.15Å; A134-D137 PolarHBondContact N-OD2 2.84Å; A134-D137 WeakPolarHBondContact O-CB 3.26Å; A134-D137 PolarHBondContact O-N 3.31Å; A134-D137 VanDerWaalsContact O-N 3.12Å
135	T	86	Confident	85.9	Confident	98 Å²	98	67.5 Å²	67.5	60%	0.601	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	117.6	172.3	-56.2	0	0	0	0	109.2
136	G	83.4	Confident	85.4	Confident	35 Å²	35	63.8 Å²	63.8	36%	0.361	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	110.7	-17.5	-177.2	0	0	0	0	0	113.9	A134	A134-G136 PolarHBondContact O-N 3.04Å; A134-G136 VanDerWaalsContact O-N 3.15Å
137	D	87.4	Confident	85.1	Confident	68 Å²	68	69.1 Å²	69.1	36%	0.364	38%	0.379	S	S	.	.			trans	-67.2	140.8	176.9	-72.3	-6.7	0	0	0	111.3	M133 A134	M133-D137 WeakPolarHBondContact CA-OD2 3.48Å; M133-D137 HydrophobicContact CB-CB 4.14Å; A134-D137 PolarHBondContact N-OD2 2.84Å; A134-D137 WeakPolarHBondContact O-CB 3.26Å; A134-D137 PolarHBondContact O-N 3.31Å; A134-D137 VanDerWaalsContact O-N 3.12Å
138	E	88.1	Confident	85.1	Confident	58 Å²	58	66.7 Å²	66.7	27%	0.271	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	128.2	175.8	-63.2	-176.5	121.5	0	0	109.8	K5 K151	K5-E138 WeakPolarHBondContact CE-OE1 3.43Å; K5-E138 IonicContact NZ-OE1 3.38Å; K5-E138 PolarHBondContact NZ-OE1 3.1Å; K5-E138 IonicContact NZ-OE2 2.78Å; E138-K151 HydrophobicContact CB-CB 3.93Å; E138-K151 HydrophobicContact CB-CD 3.93Å; E138-K151 HydrophobicContact CG-CD 4.47Å; E138-K151 WeakPolarHBondContact O-CB 3.39Å; E138-K151 PolarHBondContact O-N 2.95Å; E138-K151 WeakPolarHBondContact OE2-CD 3.17Å; E138-K151 WeakPolarHBondContact OE2-CE 3.42Å; E138-K151 IonicContact OE2-NZ 2.7Å; E138-K151 PolarHBondContact OE2-NZ 3.01Å
139	F	89.2	Confident	85.3	Confident	15 Å²	15	63.2 Å²	63.2	7%	0.066	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	164.1	179.8	69.1	-86.1	0	0	0	111.7	C8 A114 F124 M133 L148 V149	C8-F139 HydrophobicContact CB-CE1 4.02Å; C8-F139 WeakPolarHBondContact SG-CE1 3.24Å; C8-F139 VanDerWaalsContact SG-CZ 3.59Å; A114-F139 HydrophobicContact CB-CE2 3.9Å; A114-F139 HydrophobicContact CB-CZ 4.05Å; F124-F139 HydrophobicContact CE1-CD1 4.35Å; F124-F139 HydrophobicContact CE1-CE1 4.33Å; F124-F139 HydrophobicContact CE2-CZ 4.47Å; F124-F139 HydrophobicContact CZ-CD1 4.08Å; F124-F139 HydrophobicContact CZ-CD2 4.38Å; F124-F139 AromaticContact CZ-CE1 3.75Å; F124-F139 HydrophobicContact CZ-CE1 3.75Å; F124-F139 HydrophobicContact CZ-CE2 4.06Å; F124-F139 HydrophobicContact CZ-CG 4.4Å; F124-F139 AromaticContact CZ-CZ 3.73Å; F124-F139 HydrophobicContact CZ-CZ 3.73Å; M133-F139 HydrophobicContact CE-CB 4.21Å; M133-F139 HydrophobicContact CE-CG 4.34Å; M133-F139 HydrophobicContact SD-CB 3.35Å; M133-F139 WeakPolarHBondContact SD-CB 3.36Å; M133-F139 HydrophobicContact SD-CG 4.03Å; F139-L148 HydrophobicContact CD2-CD2 3.6Å; F139-L148 HydrophobicContact CE2-CD2 3.67Å; F139-V149 CarbonylContact C-O 3.52Å; F139-V149 WeakPolarHBondContact CA-O 3.37Å
140	Y	87.6	Confident	85.3	Confident	25 Å²	25	61.2 Å²	61.2	10%	0.098	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	133.5	176.9	-67.2	-88.3	0	0	0	109.2	K5 V149 K151 Y154	K5-Y140 HydrophobicContact CB-CE1 4.25Å; Y140-V149 PolarHBondContact N-O 3.42Å; Y140-V149 PolarHBondContact O-N 3.22Å; Y140-K151 HydrophobicContact CE2-CB 4.22Å; Y140-K151 HydrophobicContact CE2-CG 4.31Å; Y140-Y154 HydrophobicContact CD1-CD1 4.03Å; Y140-Y154 HydrophobicContact CD1-CD2 4.29Å; Y140-Y154 AromaticContact CD1-CE1 3.9Å; Y140-Y154 HydrophobicContact CD1-CE1 3.9Å; Y140-Y154 HydrophobicContact CD1-CE2 4.21Å; Y140-Y154 HydrophobicContact CD1-CG 4.2Å; Y140-Y154 AromaticContact CD2-CD1 3.46Å; Y140-Y154 HydrophobicContact CD2-CD1 3.46Å; Y140-Y154 VanDerWaalsContact CD2-CD1 3.46Å; Y140-Y154 AromaticContact CD2-CD2 3.9Å; Y140-Y154 HydrophobicContact CD2-CD2 3.9Å; Y140-Y154 HydrophobicContact CD2-CE1 4.19Å; Y140-Y154 AromaticContact CD2-CG 3.27Å; Y140-Y154 HydrophobicContact CD2-CG 3.27Å; Y140-Y154 AromaticContact CE1-CD1 3.87Å; Y140-Y154 HydrophobicContact CE1-CD1 3.87Å; Y140-Y154 AromaticContact CE1-CE1 3.66Å; Y140-Y154 HydrophobicContact CE1-CE1 3.66Å; Y140-Y154 HydrophobicContact CE1-CG 4.47Å; Y140-Y154 AromaticContact CE2-CD1 3.25Å; Y140-Y154 HydrophobicContact CE2-CD1 3.25Å; Y140-Y154 AromaticContact CE2-CE1 3.95Å; Y140-Y154 HydrophobicContact CE2-CE1 3.95Å; Y140-Y154 AromaticContact CE2-CG 3.59Å; Y140-Y154 HydrophobicContact CE2-CG 3.59Å; Y140-Y154 AromaticContact CG-CD1 3.83Å; Y140-Y154 HydrophobicContact CG-CD1 3.83Å; Y140-Y154 AromaticContact CG-CD2 3.74Å; Y140-Y154 HydrophobicContact CG-CD2 3.74Å; Y140-Y154 HydrophobicContact CG-CE1 4.15Å; Y140-Y154 HydrophobicContact CG-CE2 4.1Å; Y140-Y154 AromaticContact CG-CG 3.59Å; Y140-Y154 HydrophobicContact CG-CG 3.59Å; Y140-Y154 AromaticContact CZ-CD1 3.45Å; Y140-Y154 VanDerWaalsContact CZ-CD1 3.45Å; Y140-Y154 AromaticContact CZ-CE1 3.66Å
141	L	88.1	Confident	85.3	Confident	50 Å²	50	58.4 Å²	58.4	26%	0.262	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	123.5	175.3	-174.2	72	0	0	0	108.9	H115 Y119 G146 L148	H115-L141 HydrophobicContact CB-CD2 4.17Å; Y119-L141 WeakPolarHBondContact OH-CD1 3.21Å; L141-G146 WeakPolarHBondContact CD1-O 3.27Å; L141-L148 HydrophobicContact CD1-CD2 3.68Å; L141-L148 HydrophobicContact CD1-CG 4.38Å
142	M	83.4	Confident	85.3	Confident	35 Å²	35	58.9 Å²	58.9	17%	0.172	32%	0.316	C	S	.	.			trans	-74.1	127.1	175.1	-67.8	-60.5	100.9	0	0	109.8	Q144 D145 G146 K147 V149 Y154	M142-Q144 VanDerWaalsContact C-N 3.31Å; M142-Q144 PolarHBondContact O-N 2.76Å; M142-D145 WeakPolarHBondContact CB-OD1 3.47Å; M142-G146 WeakPolarHBondContact O-CA 3.2Å; M142-G146 PolarHBondContact O-N 3.2Å; M142-G146 VanDerWaalsContact O-N 3.13Å; M142-K147 HydrophobicContact CB-CB 4.3Å; M142-K147 HydrophobicContact CG-CB 4.34Å; M142-K147 PolarHBondContact N-O 2.73Å; M142-V149 HydrophobicContact CE-CG2 4.29Å; M142-V149 HydrophobicContact CG-CG2 4.1Å; M142-Y154 HydrophobicContact CE-CD2 4.08Å; M142-Y154 HydrophobicContact CE-CE2 3.97Å
143	P	75.4	Confident	85.2	Confident	122 Å²	122	54.4 Å²	54.4	79%	0.792	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-26.6	-171.4	-22	31.6	0	0	0	115.3
144	Q	72.8	Confident	85.3	Confident	163 Å²	163	56 Å²	56	76%	0.762	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-34.8	-169.2	-64.1	-179.3	4.4	0	0	113.2	M142	M142-Q144 VanDerWaalsContact C-N 3.31Å; M142-Q144 PolarHBondContact O-N 2.76Å
145	D	78.3	Confident	85.2	Confident	65 Å²	65	55.7 Å²	55.7	35%	0.348	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.1	-1.8	-169.8	59	1.8	0	0	0	113.6	M142 K147	M142-D145 WeakPolarHBondContact CB-OD1 3.47Å; D145-K147 HydrophobicContact CB-CG 4.33Å; D145-K147 VanDerWaalsContact CG-CG 3.46Å; D145-K147 PolarHBondContact O-N 2.92Å; D145-K147 WeakPolarHBondContact OD1-CB 3.41Å; D145-K147 PolarHBondContact OD1-N 3.14Å; D145-K147 WeakPolarHBondContact OD2-CD 3.09Å; D145-K147 WeakPolarHBondContact OD2-CE 3.42Å; D145-K147 VanDerWaalsContact OD2-CG 3.26Å; D145-K147 WeakPolarHBondContact OD2-CG 3.45Å; D145-K147 IonicContact OD2-NZ 2.68Å; D145-K147 PolarHBondContact OD2-NZ 3.47Å
146	G	80.7	Confident	85.1	Confident	3 Å²	3	53.5 Å²	53.5	3%	0.031	28%	0.279	C	S	.	.			trans	66.3	17.5	-174.8	0	0	0	0	0	112.9	Y119 L141 M142	Y119-G146 PolarHBondContact OH-O 3.34Å; L141-G146 WeakPolarHBondContact CD1-O 3.27Å; M142-G146 WeakPolarHBondContact O-CA 3.2Å; M142-G146 PolarHBondContact O-N 3.2Å; M142-G146 VanDerWaalsContact O-N 3.13Å
147	K	84.8	Confident	84.6	Confident	113 Å²	113	53.8 Å²	53.8	49%	0.491	27%	0.274	S	S	.	.			trans	-69.1	143.4	176.6	-74.7	-175.8	-165.1	130.7	0	111.2	A127 M142 D145	A127-K147 HydrophobicContact CB-CB 4.14Å; A127-K147 HydrophobicContact CB-CD 4.01Å; A127-K147 HydrophobicContact CB-CG 4.39Å; M142-K147 HydrophobicContact CB-CB 4.3Å; M142-K147 HydrophobicContact CG-CB 4.34Å; M142-K147 PolarHBondContact N-O 2.73Å; D145-K147 HydrophobicContact CB-CG 4.33Å; D145-K147 VanDerWaalsContact CG-CG 3.46Å; D145-K147 PolarHBondContact O-N 2.92Å; D145-K147 WeakPolarHBondContact OD1-CB 3.41Å; D145-K147 PolarHBondContact OD1-N 3.14Å; D145-K147 WeakPolarHBondContact OD2-CD 3.09Å; D145-K147 WeakPolarHBondContact OD2-CE 3.42Å; D145-K147 VanDerWaalsContact OD2-CG 3.26Å; D145-K147 WeakPolarHBondContact OD2-CG 3.45Å; D145-K147 IonicContact OD2-NZ 2.68Å; D145-K147 PolarHBondContact OD2-NZ 3.47Å
148	L	89.5	Confident	83.9	Confident	6 Å²	6	55.8 Å²	55.8	3%	0.031	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	133.5	179	-59.9	159.3	0	0	0	109.2	A114 Y119 F124 C126 A127 M133 F139 L141	A114-L148 HydrophobicContact CB-CD2 4.22Å; Y119-L148 HydrophobicContact CD1-CD1 3.95Å; Y119-L148 HydrophobicContact CD2-CD1 4.35Å; Y119-L148 HydrophobicContact CE1-CD1 3.88Å; Y119-L148 HydrophobicContact CE1-CG 4.28Å; Y119-L148 HydrophobicContact CE2-CD1 4.31Å; Y119-L148 HydrophobicContact CG-CD1 4.2Å; F124-L148 HydrophobicContact CB-CD1 4.42Å; F124-L148 HydrophobicContact CD2-CD1 3.28Å; F124-L148 HydrophobicContact CD2-CD2 4.48Å; F124-L148 HydrophobicContact CE2-CD1 3.51Å; F124-L148 HydrophobicContact CE2-CD2 3.85Å; F124-L148 HydrophobicContact CE2-CG 4.34Å; F124-L148 HydrophobicContact CG-CD1 3.83Å; F124-L148 HydrophobicContact CZ-CD1 4.23Å; F124-L148 HydrophobicContact CZ-CD2 4.23Å; C126-L148 CarbonylContact C-O 3.51Å; C126-L148 WeakPolarHBondContact CA-O 3.27Å; A127-L148 PolarHBondContact N-O 3.37Å; M133-L148 HydrophobicContact CE-CB 3.41Å; M133-L148 VanDerWaalsContact CE-CB 3.41Å; M133-L148 HydrophobicContact CE-CD1 3.64Å; M133-L148 HydrophobicContact CE-CD2 4.22Å; M133-L148 HydrophobicContact CE-CG 3.95Å; M133-L148 HydrophobicContact SD-CB 4.47Å; F139-L148 HydrophobicContact CD2-CD2 3.6Å; F139-L148 HydrophobicContact CE2-CD2 3.67Å; L141-L148 HydrophobicContact CD1-CD2 3.68Å; L141-L148 HydrophobicContact CD1-CG 4.38Å
149	V	89.5	Confident	82.7	Confident	13 Å²	13	58.1 Å²	58.1	8%	0.079	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	127.4	177.2	-174.7	0	0	0	0	108.4	V128 F139 Y140 M142 D153	V128-V149 HydrophobicContact CG2-CG1 4.3Å; F139-V149 CarbonylContact C-O 3.52Å; F139-V149 WeakPolarHBondContact CA-O 3.37Å; Y140-V149 PolarHBondContact N-O 3.42Å; Y140-V149 PolarHBondContact O-N 3.22Å; M142-V149 HydrophobicContact CE-CG2 4.29Å; M142-V149 HydrophobicContact CG-CG2 4.1Å; V149-D153 HydrophobicContact CG1-CB 3.82Å
150	C	90.2	Very high	81.2	Confident	6 Å²	6	63.5 Å²	63.5	4%	0.041	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	156.4	177.1	73.5	0	0	0	0	110.4	C126 E152 D153 Y154	C126-C150 HydrophobicContact CB-CB 4.13Å; C126-C150 PolarHBondContact SG-N 3.07Å; C150-E152 VanDerWaalsContact C-N 3.27Å; C150-E152 PolarHBondContact O-N 2.86Å; C150-D153 PolarHBondContact O-N 2.94Å; C150-D153 VanDerWaalsContact SG-CG 3.5Å; C150-D153 PolarHBondContact SG-N 3.31Å; C150-D153 VanDerWaalsContact SG-N 3.44Å; C150-D153 PolarHBondContact SG-OD2 2.99Å; C150-Y154 WeakPolarHBondContact O-CB 3.35Å; C150-Y154 PolarHBondContact O-N 3.18Å
151	K	88.2	Confident	79.4	Confident	72 Å²	72	65.8 Å²	65.8	31%	0.313	35%	0.348	S	S	.	.	H	α-helix	trans	-55	-41.5	-179.8	174.4	178.1	171.2	-162	0	113.4	E138 Y140 D153 Y154 D155	E138-K151 HydrophobicContact CB-CB 3.93Å; E138-K151 HydrophobicContact CB-CD 3.93Å; E138-K151 HydrophobicContact CG-CD 4.47Å; E138-K151 WeakPolarHBondContact O-CB 3.39Å; E138-K151 PolarHBondContact O-N 2.95Å; E138-K151 WeakPolarHBondContact OE2-CD 3.17Å; E138-K151 WeakPolarHBondContact OE2-CE 3.42Å; E138-K151 IonicContact OE2-NZ 2.7Å; E138-K151 PolarHBondContact OE2-NZ 3.01Å; Y140-K151 HydrophobicContact CE2-CB 4.22Å; Y140-K151 HydrophobicContact CE2-CG 4.31Å; K151-D153 PolarHBondContact O-N 3.12Å; K151-Y154 PolarHBondContact O-N 3.37Å; K151-D155 VanDerWaalsContact CG-OD2 3.24Å; K151-D155 WeakPolarHBondContact CG-OD2 3.33Å; K151-D155 VanDerWaalsContact O-CB 3.25Å; K151-D155 WeakPolarHBondContact O-CB 2.81Å; K151-D155 PolarHBondContact O-N 2.92Å
152	E	86.9	Confident	77.6	Confident	113 Å²	113	66.5 Å²	66.5	53%	0.528	36%	0.357	S	S	.	.	H	α-helix	trans	-61.3	-46.1	-179.6	-66.3	165.4	-176.5	0	0	112.1	R131 C150 T156	R131-E152 IonicContact CZ-OE2 3.28Å; R131-E152 IonicContact NH1-OE1 2.65Å; R131-E152 IonicContact NH1-OE2 3.08Å; R131-E152 PolarHBondContact NH1-OE2 3.46Å; R131-E152 IonicContact NH2-OE2 3.05Å; R131-E152 PolarHBondContact NH2-OE2 3.01Å; C150-E152 VanDerWaalsContact C-N 3.27Å; C150-E152 PolarHBondContact O-N 2.86Å; E152-T156 WeakPolarHBondContact O-CB 3.39Å; E152-T156 PolarHBondContact O-N 2.74Å; E152-T156 PolarHBondContact O-OG1 2.81Å
153	D	87.8	Confident	76.2	Confident	24 Å²	24	72.8 Å²	72.8	13%	0.128	38%	0.383	C	S	.	.	H	α-helix	trans	-72.3	-35.4	179.4	-72.4	-33.4	0	0	0	111.4	C126 V128 C129 V149 C150 K151 T156 T157	C126-D153 PolarHBondContact SG-OD2 3.25Å; V128-D153 HydrophobicContact CB-CB 3.91Å; V128-D153 WeakPolarHBondContact CB-OD2 3.48Å; V128-D153 HydrophobicContact CG1-CB 4.06Å; V128-D153 HydrophobicContact CG2-CB 4.27Å; C129-D153 WeakPolarHBondContact CB-OD2 3.37Å; C129-D153 PolarHBondContact N-OD2 3.03Å; C129-D153 PolarHBondContact SG-OD2 3.38Å; V149-D153 HydrophobicContact CG1-CB 3.82Å; C150-D153 PolarHBondContact O-N 2.94Å; C150-D153 VanDerWaalsContact SG-CG 3.5Å; C150-D153 PolarHBondContact SG-N 3.31Å; C150-D153 VanDerWaalsContact SG-N 3.44Å; C150-D153 PolarHBondContact SG-OD2 2.99Å; K151-D153 PolarHBondContact O-N 3.12Å; D153-T156 PolarHBondContact O-N 3.45Å; D153-T157 VanDerWaalsContact O-CB 3.27Å; D153-T157 WeakPolarHBondContact O-CB 3.46Å; D153-T157 PolarHBondContact O-N 3.2Å; D153-T157 PolarHBondContact O-OG1 3.35Å
154	Y	86.8	Confident	75.2	Confident	38 Å²	38	73.3 Å²	73.3	15%	0.149	38%	0.375	C	S	.	.	H	α-helix	trans	-65.2	-49.1	174.8	-175.7	-95.3	0	0	0	111.2	T3 Y140 M142 C150 K151 T156 T157 K158	T3-Y154 WeakPolarHBondContact CB-OH 3.47Å; T3-Y154 VanDerWaalsContact CG2-OH 3.26Å; T3-Y154 WeakPolarHBondContact CG2-OH 3.43Å; T3-Y154 PolarHBondContact OG1-OH 3.5Å; Y140-Y154 HydrophobicContact CD1-CD1 4.03Å; Y140-Y154 HydrophobicContact CD1-CD2 4.29Å; Y140-Y154 AromaticContact CD1-CE1 3.9Å; Y140-Y154 HydrophobicContact CD1-CE1 3.9Å; Y140-Y154 HydrophobicContact CD1-CE2 4.21Å; Y140-Y154 HydrophobicContact CD1-CG 4.2Å; Y140-Y154 AromaticContact CD2-CD1 3.46Å; Y140-Y154 HydrophobicContact CD2-CD1 3.46Å; Y140-Y154 VanDerWaalsContact CD2-CD1 3.46Å; Y140-Y154 AromaticContact CD2-CD2 3.9Å; Y140-Y154 HydrophobicContact CD2-CD2 3.9Å; Y140-Y154 HydrophobicContact CD2-CE1 4.19Å; Y140-Y154 AromaticContact CD2-CG 3.27Å; Y140-Y154 HydrophobicContact CD2-CG 3.27Å; Y140-Y154 AromaticContact CE1-CD1 3.87Å; Y140-Y154 HydrophobicContact CE1-CD1 3.87Å; Y140-Y154 AromaticContact CE1-CE1 3.66Å; Y140-Y154 HydrophobicContact CE1-CE1 3.66Å; Y140-Y154 HydrophobicContact CE1-CG 4.47Å; Y140-Y154 AromaticContact CE2-CD1 3.25Å; Y140-Y154 HydrophobicContact CE2-CD1 3.25Å; Y140-Y154 AromaticContact CE2-CE1 3.95Å; Y140-Y154 HydrophobicContact CE2-CE1 3.95Å; Y140-Y154 AromaticContact CE2-CG 3.59Å; Y140-Y154 HydrophobicContact CE2-CG 3.59Å; Y140-Y154 AromaticContact CG-CD1 3.83Å; Y140-Y154 HydrophobicContact CG-CD1 3.83Å; Y140-Y154 AromaticContact CG-CD2 3.74Å; Y140-Y154 HydrophobicContact CG-CD2 3.74Å; Y140-Y154 HydrophobicContact CG-CE1 4.15Å; Y140-Y154 HydrophobicContact CG-CE2 4.1Å; Y140-Y154 AromaticContact CG-CG 3.59Å; Y140-Y154 HydrophobicContact CG-CG 3.59Å; Y140-Y154 AromaticContact CZ-CD1 3.45Å; Y140-Y154 VanDerWaalsContact CZ-CD1 3.45Å; Y140-Y154 AromaticContact CZ-CE1 3.66Å; M142-Y154 HydrophobicContact CE-CD2 4.08Å; M142-Y154 HydrophobicContact CE-CE2 3.97Å; C150-Y154 WeakPolarHBondContact O-CB 3.35Å; C150-Y154 PolarHBondContact O-N 3.18Å; K151-Y154 PolarHBondContact O-N 3.37Å; Y154-T156 VanDerWaalsContact C-N 3.3Å; Y154-T156 PolarHBondContact O-N 3.21Å; Y154-T157 PolarHBondContact O-N 2.78Å; Y154-K158 HydrophobicContact CE1-CD 4.22Å; Y154-K158 VanDerWaalsContact O-CB 3.27Å; Y154-K158 WeakPolarHBondContact O-CB 3.32Å; Y154-K158 PolarHBondContact O-N 2.95Å
155	D	85.6	Confident	74.4	Confident	47 Å²	47	68.4 Å²	68.4	25%	0.251	35%	0.353	S	S	.	.	H	α-helix	trans	-65.9	-35.7	177.3	-70.2	-17.8	0	0	0	110.7	K151 K158 N159	K151-D155 VanDerWaalsContact CG-OD2 3.24Å; K151-D155 WeakPolarHBondContact CG-OD2 3.33Å; K151-D155 VanDerWaalsContact O-CB 3.25Å; K151-D155 WeakPolarHBondContact O-CB 2.81Å; K151-D155 PolarHBondContact O-N 2.92Å; D155-K158 PolarHBondContact O-N 2.91Å; D155-N159 WeakPolarHBondContact O-CB 3.43Å; D155-N159 PolarHBondContact O-N 3.25Å; D155-N159 PolarHBondContact O-ND2 3.26Å
156	T	83	Confident	73.3	Confident	52 Å²	52	72.1 Å²	72.1	32%	0.319	36%	0.362	S	S	.	.	H	α-helix	trans	-64.2	-42.9	173.2	-65.4	0	0	0	0	111.2	E152 D153 Y154 K158 K160	E152-T156 WeakPolarHBondContact O-CB 3.39Å; E152-T156 PolarHBondContact O-N 2.74Å; E152-T156 PolarHBondContact O-OG1 2.81Å; D153-T156 PolarHBondContact O-N 3.45Å; Y154-T156 VanDerWaalsContact C-N 3.3Å; Y154-T156 PolarHBondContact O-N 3.21Å; T156-K158 VanDerWaalsContact C-N 3.33Å; T156-K160 HydrophobicContact CG2-CD 3.6Å; T156-K160 HydrophobicContact CG2-CG 4.18Å; T156-K160 WeakPolarHBondContact O-CA 3.44Å; T156-K160 WeakPolarHBondContact O-CB 3.12Å; T156-K160 WeakPolarHBondContact O-CG 3.19Å; T156-K160 PolarHBondContact O-N 3.24Å
157	T	72.5	Confident	72.3	Confident	41 Å²	41	81.3 Å²	81.3	25%	0.252	40%	0.396	S	S	.	.	H	α-helix	trans	-70.5	-31.6	177.6	-58.3	0	0	0	0	112	D153 Y154 K160 I165 L169	D153-T157 VanDerWaalsContact O-CB 3.27Å; D153-T157 WeakPolarHBondContact O-CB 3.46Å; D153-T157 PolarHBondContact O-N 3.2Å; D153-T157 PolarHBondContact O-OG1 3.35Å; Y154-T157 PolarHBondContact O-N 2.78Å; T157-K160 VanDerWaalsContact O-O 3.04Å; T157-I165 HydrophobicContact CG2-CB 4.15Å; T157-I165 HydrophobicContact CG2-CD1 4.36Å; T157-I165 HydrophobicContact CG2-CG2 3.41Å; T157-I165 VanDerWaalsContact CG2-CG2 3.41Å; T157-L169 HydrophobicContact CG2-CD1 4.38Å
158	K	72.6	Confident	71.3	Confident	111 Å²	111	84.6 Å²	84.6	48%	0.483	41%	0.411	S	S	.	.	H	α-helix	trans	-76.2	-43	176.7	-171.6	-178.7	177.5	-174.2	0	112.2	Y154 D155 T156	Y154-K158 HydrophobicContact CE1-CD 4.22Å; Y154-K158 VanDerWaalsContact O-CB 3.27Å; Y154-K158 WeakPolarHBondContact O-CB 3.32Å; Y154-K158 PolarHBondContact O-N 2.95Å; D155-K158 PolarHBondContact O-N 2.91Å; T156-K158 VanDerWaalsContact C-N 3.33Å
159	N	64.6	Low	70.1	Confident	106 Å²	106	87.9 Å²	87.9	57%	0.567	43%	0.428	S	S	*	.	H	α-helix	trans	-86.3	-34.2	-175.4	-68.8	-19.1	0	0	0	112.7	D155 G161	D155-N159 WeakPolarHBondContact O-CB 3.43Å; D155-N159 PolarHBondContact O-N 3.25Å; D155-N159 PolarHBondContact O-ND2 3.26Å; N159-G161 PolarHBondContact O-N 3.05Å
160	K	56.1	Low	68.4	Low	128 Å²	128	93.8 Å²	93.8	56%	0.557	46%	0.459	S	S	*	.	S	Bend	trans	-82	99.3	165.2	-58.6	-179.8	-177.4	166.9	0	105.4	T156 T157 C162	T156-K160 HydrophobicContact CG2-CD 3.6Å; T156-K160 HydrophobicContact CG2-CG 4.18Å; T156-K160 WeakPolarHBondContact O-CA 3.44Å; T156-K160 WeakPolarHBondContact O-CB 3.12Å; T156-K160 WeakPolarHBondContact O-CG 3.19Å; T156-K160 PolarHBondContact O-N 3.24Å; T157-K160 VanDerWaalsContact O-O 3.04Å; K160-C162 HydrophobicContact CB-CB 4.12Å; K160-C162 PolarHBondContact O-N 2.91Å
161	G	49.6	Very low	66.9	Low	73 Å²	73	97.4 Å²	97.4	75%	0.753	48%	0.477	S	S	*	.			trans	-60.6	44.4	160.4	0	0	0	0	0	112.5	N159 K163	N159-G161 PolarHBondContact O-N 3.05Å; G161-K163 PolarHBondContact O-N 3.47Å
162	C	51.5	Low	65.3	Low	66 Å²	66	100.9 Å²	100.9	45%	0.446	50%	0.498	S	S	.	.			trans	-74	96.5	178.6	-124.8	0	0	0	0	106.1	K160 E164 I165	K160-C162 HydrophobicContact CB-CB 4.12Å; K160-C162 PolarHBondContact O-N 2.91Å; C162-E164 PolarHBondContact O-N 2.99Å; C162-I165 PolarHBondContact O-N 3.15Å
163	K	53.3	Low	63.4	Low	166 Å²	166	102.5 Å²	102.5	72%	0.722	51%	0.505	S	S	*	.	H	α-helix	trans	-43.3	-25	173.8	-63.2	178.8	177.8	-177.9	0	113	G161 R167	G161-K163 PolarHBondContact O-N 3.47Å; K163-R167 PolarHBondContact O-N 3.12Å
164	E	54.6	Low	61.6	Low	133 Å²	133	106.2 Å²	106.2	62%	0.621	53%	0.529	S	S	*	.	H	α-helix	trans	-59.5	-45.8	174.6	-146.4	67.4	-151.3	0	0	114.1	C162 K168	C162-E164 PolarHBondContact O-N 2.99Å; E164-K168 PolarHBondContact O-N 2.99Å
165	I	55.6	Low	59.8	Low	60 Å²	60	109.7 Å²	109.7	31%	0.308	56%	0.559	S	S	.	*	H	α-helix	trans	-81.9	-33.1	-178.6	-59.2	170.1	0	0	0	110.4	T157 C162 R167 K168 L169	T157-I165 HydrophobicContact CG2-CB 4.15Å; T157-I165 HydrophobicContact CG2-CD1 4.36Å; T157-I165 HydrophobicContact CG2-CG2 3.41Å; T157-I165 VanDerWaalsContact CG2-CG2 3.41Å; C162-I165 PolarHBondContact O-N 3.15Å; I165-R167 VanDerWaalsContact C-N 3.27Å; I165-R167 PolarHBondContact O-N 2.77Å; I165-K168 PolarHBondContact O-N 2.8Å; I165-L169 HydrophobicContact CG2-CD1 3.69Å; I165-L169 PolarHBondContact O-N 2.88Å
166	R	56.2	Low	57.9	Low	144 Å²	144	115 Å²	115	54%	0.543	59%	0.587	S	S	.	*	H	α-helix	trans	-61.8	-33.3	172.8	-173.7	159.4	159.6	165.9	-10.4	112.2	E173	R166-E173 IonicContact CZ-OE1 2.72Å; R166-E173 IonicContact NE-OE1 2.73Å; R166-E173 VanDerWaalsContact NH2-CD 3.32Å; R166-E173 IonicContact NH2-OE1 3.95Å; R166-E173 PolarHBondContact NH2-OE1 3.14Å
167	R	60.4	Low	56.4	Low	195 Å²	195	119.5 Å²	119.5	74%	0.736	61%	0.609	S	S	*	*	H	α-helix	trans	-69	-36.9	169.5	-89.7	-175.3	172.5	136.1	-2.8	113.6	K163 I165	K163-R167 PolarHBondContact O-N 3.12Å; I165-R167 VanDerWaalsContact C-N 3.27Å; I165-R167 PolarHBondContact O-N 2.77Å
168	K	62.9	Low	55.4	Low	183 Å²	183	124.3 Å²	124.3	80%	0.796	63%	0.633	S	S	*	*	H	α-helix	trans	-74.6	-22.4	179	-85.3	-175.7	174.7	-179.7	0	114.1	E164 I165	E164-K168 PolarHBondContact O-N 2.99Å; I165-K168 PolarHBondContact O-N 2.8Å
169	L	63.2	Low	54.6	Low	75 Å²	75	125.8 Å²	125.8	39%	0.393	65%	0.645	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.1	4.5	-175.3	-82.1	162.4	0	0	0	115.2	T157 I165 L171	T157-L169 HydrophobicContact CG2-CD1 4.38Å; I165-L169 HydrophobicContact CG2-CD1 3.69Å; I165-L169 PolarHBondContact O-N 2.88Å; L169-L171 PolarHBondContact O-N 2.93Å
170	N	55.9	Low	54.1	Low	136 Å²	136	126.4 Å²	126.4	73%	0.727	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	44.4	40.2	176.3	-73.3	-27.4	0	0	0	114.5	I172	N170-I172 PolarHBondContact O-N 2.97Å
171	L	58	Low	54	Low	82 Å²	82	125.1 Å²	125.1	43%	0.429	66%	0.662	S	S	.	*			trans	-89.4	106.5	179.7	-120.4	71.5	0	0	0	109.8	M1 L169	M1-L171 HydrophobicContact CE-CD2 3.54Å; M1-L171 HydrophobicContact CE-CG 3.72Å; M1-L171 HydrophobicContact SD-CD2 3.48Å; M1-L171 WeakPolarHBondContact SD-CD2 3.34Å; M1-L171 HydrophobicContact SD-CG 4.26Å; L169-L171 PolarHBondContact O-N 2.93Å
172	I	54.8	Low	54.4	Low	145 Å²	145	127 Å²	127	74%	0.744	66%	0.663	S	S	*	*			trans	-61.1	131.8	173.4	-63.3	169.3	0	0	0	109.1	N170 T174	N170-I172 PolarHBondContact O-N 2.97Å; I172-T174 PolarHBondContact O-N 3.49Å
173	E	46.5	Very low	54.7	Low	147 Å²	147	130.1 Å²	130.1	69%	0.687	68%	0.675	S	S	*	*			trans	-68.9	109.7	-175.5	-55.5	-174.8	139.4	0	0	110.8	R166	R166-E173 IonicContact CZ-OE1 2.72Å; R166-E173 IonicContact NE-OE1 2.73Å; R166-E173 VanDerWaalsContact NH2-CD 3.32Å; R166-E173 IonicContact NH2-OE1 3.95Å; R166-E173 PolarHBondContact NH2-OE1 3.14Å
174	T	50.1	Low	54.8	Low	102 Å²	102	128.8 Å²	128.8	63%	0.626	67%	0.67	S	S	*	*			trans	-135.6	115.8	164.5	59.4	0	0	0	0	109.6	I172	I172-T174 PolarHBondContact O-N 3.49Å
175	S	49.8	Very low	55	Low	111 Å²	111	133.8 Å²	133.8	78%	0.776	68%	0.683	S	S	*	*			trans	62.4	95.9	162.1	65	0	0	0	0	118.1
176	D	44.6	Very low	55.5	Low	158 Å²	158	136.9 Å²	136.9	85%	0.845	71%	0.707	S	S	*	*			trans	-37.2	135.6	135.2	-68.8	-62.3	0	0	0	110.9
177	L	50.9	Low	56	Low	148 Å²	148	140.7 Å²	140.7	78%	0.775	72%	0.721	S	S	*	*			trans	174.7	120.6	144.5	-86.2	165	0	0	0	108.4
178	D	52.6	Low	56.9	Low	142 Å²	142	136.3 Å²	136.3	76%	0.759	72%	0.716	S	S	*	*	S	Bend	trans	88.7	8.9	148.3	-53	-29.1	0	0	0	124.7
179	L	55.4	Low	57.9	Low	142 Å²	142	133.6 Å²	133.6	74%	0.743	72%	0.715	S	S	*	*			trans	-110.2	7.6	178.5	-63.3	177.8	0	0	0	116.3
180	D	53.8	Low	59.1	Low	119 Å²	119	132.4 Å²	132.4	64%	0.636	71%	0.709	S	S	*	*			trans	-99.9	11.4	-161.7	-139.1	27.2	0	0	0	114.8	K184	D180-K184 WeakPolarHBondContact O-CE 3.45Å; D180-K184 WeakPolarHBondContact OD2-CE 3.14Å; D180-K184 IonicContact OD2-NZ 3.15Å; D180-K184 PolarHBondContact OD2-NZ 3.04Å
181	A	54.6	Low	60.8	Low	100 Å²	100	129.1 Å²	129.1	83%	0.826	70%	0.697	S	S	*	*	S	Bend	trans	-89.2	-21.8	-169	0	0	0	0	0	115.2
182	S	58.6	Low	62.4	Low	112 Å²	112	129.2 Å²	129.2	78%	0.783	71%	0.709	S	S	*	*	S	Bend	trans	-99	-6.7	-162.8	-150.3	0	0	0	0	116.6
183	N	55.9	Low	64.2	Low	132 Å²	132	130.6 Å²	130.6	71%	0.706	71%	0.709	S	S	*	*	S	Bend	trans	-125.7	13	-172.8	-83.3	-23.9	0	0	0	115.3
184	K	57.3	Low	66.6	Low	139 Å²	139	125.7 Å²	125.7	60%	0.604	69%	0.687	S	S	*	*	S	Bend	trans	-90.6	136.3	173.3	-62.5	178.8	-172.5	-179.9	0	108.3	D180	D180-K184 WeakPolarHBondContact O-CE 3.45Å; D180-K184 WeakPolarHBondContact OD2-CE 3.14Å; D180-K184 IonicContact OD2-NZ 3.15Å; D180-K184 PolarHBondContact OD2-NZ 3.04Å
185	R	58.8	Low	68.7	Low	237 Å²	237	123.4 Å²	123.4	89%	0.894	67%	0.67	S	S	*	*			trans	-45	135.5	172.4	-77.2	-179.3	-174.8	-177.4	1	108.8	R187	R185-R187 PolarHBondContact O-N 2.65Å
186	P	64.8	Low	70.9	Confident	126 Å²	126	122.3 Å²	122.3	82%	0.818	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-52.1	118.2	-176.2	19.2	-30.9	0	0	0	109	T188	P186-T188 PolarHBondContact O-N 3.23Å
187	R	68	Low	73.3	Confident	224 Å²	224	117.1 Å²	117.1	85%	0.845	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-68	126.3	-179.6	-173.9	179	-170.6	94.2	-0.9	107.4	R185 T189	R185-R187 PolarHBondContact O-N 2.65Å; R187-T189 PolarHBondContact O-N 3Å
188	T	77.6	Confident	75.4	Confident	102 Å²	102	110 Å²	110	63%	0.626	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-62.5	122.2	171.9	49.1	0	0	0	0	109.5	P186 V226	P186-T188 PolarHBondContact O-N 3.23Å; T188-V226 HydrophobicContact CG2-CG2 4.43Å
189	T	84	Confident	77.5	Confident	127 Å²	127	107.1 Å²	107.1	78%	0.779	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-93.1	127.6	174.8	51.4	0	0	0	0	109.1	R187	R187-T189 PolarHBondContact O-N 3Å
190	I	89.1	Confident	79.4	Confident	50 Å²	50	105.2 Å²	105.2	26%	0.256	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-100.7	120.8	174.7	-61.1	170.8	0	0	0	106.8	Q194 L195 L198 L222 V226 W230	I190-Q194 HydrophobicContact CG2-CB 3.67Å; I190-L195 HydrophobicContact CG2-CB 4.23Å; I190-L198 HydrophobicContact CG2-CD1 4.25Å; I190-L222 HydrophobicContact CG1-CD1 4.38Å; I190-L222 HydrophobicContact CG1-CD2 4.49Å; I190-L222 HydrophobicContact CG2-CD1 4.14Å; I190-V226 HydrophobicContact CD1-CG1 4.04Å; I190-V226 HydrophobicContact CG1-CG1 4.26Å; I190-W230 HydrophobicContact CD1-CG 4.37Å
191	S	91.5	Very high	81.4	Confident	67 Å²	67	100.5 Å²	100.5	47%	0.469	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-61.1	154.5	178.9	173.7	0	0	0	0	111.9	K193 Q194 L195	S191-K193 VanDerWaalsContact C-N 3.27Å; S191-K193 PolarHBondContact O-N 2.83Å; S191-Q194 WeakPolarHBondContact O-CB 3.13Å; S191-Q194 PolarHBondContact O-N 3.37Å; S191-Q194 VanDerWaalsContact O-N 3.13Å; S191-L195 WeakPolarHBondContact O-CB 3.24Å; S191-L195 PolarHBondContact O-N 2.85Å
192	A	92.6	Very high	83.4	Confident	83 Å²	83	96.4 Å²	96.4	69%	0.686	50%	0.498	S	S	*	.	H	α-helix	trans	-54.9	-42.1	177.6	0	0	0	0	0	112.4	L195 E196	A192-L195 PolarHBondContact O-N 2.68Å; A192-E196 PolarHBondContact O-N 2.82Å
193	K	92.5	Very high	85.1	Confident	174 Å²	174	98.9 Å²	98.9	76%	0.757	50%	0.498	S	S	*	.	H	α-helix	trans	-62.7	-46	176.6	-174.2	179.3	179.3	-178.5	0	111.8	S191 L195 E196 T197	S191-K193 VanDerWaalsContact C-N 3.27Å; S191-K193 PolarHBondContact O-N 2.83Å; K193-L195 VanDerWaalsContact C-N 3.32Å; K193-L195 PolarHBondContact O-N 3.48Å; K193-E196 PolarHBondContact O-N 3.18Å; K193-T197 PolarHBondContact O-N 3.49Å; K193-T197 PolarHBondContact O-OG1 2.76Å
194	Q	95.2	Very high	86.9	Confident	44 Å²	44	98.8 Å²	98.8	21%	0.206	50%	0.502	C	S	.	.	H	α-helix	trans	-63.5	-39.9	177.6	-64.9	170.3	-36.7	0	0	111.2	I190 S191 E196 T197 L198 T220 L222	I190-Q194 HydrophobicContact CG2-CB 3.67Å; S191-Q194 WeakPolarHBondContact O-CB 3.13Å; S191-Q194 PolarHBondContact O-N 3.37Å; S191-Q194 VanDerWaalsContact O-N 3.13Å; Q194-E196 VanDerWaalsContact C-N 3.32Å; Q194-E196 PolarHBondContact O-N 3.44Å; Q194-T197 PolarHBondContact O-N 2.79Å; Q194-L198 WeakPolarHBondContact O-CG 3.25Å; Q194-L198 PolarHBondContact O-N 2.79Å; Q194-L198 VanDerWaalsContact O-N 3.14Å; Q194-T220 HydrophobicContact CB-CG2 4.42Å; Q194-T220 PolarHBondContact NE2-O 3.21Å; Q194-L222 HydrophobicContact CB-CD1 4.29Å
195	L	94.9	Very high	88.6	Confident	55 Å²	55	94.2 Å²	94.2	29%	0.288	49%	0.487	S	S	.	.	H	α-helix	trans	-65.4	-36.3	179	-175.6	63.4	0	0	0	112	I190 S191 A192 K193 L198 K199 W230	I190-L195 HydrophobicContact CG2-CB 4.23Å; S191-L195 WeakPolarHBondContact O-CB 3.24Å; S191-L195 PolarHBondContact O-N 2.85Å; A192-L195 PolarHBondContact O-N 2.68Å; K193-L195 VanDerWaalsContact C-N 3.32Å; K193-L195 PolarHBondContact O-N 3.48Å; L195-L198 PolarHBondContact O-N 2.73Å; L195-K199 HydrophobicContact CG-CD 4.31Å; L195-K199 WeakPolarHBondContact O-CB 3.34Å; L195-K199 VanDerWaalsContact O-CG 3.27Å; L195-K199 WeakPolarHBondContact O-CG 3.47Å; L195-K199 PolarHBondContact O-N 2.78Å; L195-W230 HydrophobicContact CD1-CZ2 3.85Å
196	E	95.2	Very high	90.3	Very high	88 Å²	88	85.6 Å²	85.6	41%	0.411	46%	0.462	S	S	.	.	H	α-helix	trans	-65	-48	177.8	-171.2	52.1	-142.7	0	0	111.5	A192 K193 Q194 L198 K199 Q200	A192-E196 PolarHBondContact O-N 2.82Å; K193-E196 PolarHBondContact O-N 3.18Å; Q194-E196 VanDerWaalsContact C-N 3.32Å; Q194-E196 PolarHBondContact O-N 3.44Å; E196-L198 VanDerWaalsContact C-N 3.3Å; E196-L198 PolarHBondContact O-N 3.4Å; E196-K199 WeakPolarHBondContact O-CB 2.93Å; E196-K199 PolarHBondContact O-N 2.72Å; E196-K199 VanDerWaalsContact O-N 3.1Å; E196-Q200 WeakPolarHBondContact O-CG 3.4Å; E196-Q200 PolarHBondContact O-N 3.48Å; E196-Q200 PolarHBondContact OE1-NE2 2.87Å
197	T	95.1	Very high	91.7	Very high	48 Å²	48	87.5 Å²	87.5	29%	0.294	46%	0.457	S	S	.	.	H	α-helix	trans	-56.3	-43.3	174	-50.7	0	0	0	0	112	K193 Q194 A201 L216 T220	K193-T197 PolarHBondContact O-N 3.49Å; K193-T197 PolarHBondContact O-OG1 2.76Å; Q194-T197 PolarHBondContact O-N 2.79Å; T197-A201 PolarHBondContact O-N 3.34Å; T197-A201 VanDerWaalsContact O-N 3.12Å; T197-L216 HydrophobicContact CG2-CD2 3.91Å; T197-T220 HydrophobicContact CG2-CG2 3.99Å
198	L	96.5	Very high	93	Very high	0 Å²	0	77.3 Å²	77.3	0%	0	42%	0.42	C	S	.	.	H	α-helix	trans	-66.4	-38.2	177	-70.4	171.6	0	0	0	112.6	I190 Q194 L195 E196 Y202 L222 V227 W230 F231	I190-L198 HydrophobicContact CG2-CD1 4.25Å; Q194-L198 WeakPolarHBondContact O-CG 3.25Å; Q194-L198 PolarHBondContact O-N 2.79Å; Q194-L198 VanDerWaalsContact O-N 3.14Å; L195-L198 PolarHBondContact O-N 2.73Å; E196-L198 VanDerWaalsContact C-N 3.3Å; E196-L198 PolarHBondContact O-N 3.4Å; L198-Y202 WeakPolarHBondContact O-CB 3.32Å; L198-Y202 PolarHBondContact O-N 3.31Å; L198-L222 HydrophobicContact CD1-CD1 3.9Å; L198-V227 HydrophobicContact CD2-CG1 4.03Å; L198-V227 HydrophobicContact CD2-CG2 4.44Å; L198-W230 HydrophobicContact CB-CD2 3.94Å; L198-W230 HydrophobicContact CB-CE3 3.93Å; L198-W230 HydrophobicContact CB-CH2 3.69Å; L198-W230 HydrophobicContact CB-CZ2 3.66Å; L198-W230 HydrophobicContact CB-CZ3 3.82Å; L198-W230 HydrophobicContact CD1-CB 4.4Å; L198-W230 HydrophobicContact CD1-CD2 3.85Å; L198-W230 HydrophobicContact CD1-CE3 4.42Å; L198-W230 HydrophobicContact CD1-CG 3.8Å; L198-W230 HydrophobicContact CD2-CE3 4.3Å; L198-W230 HydrophobicContact CG-CD2 4.33Å; L198-W230 HydrophobicContact CG-CE3 4.46Å; L198-W230 WeakPolarHBondContact O-CH2 3.34Å; L198-W230 WeakPolarHBondContact O-CZ3 3.48Å; L198-F231 HydrophobicContact CD2-CE2 3.97Å
199	K	95.6	Very high	93.8	Very high	81 Å²	81	74.8 Å²	74.8	35%	0.352	41%	0.409	S	S	.	.	H	α-helix	trans	-65.3	-44.6	176.7	-79.2	172.6	176.9	177.3	0	111.9	L195 E196 Y202 Q203 W230	L195-K199 HydrophobicContact CG-CD 4.31Å; L195-K199 WeakPolarHBondContact O-CB 3.34Å; L195-K199 VanDerWaalsContact O-CG 3.27Å; L195-K199 WeakPolarHBondContact O-CG 3.47Å; L195-K199 PolarHBondContact O-N 2.78Å; E196-K199 WeakPolarHBondContact O-CB 2.93Å; E196-K199 PolarHBondContact O-N 2.72Å; E196-K199 VanDerWaalsContact O-N 3.1Å; K199-Y202 WeakPolarHBondContact O-CB 3.45Å; K199-Y202 PolarHBondContact O-N 2.89Å; K199-Q203 PolarHBondContact O-N 3.25Å; K199-W230 HydrophobicContact CG-CH2 4.5Å; K199-W230 HydrophobicContact CG-CZ2 4.25Å
200	Q	95.6	Very high	94.3	Very high	102 Å²	102	77.2 Å²	77.2	48%	0.477	40%	0.404	S	S	.	.	H	α-helix	trans	-61.9	-46.6	177.3	-69.2	173	7.7	0	0	110.9	E196 Y202 Q203 V204	E196-Q200 WeakPolarHBondContact O-CG 3.4Å; E196-Q200 PolarHBondContact O-N 3.48Å; E196-Q200 PolarHBondContact OE1-NE2 2.87Å; Q200-Y202 VanDerWaalsContact C-N 3.26Å; Q200-Y202 PolarHBondContact O-N 3.09Å; Q200-Q203 WeakPolarHBondContact O-CB 3.49Å; Q200-Q203 PolarHBondContact O-N 2.96Å; Q200-Q203 VanDerWaalsContact O-N 3.13Å; Q200-V204 PolarHBondContact O-N 3.45Å
201	A	96	Very high	94.7	Very high	19 Å²	19	80.9 Å²	80.9	16%	0.157	42%	0.42	C	S	.	.	H	α-helix	trans	-61.9	-32.7	175.3	0	0	0	0	0	113.3	T197 V204 S205 L216 F231	T197-A201 PolarHBondContact O-N 3.34Å; T197-A201 VanDerWaalsContact O-N 3.12Å; A201-V204 PolarHBondContact O-N 3.14Å; A201-S205 PolarHBondContact O-N 3.01Å; A201-L216 HydrophobicContact CB-CD1 3.64Å; A201-L216 HydrophobicContact CB-CD2 3.78Å; A201-L216 HydrophobicContact CB-CG 4.32Å; A201-F231 HydrophobicContact CB-CZ 4.13Å
202	Y	96.3	Very high	94.9	Very high	14 Å²	14	80 Å²	80	6%	0.055	41%	0.412	C	S	.	.	H	α-helix	trans	-66.6	-34.7	175.2	-169.7	-93.1	0	0	0	113.4	L198 K199 Q200 V204 S205 P206 W230 F231 R234 R235 E238	L198-Y202 WeakPolarHBondContact O-CB 3.32Å; L198-Y202 PolarHBondContact O-N 3.31Å; K199-Y202 WeakPolarHBondContact O-CB 3.45Å; K199-Y202 PolarHBondContact O-N 2.89Å; Q200-Y202 VanDerWaalsContact C-N 3.26Å; Q200-Y202 PolarHBondContact O-N 3.09Å; Y202-V204 VanDerWaalsContact C-N 3.33Å; Y202-S205 CarbonylContact O-C 3.59Å; Y202-P206 HydrophobicContact CD2-CB 4.41Å; Y202-P206 HydrophobicContact CE1-CB 4.35Å; Y202-P206 HydrophobicContact CE1-CG 4.43Å; Y202-P206 HydrophobicContact CE2-CB 3.84Å; Y202-P206 WeakPolarHBondContact O-CD 3.39Å; Y202-W230 HydrophobicContact CD2-CZ3 4.11Å; Y202-W230 HydrophobicContact CG-CH2 4.48Å; Y202-W230 HydrophobicContact CG-CZ3 4.42Å; Y202-F231 AromaticContact CD2-CD1 3.71Å; Y202-F231 HydrophobicContact CD2-CD1 3.71Å; Y202-F231 AromaticContact CD2-CE1 3.8Å; Y202-F231 HydrophobicContact CD2-CE1 3.8Å; Y202-F231 HydrophobicContact CE2-CD1 4.35Å; Y202-F231 HydrophobicContact CG-CE1 4.46Å; Y202-R234 HydrophobicContact CD1-CG 4.15Å; Y202-R234 HydrophobicContact CD2-CB 4.26Å; Y202-R234 HydrophobicContact CD2-CG 3.59Å; Y202-R234 HydrophobicContact CE1-CG 3.94Å; Y202-R234 HydrophobicContact CE2-CB 3.95Å; Y202-R234 HydrophobicContact CE2-CG 3.34Å; Y202-R234 HydrophobicContact CG-CG 3.99Å; Y202-R235 HydrophobicContact CE2-CG 3.95Å; Y202-E238 PolarHBondContact OH-OE2 3.42Å
203	Q	94.3	Very high	95.1	Very high	165 Å²	165	78.9 Å²	78.9	77%	0.771	39%	0.39	S	S	*	.	H	α-helix	trans	-66.6	-37.3	176.1	-69.5	174.4	-10.4	0	0	111.5	K199 Q200	K199-Q203 PolarHBondContact O-N 3.25Å; Q200-Q203 WeakPolarHBondContact O-CB 3.49Å; Q200-Q203 PolarHBondContact O-N 2.96Å; Q200-Q203 VanDerWaalsContact O-N 3.13Å
204	V	95.1	Very high	95.3	Very high	130 Å²	130	74.5 Å²	74.5	79%	0.788	37%	0.372	S	S	*	.	H	α-helix	trans	-70.2	-48.3	175.5	-179.3	0	0	0	0	111.1	Q200 A201 Y202	Q200-V204 PolarHBondContact O-N 3.45Å; A201-V204 PolarHBondContact O-N 3.14Å; Y202-V204 VanDerWaalsContact C-N 3.33Å
205	S	92.7	Very high	95.3	Very high	43 Å²	43	80.9 Å²	80.9	30%	0.301	39%	0.394	S	S	.	.			trans	-149.5	114	177.8	-177	0	0	0	0	111.9	A201 Y202 K207 P208	A201-S205 PolarHBondContact O-N 3.01Å; Y202-S205 CarbonylContact O-C 3.59Å; S205-K207 PolarHBondContact O-N 2.96Å; S205-K207 VanDerWaalsContact OG-C 3.31Å; S205-K207 PolarHBondContact OG-N 3.39Å; S205-K207 PolarHBondContact OG-O 3.39Å; S205-P208 WeakPolarHBondContact O-CD 3.34Å
206	P	93.8	Very high	95.4	Very high	56 Å²	56	78.9 Å²	78.9	36%	0.364	38%	0.384	S	S	.	.	S	Bend	trans	-64.4	-17.2	172.2	-25.5	35.4	0	0	0	114.1	Y202 R235	Y202-P206 HydrophobicContact CD2-CB 4.41Å; Y202-P206 HydrophobicContact CE1-CB 4.35Å; Y202-P206 HydrophobicContact CE1-CG 4.43Å; Y202-P206 HydrophobicContact CE2-CB 3.84Å; Y202-P206 WeakPolarHBondContact O-CD 3.39Å; P206-R235 WeakPolarHBondContact O-CD 3.33Å; P206-R235 PolarHBondContact O-NH1 3.32Å
207	K	94.6	Very high	95.4	Very high	166 Å²	166	75.2 Å²	75.2	72%	0.722	37%	0.369	S	S	*	.	S	Bend	trans	-128.7	68.5	179.7	-68.1	-177.2	-179.8	177	0	109.8	S205	S205-K207 PolarHBondContact O-N 2.96Å; S205-K207 VanDerWaalsContact OG-C 3.31Å; S205-K207 PolarHBondContact OG-N 3.39Å; S205-K207 PolarHBondContact OG-O 3.39Å
208	P	94.2	Very high	95.5	Very high	9 Å²	9	80.3 Å²	80.3	6%	0.058	39%	0.389	C	S	.	.			trans	-63.1	139.1	-176.4	27.9	-36.3	0	0	0	111.4	S205 V212 R213 F231	S205-P208 WeakPolarHBondContact O-CD 3.34Å; P208-V212 HydrophobicContact CB-CB 3.92Å; P208-V212 HydrophobicContact CB-CG1 3.82Å; P208-R213 HydrophobicContact CB-CG 4.04Å; P208-R213 HydrophobicContact CG-CG 3.62Å; P208-R213 PolarHBondContact O-NE 3.42Å; P208-F231 VanDerWaalsContact CD-CD1 3.46Å; P208-F231 HydrophobicContact CG-CD1 3.68Å; P208-F231 HydrophobicContact CG-CD2 4.03Å; P208-F231 HydrophobicContact CG-CE1 3.55Å; P208-F231 HydrophobicContact CG-CE2 3.94Å; P208-F231 HydrophobicContact CG-CG 3.94Å; P208-F231 HydrophobicContact CG-CZ 3.71Å
209	A	96	Very high	95.4	Very high	49 Å²	49	85 Å²	85	41%	0.405	41%	0.414	S	S	.	.			trans	-60.1	163.1	173	0	0	0	0	0	111.1	H211 V212 R213	A209-H211 VanDerWaalsContact C-N 3.34Å; A209-H211 PolarHBondContact O-N 3Å; A209-V212 HydrophobicContact CB-CG2 4.4Å; A209-V212 PolarHBondContact O-N 3.31Å; A209-V212 VanDerWaalsContact O-N 3.16Å; A209-R213 PolarHBondContact O-N 2.85Å; A209-R213 VanDerWaalsContact O-N 3.12Å
210	R	94.5	Very high	95.3	Very high	179 Å²	179	81.7 Å²	81.7	68%	0.675	40%	0.401	S	S	*	.	H	α-helix	trans	-53.4	-48.9	-177.8	179.9	179.6	171	-172.2	-2.7	112.3	V212 R213 E214	R210-V212 VanDerWaalsContact C-N 3.31Å; R210-V212 PolarHBondContact O-N 3.46Å; R210-R213 WeakPolarHBondContact O-CB 3.28Å; R210-R213 PolarHBondContact O-N 3.07Å; R210-R213 VanDerWaalsContact O-N 3.09Å; R210-E214 HydrophobicContact CG-CG 4.47Å; R210-E214 IonicContact CZ-OE1 3.64Å; R210-E214 IonicContact NE-OE1 2.95Å; R210-E214 PolarHBondContact NE-OE1 3.01Å; R210-E214 IonicContact NH2-OE1 2.66Å; R210-E214 PolarHBondContact NH2-OE1 2.75Å; R210-E214 VanDerWaalsContact NH2-OE1 3.15Å; R210-E214 PolarHBondContact O-N 3.31Å
211	H	96.3	Very high	95.3	Very high	126 Å²	126	80 Å²	80	58%	0.583	41%	0.411	S	S	*	.	H	α-helix	trans	-61.3	-36.5	-179.4	68.9	-93.6	0	0	0	113	A209 E214 R215	A209-H211 VanDerWaalsContact C-N 3.34Å; A209-H211 PolarHBondContact O-N 3Å; H211-E214 PolarHBondContact O-N 3.46Å; H211-R215 PolarHBondContact O-N 2.56Å
212	V	95.9	Very high	95.1	Very high	50 Å²	50	80.3 Å²	80.3	30%	0.303	41%	0.409	S	S	.	.	H	α-helix	trans	-66.3	-41.3	176.1	-178	0	0	0	0	110.3	P208 A209 R210 E214 R215 L216	P208-V212 HydrophobicContact CB-CB 3.92Å; P208-V212 HydrophobicContact CB-CG1 3.82Å; A209-V212 HydrophobicContact CB-CG2 4.4Å; A209-V212 PolarHBondContact O-N 3.31Å; A209-V212 VanDerWaalsContact O-N 3.16Å; R210-V212 VanDerWaalsContact C-N 3.31Å; R210-V212 PolarHBondContact O-N 3.46Å; V212-E214 VanDerWaalsContact C-N 3.33Å; V212-R215 PolarHBondContact O-N 3.34Å; V212-L216 HydrophobicContact CG1-CD1 4.15Å; V212-L216 VanDerWaalsContact O-CG 3.29Å; V212-L216 WeakPolarHBondContact O-CG 3.41Å; V212-L216 PolarHBondContact O-N 2.89Å
213	R	96.2	Very high	95	Very high	59 Å²	59	84.6 Å²	84.6	22%	0.223	43%	0.434	C	S	.	.	H	α-helix	trans	-66	-36	175.6	-70	-173.3	-82.1	145.4	-2.7	112.3	P208 A209 R210 L216 A217 M224 V227	P208-R213 HydrophobicContact CB-CG 4.04Å; P208-R213 HydrophobicContact CG-CG 3.62Å; P208-R213 PolarHBondContact O-NE 3.42Å; A209-R213 PolarHBondContact O-N 2.85Å; A209-R213 VanDerWaalsContact O-N 3.12Å; R210-R213 WeakPolarHBondContact O-CB 3.28Å; R210-R213 PolarHBondContact O-N 3.07Å; R210-R213 VanDerWaalsContact O-N 3.09Å; R213-L216 PolarHBondContact O-N 3.39Å; R213-A217 WeakPolarHBondContact O-CB 3.28Å; R213-A217 PolarHBondContact O-N 2.83Å; R213-M224 HydrophobicContact CB-CE 4.28Å; R213-M224 HydrophobicContact CB-SD 4Å; R213-V227 HydrophobicContact CB-CG1 4.35Å; R213-V227 HydrophobicContact CG-CG1 4.37Å
214	E	96.7	Very high	95	Very high	82 Å²	82	79.6 Å²	79.6	38%	0.383	41%	0.411	S	S	.	.	H	α-helix	trans	-65.2	-45	176.4	-74.9	168.4	170	0	0	110.8	R210 H211 V212 A217 H218 M224	R210-E214 HydrophobicContact CG-CG 4.47Å; R210-E214 IonicContact CZ-OE1 3.64Å; R210-E214 IonicContact NE-OE1 2.95Å; R210-E214 PolarHBondContact NE-OE1 3.01Å; R210-E214 IonicContact NH2-OE1 2.66Å; R210-E214 PolarHBondContact NH2-OE1 2.75Å; R210-E214 VanDerWaalsContact NH2-OE1 3.15Å; R210-E214 PolarHBondContact O-N 3.31Å; H211-E214 PolarHBondContact O-N 3.46Å; V212-E214 VanDerWaalsContact C-N 3.33Å; E214-A217 PolarHBondContact O-N 3.34Å; E214-H218 PolarHBondContact O-N 2.81Å; E214-M224 HydrophobicContact CB-CE 3.89Å; E214-M224 HydrophobicContact CG-CE 3.23Å
215	R	96.1	Very high	94.9	Very high	177 Å²	177	81.4 Å²	81.4	67%	0.668	40%	0.403	S	S	*	.	H	α-helix	trans	-60.4	-46.7	172.5	-174	179.5	-67.1	-164.4	-1.6	112.1	H211 V212 A217 H218 D219	H211-R215 PolarHBondContact O-N 2.56Å; V212-R215 PolarHBondContact O-N 3.34Å; R215-A217 VanDerWaalsContact C-N 3.34Å; R215-A217 PolarHBondContact O-N 3.43Å; R215-H218 WeakPolarHBondContact O-CB 3.36Å; R215-H218 PolarHBondContact O-N 3.41Å; R215-D219 WeakPolarHBondContact CG-OD2 3.42Å; R215-D219 WeakPolarHBondContact O-CB 3.27Å; R215-D219 PolarHBondContact O-N 3.36Å
216	L	96.5	Very high	95	Very high	13 Å²	13	80.6 Å²	80.6	7%	0.068	40%	0.397	C	S	.	.	H	α-helix	trans	-62.8	-39	178.3	-71.6	168.7	0	0	0	112.8	T197 A201 V212 R213 H218 D219 T220 V227 F231	T197-L216 HydrophobicContact CG2-CD2 3.91Å; A201-L216 HydrophobicContact CB-CD1 3.64Å; A201-L216 HydrophobicContact CB-CD2 3.78Å; A201-L216 HydrophobicContact CB-CG 4.32Å; V212-L216 HydrophobicContact CG1-CD1 4.15Å; V212-L216 VanDerWaalsContact O-CG 3.29Å; V212-L216 WeakPolarHBondContact O-CG 3.41Å; V212-L216 PolarHBondContact O-N 2.89Å; R213-L216 PolarHBondContact O-N 3.39Å; L216-H218 VanDerWaalsContact C-N 3.35Å; L216-D219 PolarHBondContact O-N 3.22Å; L216-T220 VanDerWaalsContact O-CB 3.3Å; L216-T220 WeakPolarHBondContact O-CB 3.5Å; L216-T220 WeakPolarHBondContact O-CG2 3.39Å; L216-T220 PolarHBondContact O-N 2.82Å; L216-T220 PolarHBondContact O-OG1 3.02Å; L216-V227 HydrophobicContact CB-CG1 4.15Å; L216-F231 HydrophobicContact CD1-CE2 3.74Å; L216-F231 HydrophobicContact CD1-CZ 3.84Å
217	A	96.6	Very high	95.1	Very high	12 Å²	12	77.9 Å²	77.9	10%	0.099	38%	0.379	C	S	.	.	H	α-helix	trans	-61.5	-45.9	175.8	0	0	0	0	0	111	R213 E214 R215 G221 L222 M224 V227	R213-A217 WeakPolarHBondContact O-CB 3.28Å; R213-A217 PolarHBondContact O-N 2.83Å; E214-A217 PolarHBondContact O-N 3.34Å; R215-A217 VanDerWaalsContact C-N 3.34Å; R215-A217 PolarHBondContact O-N 3.43Å; A217-G221 WeakPolarHBondContact O-CA 3.4Å; A217-G221 PolarHBondContact O-N 3.39Å; A217-L222 WeakPolarHBondContact CA-O 3.17Å; A217-L222 WeakPolarHBondContact CB-O 3.39Å; A217-L222 PolarHBondContact O-N 3.5Å; A217-L222 VanDerWaalsContact O-N 3.13Å; A217-M224 HydrophobicContact CB-CE 4.15Å; A217-V227 HydrophobicContact CB-CG2 3.98Å
218	H	96.1	Very high	95.1	Very high	155 Å²	155	73 Å²	73	72%	0.718	36%	0.359	S	S	*	.	H	α-helix	trans	-60.5	-52.4	174.4	177.3	-87.9	0	0	0	112	E214 R215 L216 T220 G221	E214-H218 PolarHBondContact O-N 2.81Å; R215-H218 WeakPolarHBondContact O-CB 3.36Å; R215-H218 PolarHBondContact O-N 3.41Å; L216-H218 VanDerWaalsContact C-N 3.35Å; H218-T220 VanDerWaalsContact C-N 3.33Å; H218-T220 PolarHBondContact O-N 3.07Å; H218-G221 PolarHBondContact O-N 3.43Å
219	D	94.7	Very high	95.2	Very high	98 Å²	98	74.8 Å²	74.8	52%	0.524	37%	0.37	S	S	.	.	H	α-helix	trans	-69	-30.6	-174.2	-63.3	-9.5	0	0	0	112.9	R215 L216	R215-D219 WeakPolarHBondContact CG-OD2 3.42Å; R215-D219 WeakPolarHBondContact O-CB 3.27Å; R215-D219 PolarHBondContact O-N 3.36Å; L216-D219 PolarHBondContact O-N 3.22Å
220	T	94.1	Very high	95.2	Very high	12 Å²	12	73.9 Å²	73.9	7%	0.074	36%	0.356	C	S	.	.	H	α-helix	trans	-90.9	-11.9	177.5	60.9	0	0	0	0	113.5	Q194 T197 L216 H218 L222	Q194-T220 HydrophobicContact CB-CG2 4.42Å; Q194-T220 PolarHBondContact NE2-O 3.21Å; T197-T220 HydrophobicContact CG2-CG2 3.99Å; L216-T220 VanDerWaalsContact O-CB 3.3Å; L216-T220 WeakPolarHBondContact O-CB 3.5Å; L216-T220 WeakPolarHBondContact O-CG2 3.39Å; L216-T220 PolarHBondContact O-N 2.82Å; L216-T220 PolarHBondContact O-OG1 3.02Å; H218-T220 VanDerWaalsContact C-N 3.33Å; H218-T220 PolarHBondContact O-N 3.07Å; T220-L222 PolarHBondContact O-N 3.4Å; T220-L222 WeakPolarHBondContact OG1-CB 3.32Å; T220-L222 WeakPolarHBondContact OG1-CD1 3.34Å; T220-L222 WeakPolarHBondContact OG1-CG 3.46Å; T220-L222 PolarHBondContact OG1-N 2.83Å
221	G	94.1	Very high	95.3	Very high	67 Å²	67	65.4 Å²	65.4	69%	0.691	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	22.7	-170.9	0	0	0	0	0	113.5	A217 H218	A217-G221 WeakPolarHBondContact O-CA 3.4Å; A217-G221 PolarHBondContact O-N 3.39Å; H218-G221 PolarHBondContact O-N 3.43Å
222	L	93.3	Very high	95.2	Very high	24 Å²	24	63.6 Å²	63.6	13%	0.126	32%	0.316	C	S	.	.			trans	-96.6	147.2	178.3	-64.4	175.5	0	0	0	110.3	I190 Q194 L198 A217 T220 V226 V227	I190-L222 HydrophobicContact CG1-CD1 4.38Å; I190-L222 HydrophobicContact CG1-CD2 4.49Å; I190-L222 HydrophobicContact CG2-CD1 4.14Å; Q194-L222 HydrophobicContact CB-CD1 4.29Å; L198-L222 HydrophobicContact CD1-CD1 3.9Å; A217-L222 WeakPolarHBondContact CA-O 3.17Å; A217-L222 WeakPolarHBondContact CB-O 3.39Å; A217-L222 PolarHBondContact O-N 3.5Å; A217-L222 VanDerWaalsContact O-N 3.13Å; T220-L222 PolarHBondContact O-N 3.4Å; T220-L222 WeakPolarHBondContact OG1-CB 3.32Å; T220-L222 WeakPolarHBondContact OG1-CD1 3.34Å; T220-L222 WeakPolarHBondContact OG1-CG 3.46Å; T220-L222 PolarHBondContact OG1-N 2.83Å; L222-V226 HydrophobicContact CB-CB 4.42Å; L222-V226 HydrophobicContact CB-CG1 4.37Å; L222-V226 HydrophobicContact CD1-CG1 4.29Å; L222-V226 HydrophobicContact CD2-CG1 4.29Å; L222-V227 HydrophobicContact CB-CG2 3.97Å; L222-V227 HydrophobicContact CD1-CG2 4.49Å
223	D	93.9	Very high	95.2	Very high	105 Å²	105	65.9 Å²	65.9	56%	0.561	33%	0.326	S	S	*	.			trans	-59	140.9	171.5	-173.4	-77.6	0	0	0	110.8	R225 V226 V227	D223-R225 PolarHBondContact O-N 2.83Å; D223-R225 VanDerWaalsContact O-N 3.09Å; D223-R225 WeakPolarHBondContact OD1-CA 3.46Å; D223-R225 WeakPolarHBondContact OD1-CB 3.32Å; D223-R225 PolarHBondContact OD1-N 3.41Å; D223-V226 HydrophobicContact CB-CB 4.43Å; D223-V226 HydrophobicContact CB-CG2 4Å; D223-V226 WeakPolarHBondContact O-CA 3.34Å; D223-V226 WeakPolarHBondContact O-CB 3.28Å; D223-V226 PolarHBondContact O-N 3.13Å; D223-V227 PolarHBondContact O-N 3.2Å
224	M	94	Very high	95.1	Very high	60 Å²	60	67.2 Å²	67.2	30%	0.296	33%	0.331	S	S	.	.	H	α-helix	trans	-47.6	-40.4	176.5	170.8	53.2	60.8	0	0	112.4	R213 E214 A217 V227 Q228	R213-M224 HydrophobicContact CB-CE 4.28Å; R213-M224 HydrophobicContact CB-SD 4Å; E214-M224 HydrophobicContact CB-CE 3.89Å; E214-M224 HydrophobicContact CG-CE 3.23Å; A217-M224 HydrophobicContact CB-CE 4.15Å; M224-V227 PolarHBondContact O-N 3.29Å; M224-Q228 WeakPolarHBondContact O-CB 3.48Å; M224-Q228 PolarHBondContact O-N 2.96Å
225	R	93.8	Very high	95	Very high	167 Å²	167	67 Å²	67	63%	0.63	33%	0.327	S	S	*	.	H	α-helix	trans	-66.5	-38.6	177.4	-174.3	164.2	179.9	73.6	1.2	111.7	D223 Q228 V229	D223-R225 PolarHBondContact O-N 2.83Å; D223-R225 VanDerWaalsContact O-N 3.09Å; D223-R225 WeakPolarHBondContact OD1-CA 3.46Å; D223-R225 WeakPolarHBondContact OD1-CB 3.32Å; D223-R225 PolarHBondContact OD1-N 3.41Å; R225-Q228 PolarHBondContact O-N 3.18Å; R225-V229 HydrophobicContact CG-CG2 4.18Å; R225-V229 VanDerWaalsContact O-CB 3.28Å; R225-V229 WeakPolarHBondContact O-CB 3.19Å; R225-V229 WeakPolarHBondContact O-CG2 3.48Å; R225-V229 PolarHBondContact O-N 3.31Å
226	V	94.6	Very high	94.8	Very high	26 Å²	26	60.7 Å²	60.7	16%	0.158	31%	0.312	C	S	.	.	H	α-helix	trans	-63.7	-45.3	176.3	176.3	0	0	0	0	110.2	T188 I190 L222 D223 V229 W230	T188-V226 HydrophobicContact CG2-CG2 4.43Å; I190-V226 HydrophobicContact CD1-CG1 4.04Å; I190-V226 HydrophobicContact CG1-CG1 4.26Å; L222-V226 HydrophobicContact CB-CB 4.42Å; L222-V226 HydrophobicContact CB-CG1 4.37Å; L222-V226 HydrophobicContact CD1-CG1 4.29Å; L222-V226 HydrophobicContact CD2-CG1 4.29Å; D223-V226 HydrophobicContact CB-CB 4.43Å; D223-V226 HydrophobicContact CB-CG2 4Å; D223-V226 WeakPolarHBondContact O-CA 3.34Å; D223-V226 WeakPolarHBondContact O-CB 3.28Å; D223-V226 PolarHBondContact O-N 3.13Å; V226-V229 PolarHBondContact O-N 3.42Å; V226-W230 WeakPolarHBondContact O-CB 3.44Å; V226-W230 PolarHBondContact O-N 3.14Å
227	V	95.4	Very high	94.5	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-60.8	-48.8	175	178.2	0	0	0	0	110.7	L198 R213 L216 A217 L222 D223 M224 V229 W230 F231	L198-V227 HydrophobicContact CD2-CG1 4.03Å; L198-V227 HydrophobicContact CD2-CG2 4.44Å; R213-V227 HydrophobicContact CB-CG1 4.35Å; R213-V227 HydrophobicContact CG-CG1 4.37Å; L216-V227 HydrophobicContact CB-CG1 4.15Å; A217-V227 HydrophobicContact CB-CG2 3.98Å; L222-V227 HydrophobicContact CB-CG2 3.97Å; L222-V227 HydrophobicContact CD1-CG2 4.49Å; D223-V227 PolarHBondContact O-N 3.2Å; M224-V227 PolarHBondContact O-N 3.29Å; V227-V229 PolarHBondContact O-N 3.02Å; V227-W230 WeakPolarHBondContact O-CB 3.34Å; V227-W230 PolarHBondContact O-N 3.03Å; V227-F231 HydrophobicContact CG1-CD2 3.97Å; V227-F231 HydrophobicContact CG1-CE2 3.92Å; V227-F231 WeakPolarHBondContact O-CD2 3.39Å; V227-F231 PolarHBondContact O-N 3.5Å
228	Q	95.3	Very high	94.2	Very high	64 Å²	64	69 Å²	69	30%	0.299	35%	0.347	S	S	.	.	H	α-helix	trans	-58.5	-47.1	177.7	176.7	170.1	-29.9	0	0	112.6	M224 R225 W230 F231 Q232	M224-Q228 WeakPolarHBondContact O-CB 3.48Å; M224-Q228 PolarHBondContact O-N 2.96Å; R225-Q228 PolarHBondContact O-N 3.18Å; Q228-W230 VanDerWaalsContact C-N 3.31Å; Q228-W230 PolarHBondContact O-N 3.1Å; Q228-F231 PolarHBondContact O-N 2.91Å; Q228-Q232 VanDerWaalsContact O-CG 3.32Å; Q228-Q232 WeakPolarHBondContact O-CG 3.42Å; Q228-Q232 PolarHBondContact O-N 3.31Å
229	V	94.8	Very high	93.8	Very high	46 Å²	46	69.4 Å²	69.4	28%	0.279	35%	0.347	S	S	.	.	H	α-helix	trans	-65.3	-36.2	178.3	169.5	0	0	0	0	110.7	R225 V226 V227 Q232 N233	R225-V229 HydrophobicContact CG-CG2 4.18Å; R225-V229 VanDerWaalsContact O-CB 3.28Å; R225-V229 WeakPolarHBondContact O-CB 3.19Å; R225-V229 WeakPolarHBondContact O-CG2 3.48Å; R225-V229 PolarHBondContact O-N 3.31Å; V226-V229 PolarHBondContact O-N 3.42Å; V227-V229 PolarHBondContact O-N 3.02Å; V229-Q232 PolarHBondContact O-N 3.03Å; V229-N233 WeakPolarHBondContact CG1-ND2 3.38Å; V229-N233 VanDerWaalsContact O-CB 3.28Å; V229-N233 WeakPolarHBondContact O-CB 3.5Å; V229-N233 PolarHBondContact O-N 3.46Å; V229-N233 PolarHBondContact O-ND2 3.33Å
230	W	95.9	Very high	93.3	Very high	29 Å²	29	73.2 Å²	73.2	11%	0.11	35%	0.354	C	S	.	.	H	α-helix	trans	-60.9	-49	175.1	-174.9	95.7	0	0	0	111.6	I190 L195 L198 K199 Y202 V226 V227 Q228 Q232 N233 R234	I190-W230 HydrophobicContact CD1-CG 4.37Å; L195-W230 HydrophobicContact CD1-CZ2 3.85Å; L198-W230 HydrophobicContact CB-CD2 3.94Å; L198-W230 HydrophobicContact CB-CE3 3.93Å; L198-W230 HydrophobicContact CB-CH2 3.69Å; L198-W230 HydrophobicContact CB-CZ2 3.66Å; L198-W230 HydrophobicContact CB-CZ3 3.82Å; L198-W230 HydrophobicContact CD1-CB 4.4Å; L198-W230 HydrophobicContact CD1-CD2 3.85Å; L198-W230 HydrophobicContact CD1-CE3 4.42Å; L198-W230 HydrophobicContact CD1-CG 3.8Å; L198-W230 HydrophobicContact CD2-CE3 4.3Å; L198-W230 HydrophobicContact CG-CD2 4.33Å; L198-W230 HydrophobicContact CG-CE3 4.46Å; L198-W230 WeakPolarHBondContact O-CH2 3.34Å; L198-W230 WeakPolarHBondContact O-CZ3 3.48Å; K199-W230 HydrophobicContact CG-CH2 4.5Å; K199-W230 HydrophobicContact CG-CZ2 4.25Å; Y202-W230 HydrophobicContact CD2-CZ3 4.11Å; Y202-W230 HydrophobicContact CG-CH2 4.48Å; Y202-W230 HydrophobicContact CG-CZ3 4.42Å; V226-W230 WeakPolarHBondContact O-CB 3.44Å; V226-W230 PolarHBondContact O-N 3.14Å; V227-W230 WeakPolarHBondContact O-CB 3.34Å; V227-W230 PolarHBondContact O-N 3.03Å; Q228-W230 VanDerWaalsContact C-N 3.31Å; Q228-W230 PolarHBondContact O-N 3.1Å; W230-Q232 VanDerWaalsContact C-N 3.33Å; W230-Q232 PolarHBondContact O-N 3.48Å; W230-N233 PolarHBondContact O-N 2.86Å; W230-R234 HydrophobicContact CE3-CB 4.42Å; W230-R234 HydrophobicContact CH2-CB 4.47Å; W230-R234 HydrophobicContact CH2-CG 4.23Å; W230-R234 HydrophobicContact CZ3-CB 4.3Å; W230-R234 HydrophobicContact CZ3-CG 4.38Å; W230-R234 VanDerWaalsContact O-CB 3.28Å; W230-R234 WeakPolarHBondContact O-CB 3.46Å; W230-R234 PolarHBondContact O-N 3.13Å
231	F	97	Very high	92.5	Very high	2 Å²	2	77.8 Å²	77.8	1%	0.009	38%	0.375	C	S	.	.	H	α-helix	trans	-64	-37.8	177.1	-85.1	-86.4	0	0	0	112.2	L198 A201 Y202 P208 L216 V227 Q228 R235	L198-F231 HydrophobicContact CD2-CE2 3.97Å; A201-F231 HydrophobicContact CB-CZ 4.13Å; Y202-F231 AromaticContact CD2-CD1 3.71Å; Y202-F231 HydrophobicContact CD2-CD1 3.71Å; Y202-F231 AromaticContact CD2-CE1 3.8Å; Y202-F231 HydrophobicContact CD2-CE1 3.8Å; Y202-F231 HydrophobicContact CE2-CD1 4.35Å; Y202-F231 HydrophobicContact CG-CE1 4.46Å; P208-F231 VanDerWaalsContact CD-CD1 3.46Å; P208-F231 HydrophobicContact CG-CD1 3.68Å; P208-F231 HydrophobicContact CG-CD2 4.03Å; P208-F231 HydrophobicContact CG-CE1 3.55Å; P208-F231 HydrophobicContact CG-CE2 3.94Å; P208-F231 HydrophobicContact CG-CG 3.94Å; P208-F231 HydrophobicContact CG-CZ 3.71Å; L216-F231 HydrophobicContact CD1-CE2 3.74Å; L216-F231 HydrophobicContact CD1-CZ 3.84Å; V227-F231 HydrophobicContact CG1-CD2 3.97Å; V227-F231 HydrophobicContact CG1-CE2 3.92Å; V227-F231 WeakPolarHBondContact O-CD2 3.39Å; V227-F231 PolarHBondContact O-N 3.5Å; Q228-F231 PolarHBondContact O-N 2.91Å; F231-R235 WeakPolarHBondContact O-CG 3.12Å; F231-R235 PolarHBondContact O-N 3.3Å
232	Q	94.8	Very high	91.7	Very high	88 Å²	88	81.7 Å²	81.7	41%	0.411	37%	0.373	S	S	.	.	H	α-helix	trans	-62.7	-49.5	174.2	-73	177.7	7.6	0	0	111.6	Q228 V229 W230 R234 R235 A236	Q228-Q232 VanDerWaalsContact O-CG 3.32Å; Q228-Q232 WeakPolarHBondContact O-CG 3.42Å; Q228-Q232 PolarHBondContact O-N 3.31Å; V229-Q232 PolarHBondContact O-N 3.03Å; W230-Q232 VanDerWaalsContact C-N 3.33Å; W230-Q232 PolarHBondContact O-N 3.48Å; Q232-R234 VanDerWaalsContact C-N 3.33Å; Q232-R234 PolarHBondContact O-N 3.32Å; Q232-R235 PolarHBondContact O-N 3.29Å; Q232-A236 WeakPolarHBondContact O-CB 3.3Å; Q232-A236 PolarHBondContact O-N 3.42Å
233	N	95.3	Very high	90.4	Very high	97 Å²	97	87.4 Å²	87.4	52%	0.519	40%	0.397	S	S	.	.	H	α-helix	trans	-64.3	-38	179.1	-72.9	-16.8	0	0	0	111.8	V229 W230 A236 K237	V229-N233 WeakPolarHBondContact CG1-ND2 3.38Å; V229-N233 VanDerWaalsContact O-CB 3.28Å; V229-N233 WeakPolarHBondContact O-CB 3.5Å; V229-N233 PolarHBondContact O-N 3.46Å; V229-N233 PolarHBondContact O-ND2 3.33Å; W230-N233 PolarHBondContact O-N 2.86Å; N233-A236 PolarHBondContact O-N 3.29Å; N233-K237 WeakPolarHBondContact O-CB 3.41Å; N233-K237 PolarHBondContact O-N 2.98Å
234	R	94	Very high	88.9	Confident	88 Å²	88	85.8 Å²	85.8	33%	0.332	39%	0.388	S	S	.	.	H	α-helix	trans	-63.1	-48.6	176.5	-178.6	59.3	-179.5	-99.5	2.4	111.5	Y202 W230 Q232 A236 K237 E238	Y202-R234 HydrophobicContact CD1-CG 4.15Å; Y202-R234 HydrophobicContact CD2-CB 4.26Å; Y202-R234 HydrophobicContact CD2-CG 3.59Å; Y202-R234 HydrophobicContact CE1-CG 3.94Å; Y202-R234 HydrophobicContact CE2-CB 3.95Å; Y202-R234 HydrophobicContact CE2-CG 3.34Å; Y202-R234 HydrophobicContact CG-CG 3.99Å; W230-R234 HydrophobicContact CE3-CB 4.42Å; W230-R234 HydrophobicContact CH2-CB 4.47Å; W230-R234 HydrophobicContact CH2-CG 4.23Å; W230-R234 HydrophobicContact CZ3-CB 4.3Å; W230-R234 HydrophobicContact CZ3-CG 4.38Å; W230-R234 VanDerWaalsContact O-CB 3.28Å; W230-R234 WeakPolarHBondContact O-CB 3.46Å; W230-R234 PolarHBondContact O-N 3.13Å; Q232-R234 VanDerWaalsContact C-N 3.33Å; Q232-R234 PolarHBondContact O-N 3.32Å; R234-A236 VanDerWaalsContact C-N 3.33Å; R234-A236 PolarHBondContact O-N 3.18Å; R234-K237 PolarHBondContact O-N 3.4Å; R234-E238 PolarHBondContact O-N 3.34Å
235	R	95.3	Very high	87.4	Confident	77 Å²	77	89 Å²	89	29%	0.291	41%	0.407	S	S	.	.	H	α-helix	trans	-62.5	-39.1	174.1	-70.9	-168.4	-58.8	-88.7	-2.6	112.2	Y202 P206 F231 Q232 E238 K239	Y202-R235 HydrophobicContact CE2-CG 3.95Å; P206-R235 WeakPolarHBondContact O-CD 3.33Å; P206-R235 PolarHBondContact O-NH1 3.32Å; F231-R235 WeakPolarHBondContact O-CG 3.12Å; F231-R235 PolarHBondContact O-N 3.3Å; Q232-R235 PolarHBondContact O-N 3.29Å; R235-E238 PolarHBondContact O-N 2.91Å; R235-K239 WeakPolarHBondContact O-CB 3.33Å; R235-K239 PolarHBondContact O-N 3.06Å
236	A	91.9	Very high	85.3	Confident	44 Å²	44	83.8 Å²	83.8	36%	0.364	40%	0.396	S	S	.	.	H	α-helix	trans	-64.2	-41.9	177.3	0	0	0	0	0	111.7	Q232 N233 R234 K239 R240	Q232-A236 WeakPolarHBondContact O-CB 3.3Å; Q232-A236 PolarHBondContact O-N 3.42Å; N233-A236 PolarHBondContact O-N 3.29Å; R234-A236 VanDerWaalsContact C-N 3.33Å; R234-A236 PolarHBondContact O-N 3.18Å; A236-K239 PolarHBondContact O-N 2.82Å; A236-R240 WeakPolarHBondContact O-CG 3.42Å; A236-R240 PolarHBondContact O-N 2.75Å
237	K	90.6	Very high	83.4	Confident	130 Å²	130	90 Å²	90	57%	0.565	42%	0.417	S	S	*	.	H	α-helix	trans	-62.8	-46.5	174.9	-171.5	176	-177.8	179.4	0	111	N233 R234 K239 R240 M241	N233-K237 WeakPolarHBondContact O-CB 3.41Å; N233-K237 PolarHBondContact O-N 2.98Å; R234-K237 PolarHBondContact O-N 3.4Å; K237-K239 VanDerWaalsContact C-N 3.31Å; K237-K239 PolarHBondContact O-N 3.09Å; K237-R240 PolarHBondContact O-N 3.12Å; K237-R240 VanDerWaalsContact O-N 3.14Å; K237-M241 WeakPolarHBondContact O-CG 3.35Å; K237-M241 PolarHBondContact O-N 3.49Å
238	E	88.8	Confident	81.4	Confident	71 Å²	71	96.5 Å²	96.5	33%	0.332	45%	0.447	S	S	.	.	H	α-helix	trans	-60.5	-40.2	177.2	-164.6	-171.5	151.2	0	0	112.2	Y202 R234 R235 M241 K242	Y202-E238 PolarHBondContact OH-OE2 3.42Å; R234-E238 PolarHBondContact O-N 3.34Å; R235-E238 PolarHBondContact O-N 2.91Å; E238-M241 PolarHBondContact O-N 2.62Å; E238-K242 WeakPolarHBondContact O-CG 3.4Å; E238-K242 PolarHBondContact O-N 2.93Å; E238-K242 VanDerWaalsContact O-N 3.09Å; E238-K242 IonicContact OE1-NZ 3.88Å; E238-K242 PolarHBondContact OE1-NZ 3.37Å
239	K	87.8	Confident	79.2	Confident	163 Å²	163	100.7 Å²	100.7	71%	0.709	46%	0.464	S	S	*	.	H	α-helix	trans	-65.3	-36.3	175	-173.6	177	179.9	178.6	0	112.6	R235 A236 K237 K243	R235-K239 WeakPolarHBondContact O-CB 3.33Å; R235-K239 PolarHBondContact O-N 3.06Å; A236-K239 PolarHBondContact O-N 2.82Å; K237-K239 VanDerWaalsContact C-N 3.31Å; K237-K239 PolarHBondContact O-N 3.09Å; K239-K243 PolarHBondContact O-N 3.35Å
240	R	85.5	Confident	76.7	Confident	178 Å²	178	106.1 Å²	106.1	67%	0.672	48%	0.48	S	S	*	.	H	α-helix	trans	-66.7	-48.6	175.1	-72.5	179.8	-170.2	-159.7	2.3	110.8	A236 K237 K242 K243 D244	A236-R240 WeakPolarHBondContact O-CG 3.42Å; A236-R240 PolarHBondContact O-N 2.75Å; K237-R240 PolarHBondContact O-N 3.12Å; K237-R240 VanDerWaalsContact O-N 3.14Å; R240-K242 VanDerWaalsContact C-N 3.29Å; R240-K242 PolarHBondContact O-N 3.49Å; R240-K243 CarbonylContact O-C 3.37Å; R240-K243 WeakPolarHBondContact O-CA 3.29Å; R240-K243 PolarHBondContact O-N 3.25Å; R240-D244 VanDerWaalsContact O-CG 3.3Å; R240-D244 PolarHBondContact O-N 3.34Å
241	M	76.9	Confident	74.8	Confident	107 Å²	107	110.3 Å²	110.3	53%	0.527	50%	0.503	S	S	.	.	H	α-helix	trans	-56.9	-41.3	177.8	-63.9	-52.5	-161.5	0	0	112.4	K237 E238 K243 D244	K237-M241 WeakPolarHBondContact O-CG 3.35Å; K237-M241 PolarHBondContact O-N 3.49Å; E238-M241 PolarHBondContact O-N 2.62Å; M241-K243 VanDerWaalsContact C-N 3.28Å; M241-K243 PolarHBondContact O-N 2.79Å; M241-D244 PolarHBondContact O-N 3.12Å
242	K	76.9	Confident	72.8	Confident	149 Å²	149	117.2 Å²	117.2	65%	0.648	54%	0.535	S	S	*	.	H	α-helix	trans	-64.7	-27.6	175.2	-75.3	171.4	170.1	164.6	0	113.7	E238 R240	E238-K242 WeakPolarHBondContact O-CG 3.4Å; E238-K242 PolarHBondContact O-N 2.93Å; E238-K242 VanDerWaalsContact O-N 3.09Å; E238-K242 IonicContact OE1-NZ 3.88Å; E238-K242 PolarHBondContact OE1-NZ 3.37Å; R240-K242 VanDerWaalsContact C-N 3.29Å; R240-K242 PolarHBondContact O-N 3.49Å
243	K	66.9	Low	70.3	Confident	145 Å²	145	122 Å²	122	63%	0.63	55%	0.551	S	S	*	*	H	α-helix	trans	-90.5	-29.5	-179.7	-170.3	170.8	-178.1	176.9	0	112.4	K239 R240 M241 N245 S246 R247	K239-K243 PolarHBondContact O-N 3.35Å; R240-K243 CarbonylContact O-C 3.37Å; R240-K243 WeakPolarHBondContact O-CA 3.29Å; R240-K243 PolarHBondContact O-N 3.25Å; M241-K243 VanDerWaalsContact C-N 3.28Å; M241-K243 PolarHBondContact O-N 2.79Å; K243-N245 VanDerWaalsContact C-N 3.34Å; K243-N245 PolarHBondContact O-N 3.16Å; K243-S246 CarbonylContact O-C 3.58Å; K243-S246 WeakPolarHBondContact O-CA 3.37Å; K243-S246 WeakPolarHBondContact O-CB 3.49Å; K243-S246 PolarHBondContact O-N 2.95Å; K243-R247 PolarHBondContact O-N 3.34Å
244	D	62.3	Low	68.3	Low	71 Å²	71	124.4 Å²	124.4	38%	0.38	56%	0.557	S	S	.	*	H	α-helix	trans	-69.1	-33	-177.8	-66.9	-31.5	0	0	0	111.8	R240 M241 S246 R247 E248	R240-D244 VanDerWaalsContact O-CG 3.3Å; R240-D244 PolarHBondContact O-N 3.34Å; M241-D244 PolarHBondContact O-N 3.12Å; D244-S246 PolarHBondContact O-N 3.44Å; D244-S246 VanDerWaalsContact O-N 3.14Å; D244-R247 PolarHBondContact O-N 2.94Å; D244-E248 PolarHBondContact O-N 3.33Å
245	N	60.9	Low	66	Low	126 Å²	126	123 Å²	123	67%	0.674	57%	0.57	S	S	*	*	H	α-helix	trans	-58.1	-24.9	165.6	-90.9	96.1	0	0	0	114	K243	K243-N245 VanDerWaalsContact C-N 3.34Å; K243-N245 PolarHBondContact O-N 3.16Å
246	S	50.7	Low	63.6	Low	59 Å²	59	128 Å²	128	41%	0.413	59%	0.594	S	S	.	*	H	α-helix	trans	-90.8	-28	173.6	-164.7	0	0	0	0	111.6	K243 D244 K249 W250	K243-S246 CarbonylContact O-C 3.58Å; K243-S246 WeakPolarHBondContact O-CA 3.37Å; K243-S246 WeakPolarHBondContact O-CB 3.49Å; K243-S246 PolarHBondContact O-N 2.95Å; D244-S246 PolarHBondContact O-N 3.44Å; D244-S246 VanDerWaalsContact O-N 3.14Å; S246-K249 WeakPolarHBondContact O-CA 3.45Å; S246-K249 WeakPolarHBondContact O-CB 3.42Å; S246-K249 PolarHBondContact O-N 2.92Å; S246-K249 VanDerWaalsContact O-N 3.12Å; S246-W250 VanDerWaalsContact O-CD1 3.32Å; S246-W250 PolarHBondContact O-N 3.09Å
247	R	54.9	Low	61.2	Low	157 Å²	157	131.9 Å²	131.9	59%	0.592	61%	0.613	S	S	*	*	H	α-helix	trans	-74.2	-32.4	-178.5	-159.9	174.1	156	90.3	1.7	112	K243 D244 K249 W250 I251	K243-R247 PolarHBondContact O-N 3.34Å; D244-R247 PolarHBondContact O-N 2.94Å; R247-K249 PolarHBondContact O-N 3.42Å; R247-W250 PolarHBondContact O-N 3.4Å; R247-I251 WeakPolarHBondContact O-CG1 3.45Å; R247-I251 PolarHBondContact O-N 2.84Å
248	E	52.9	Low	58.8	Low	136 Å²	136	130.9 Å²	130.9	64%	0.636	62%	0.623	S	S	*	*	H	α-helix	trans	-55.7	-36.4	166.1	-72.5	174.8	161.3	0	0	111.4	D244 H252	D244-E248 PolarHBondContact O-N 3.33Å; E248-H252 PolarHBondContact O-N 3.24Å
249	K	48.5	Very low	56.6	Low	152 Å²	152	138.6 Å²	138.6	66%	0.661	65%	0.649	S	S	*	*	H	α-helix	trans	-70.9	-31.3	175.8	-153.8	168.8	-174.4	168.1	0	113.3	S246 R247 Y253	S246-K249 WeakPolarHBondContact O-CA 3.45Å; S246-K249 WeakPolarHBondContact O-CB 3.42Å; S246-K249 PolarHBondContact O-N 2.92Å; S246-K249 VanDerWaalsContact O-N 3.12Å; R247-K249 PolarHBondContact O-N 3.42Å; K249-Y253 PolarHBondContact O-N 3.06Å
250	W	43.4	Very low	54.2	Low	160 Å²	160	138.6 Å²	138.6	61%	0.606	66%	0.656	S	S	*	*	H	α-helix	trans	-77.7	-31	176.3	-83	91.1	0	0	0	113.3	S246 R247 H252 Y253 F254	S246-W250 VanDerWaalsContact O-CD1 3.32Å; S246-W250 PolarHBondContact O-N 3.09Å; R247-W250 PolarHBondContact O-N 3.4Å; W250-H252 VanDerWaalsContact C-N 3.27Å; W250-H252 PolarHBondContact O-N 3.36Å; W250-Y253 PolarHBondContact O-N 3.13Å; W250-F254 AromaticContact CE3-CD2 3.84Å; W250-F254 HydrophobicContact CE3-CD2 3.84Å; W250-F254 AromaticContact CE3-CE2 3.99Å; W250-F254 HydrophobicContact CE3-CE2 3.99Å; W250-F254 AromaticContact CZ3-CD2 3.88Å; W250-F254 HydrophobicContact CZ3-CD2 3.88Å; W250-F254 AromaticContact CZ3-CE2 3.52Å; W250-F254 HydrophobicContact CZ3-CE2 3.52Å; W250-F254 PolarHBondContact O-N 2.98Å
251	I	55.3	Low	51.7	Low	117 Å²	117	137.7 Å²	137.7	60%	0.6	67%	0.665	S	S	*	*	H	α-helix	trans	-63.9	-37.7	173.2	-66.3	167	0	0	0	110	R247 G255	R247-I251 WeakPolarHBondContact O-CG1 3.45Å; R247-I251 PolarHBondContact O-N 2.84Å; I251-G255 WeakPolarHBondContact O-CA 3.38Å; I251-G255 PolarHBondContact O-N 3.15Å
252	H	54.9	Low	49.9	Very low	147 Å²	147	137.9 Å²	137.9	68%	0.681	68%	0.676	S	S	*	*	H	α-helix	trans	-72.6	-27.3	178.8	-161.9	-85.7	0	0	0	114	E248 W250	E248-H252 PolarHBondContact O-N 3.24Å; W250-H252 VanDerWaalsContact C-N 3.27Å; W250-H252 PolarHBondContact O-N 3.36Å
253	Y	41.7	Very low	47.9	Very low	187 Å²	187	134.8 Å²	134.8	73%	0.733	68%	0.678	S	S	*	*	H	α-helix	trans	-87.9	-27.5	-177.7	-109.9	-92.2	0	0	0	114.5	K249 W250	K249-Y253 PolarHBondContact O-N 3.06Å; W250-Y253 PolarHBondContact O-N 3.13Å
254	F	54	Low	46.4	Very low	148 Å²	148	134 Å²	134	65%	0.649	68%	0.681	S	S	*	*	H	α-helix	trans	-111.6	-4.6	178.9	-85	-90.2	0	0	0	114.2	W250 K256	W250-F254 AromaticContact CE3-CD2 3.84Å; W250-F254 HydrophobicContact CE3-CD2 3.84Å; W250-F254 AromaticContact CE3-CE2 3.99Å; W250-F254 HydrophobicContact CE3-CE2 3.99Å; W250-F254 AromaticContact CZ3-CD2 3.88Å; W250-F254 HydrophobicContact CZ3-CD2 3.88Å; W250-F254 AromaticContact CZ3-CE2 3.52Å; W250-F254 HydrophobicContact CZ3-CE2 3.52Å; W250-F254 PolarHBondContact O-N 2.98Å; F254-K256 VanDerWaalsContact C-N 3.27Å; F254-K256 PolarHBondContact O-N 2.78Å
255	G	46.4	Very low	45.2	Very low	60 Å²	60	137.7 Å²	137.7	62%	0.619	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	3.3	-175.9	0	0	0	0	0	116.7	I251	I251-G255 WeakPolarHBondContact O-CA 3.38Å; I251-G255 PolarHBondContact O-N 3.15Å
256	K	45.1	Very low	44	Very low	181 Å²	181	140.7 Å²	140.7	79%	0.787	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.1	4	-175	-90.5	-178	177.5	177.2	0	116.4	F254	F254-K256 VanDerWaalsContact C-N 3.27Å; F254-K256 PolarHBondContact O-N 2.78Å
257	T	41.8	Very low	43.3	Very low	125 Å²	125	142 Å²	142	77%	0.767	72%	0.722	S	S	*	*	S	Bend	trans	-132.2	64.8	-178.6	65.2	0	0	0	0	113.6
258	S	39.2	Very low	42.5	Very low	110 Å²	110	138.6 Å²	138.6	77%	0.769	73%	0.728	S	S	*	*			trans	-161.4	54.2	151.3	67.5	0	0	0	0	110.3	L260	S258-L260 PolarHBondContact O-N 2.99Å
259	R	42.3	Very low	41.6	Very low	232 Å²	232	138.5 Å²	138.5	88%	0.875	73%	0.732	S	S	*	*			trans	-84.4	90.9	153.9	-74.1	-172.1	-155.3	171.4	4	107.3
260	L	37.5	Very low	40.9	Very low	164 Å²	164	139.5 Å²	139.5	86%	0.859	74%	0.739	S	S	*	*	S	Bend	trans	-161.2	109.1	149.2	-91.3	161.9	0	0	0	101.7	S258	S258-L260 PolarHBondContact O-N 2.99Å
261	N	34.2	Very low	40.8	Very low	159 Å²	159	136.6 Å²	136.6	85%	0.85	74%	0.743	S	S	*	*	S	Bend	trans	85.2	64.7	-162.7	-56.6	-23	0	0	0	115.7
262	S	39	Very low	39.8	Very low	111 Å²	111	138.2 Å²	138.2	78%	0.776	75%	0.753	S	S	*	*			trans	179.3	97.8	157.1	-80.1	0	0	0	0	109.4
263	A	34.4	Very low	38.9	Very low	83 Å²	83	139.8 Å²	139.8	69%	0.686	76%	0.76	S	S	*	*			trans	-175.7	125.2	171.4	0	0	0	0	0	102.5
264	D	35.6	Very low	38.5	Very low	130 Å²	130	135.3 Å²	135.3	70%	0.695	76%	0.757	S	S	*	*			cis	-160.1	159.5	22.1	-78.8	-52.9	0	0	0	107.7
265	N	36.1	Very low	37.5	Very low	147 Å²	147	135.6 Å²	135.6	79%	0.786	76%	0.764	S	S	*	*			trans	143.9	93.6	148.9	-73.2	-33.5	0	0	0	108.8
266	F	35.6	Very low	36.7	Very low	189 Å²	189	139.7 Å²	139.7	83%	0.829	77%	0.772	S	S	*	*				56.1	126.8	84.1	-79.9	-93.4	0	0	0	110.7
267	A	37.4	Very low	36.1	Very low	86 Å²	86	138.2 Å²	138.2	71%	0.711	77%	0.771	S	S	*	*			cis	-160.7	140.8	32.6	0	0	0	0	0	108.4
268	A	37.2	Very low	35.5	Very low	87 Å²	87	138.2 Å²	138.2	72%	0.719	77%	0.77	S	S	*	*				80.5	109.1	91.6	0	0	0	0	0	114.8
269	N	33.1	Very low	35.1	Very low	134 Å²	134	137.8 Å²	137.8	72%	0.717	77%	0.767	S	S	*	*				175	113.9	114.5	-98.8	15.4	0	0	0	107.2
270	E	34.8	Very low	34.6	Very low	173 Å²	173	130.4 Å²	130.4	81%	0.808	75%	0.752	S	S	*	*				57.8	133.5	81	-72.8	-168.5	122.6	0	0	111.1
271	S	41.1	Very low	34.5	Very low	98 Å²	98	130.7 Å²	130.7	69%	0.685	75%	0.749	S	S	*	*			cis	-172.4	132.6	2.8	39.2	0	0	0	0	103.6
272	D	34.3	Very low	34.5	Very low	152 Å²	152	132.4 Å²	132.4	81%	0.813	75%	0.751	S	S	*	*				38.5	103.2	115.1	-145	8.5	0	0	0	115.4
273	E	36.2	Very low	34.4	Very low	179 Å²	179	130.8 Å²	130.8	84%	0.836	75%	0.752	S	S	*	*			trans	-160.2	105.6	143.2	-138.9	178.5	100.6	0	0	110.1
274	S	33.4	Very low	34.3	Very low	93 Å²	93	133 Å²	133	65%	0.65	76%	0.762	S	S	*	*			trans	-58.2	142.8	154.9	50.9	0	0	0	0	110.8
275	L	33.8	Very low	34.7	Very low	155 Å²	155	132 Å²	132	81%	0.812	76%	0.764	S	S	*	*			trans	-179.4	127.7	135.8	-95.8	163.8	0	0	0	111.3
276	D	29	Very low	35.4	Very low	145 Å²	145	130.5 Å²	130.5	78%	0.775	76%	0.763	S	S	*	*			trans	-68.2	156.7	167.5	-61.7	-65.8	0	0	0	111.6
277	I	32	Very low	35.7	Very low	151 Å²	151	125.7 Å²	125.7	77%	0.774	75%	0.752	S	S	*	*				153.7	108.6	127.5	-76.8	159.7	0	0	0	113.4
278	V	30.1	Very low	36.1	Very low	124 Å²	124	129.4 Å²	129.4	75%	0.752	76%	0.755	S	S	*	*				50.9	145.2	126.9	-148.8	0	0	0	0	123
279	S	29.7	Very low	36.3	Very low	101 Å²	101	134.9 Å²	134.9	71%	0.706	76%	0.758	S	S	*	*			trans	88.3	143	149.8	-77.9	0	0	0	0	117.2
280	S	32.9	Very low	36.7	Very low	78 Å²	78	134.1 Å²	134.1	55%	0.545	75%	0.754	S	S	.	*			cis	-176	159.2	-6	-85	0	0	0	0	105.2
281	E	34.9	Very low	37.6	Very low	170 Å²	170	130.9 Å²	130.9	79%	0.794	75%	0.751	S	S	*	*			trans	70.7	110.5	147.5	-68.2	147.8	-149.4	0	0	118.6
282	E	35	Very low	38.2	Very low	194 Å²	194	138.8 Å²	138.8	91%	0.907	78%	0.78	S	S	*	*				74.9	115.6	88.1	-66.7	-131.5	145.1	0	0	114.6
283	G	35.3	Very low	38.4	Very low	77 Å²	77	138.1 Å²	138.1	79%	0.794	78%	0.778	S	S	*	*			trans	91.2	107.8	140.3	0	0	0	0	0	117.8
284	C	32.6	Very low	38.5	Very low	131 Å²	131	135.9 Å²	135.9	89%	0.885	78%	0.775	S	S	*	*				-169.2	108.3	115.6	-137.5	0	0	0	0	110.9
285	S	44.2	Very low	38.8	Very low	108 Å²	108	138.3 Å²	138.3	76%	0.755	78%	0.782	S	S	*	*			trans	-70.8	159	154.1	-55.4	0	0	0	0	108.8
286	P	51	Low	39.1	Very low	115 Å²	115	137.4 Å²	137.4	75%	0.747	78%	0.78	S	S	*	*				-141.5	130.6	106.5	18.6	3	0	0	0	114.8
287	S	42.1	Very low	39.7	Very low	88 Å²	88	136.9 Å²	136.9	62%	0.615	78%	0.781	S	S	*	*			trans	15.3	133.8	130.4	55.5	0	0	0	0	120
288	H	45.7	Very low	40.3	Very low	165 Å²	165	135.9 Å²	135.9	76%	0.764	78%	0.781	S	S	*	*				-178.7	116.9	102.8	-106.1	-104.5	0	0	0	108.1
289	Y	41.5	Very low	41	Very low	202 Å²	202	136.8 Å²	136.8	79%	0.792	78%	0.783	S	S	*	*				60.8	137.5	99.3	-112	-109	0	0	0	113.8
290	N	41.5	Very low	41.9	Very low	118 Å²	118	139.5 Å²	139.5	63%	0.631	79%	0.789	S	S	*	*			cis	-178.7	172.4	-13.5	-147.3	-23.4	0	0	0	106.8
291	S	53.1	Low	42.6	Very low	104 Å²	104	144.7 Å²	144.7	73%	0.727	81%	0.809	S	S	*	*			trans	88.6	112.5	142.4	-126.2	0	0	0	0	121.5
292	M	54.3	Low	43.3	Very low	264 Å²	264	142.4 Å²	142.4	100%	1.3	81%	0.811	S	S	*	*			trans	129.6	0	146.7	-79.2	173.8	159.5	0	0	112.3

Retrieved 292 of 292 residues in 637.4 ms (Link to these results)

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