A0A087XLN6_POEFO Loading...

Zinc finger, matrin-type 4a

AlphaFold DB , UniProt , Accession A0A087XLN6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 260 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	39.7	Very low	35.2	Very low	230 Å²	230	155.4 Å²	155.4	100%	1.133	83%	0.827	S	S	*	*				0	103.9	0	-73.9	176.2	-172.4	0	0	105.7
2	E	29.7	Very low	35.3	Very low	185 Å²	185	155.6 Å²	155.6	86%	0.864	83%	0.827	S	S	*	*			trans	-81.5	131.2	-169.9	-52.9	-151.4	128.4	0	0	109.4	T4	E2-T4 PolarHBondContact O-N 3.09Å
3	C	28.6	Very low	35.4	Very low	135 Å²	135	155.8 Å²	155.8	91%	0.912	83%	0.828	S	S	*	*			trans	-82.5	99.2	177.4	-68.5	0	0	0	0	109
4	T	32.1	Very low	35.1	Very low	126 Å²	126	150.1 Å²	150.1	77%	0.773	82%	0.824	S	S	*	*			trans	-82.1	121.4	169.3	42.5	0	0	0	0	110.3	E2	E2-T4 PolarHBondContact O-N 3.09Å
5	L	34.7	Very low	34.8	Very low	162 Å²	162	148.7 Å²	148.7	85%	0.848	82%	0.821	S	S	*	*			trans	-95.1	108.6	175.7	-127.6	151.3	0	0	0	107.5
6	S	34.1	Very low	34.4	Very low	112 Å²	112	150.3 Å²	150.3	78%	0.783	82%	0.817	S	S	*	*			trans	-109.1	115.5	177.1	-60.9	0	0	0	0	109.5
7	I	36.3	Very low	34.8	Very low	147 Å²	147	147.7 Å²	147.7	75%	0.754	81%	0.81	S	S	*	*			trans	-93.4	116.5	171.6	-59.9	173.5	0	0	0	106.5	V9	I7-V9 HydrophobicContact CG2-CG2 4.11Å
8	Q	33.4	Very low	35	Very low	179 Å²	179	146.3 Å²	146.3	84%	0.836	81%	0.807	S	S	*	*			trans	-110	110.4	173.6	-132	170.5	26.3	0	0	108.3
9	V	36	Very low	34.8	Very low	123 Å²	123	148.5 Å²	148.5	75%	0.745	81%	0.81	S	S	*	*			trans	-92.4	101.3	174.1	-179.4	0	0	0	0	106.9	I7 Q11	I7-V9 HydrophobicContact CG2-CG2 4.11Å; V9-Q11 PolarHBondContact O-N 3.32Å
10	Q	38.8	Very low	34.6	Very low	150 Å²	150	151.3 Å²	151.3	70%	0.701	81%	0.81	S	S	*	*			trans	-87.1	104.5	175.8	-161	82.5	27.4	0	0	108.8
11	Q	43.4	Very low	34.3	Very low	160 Å²	160	154.6 Å²	154.6	75%	0.748	81%	0.813	S	S	*	*			trans	-90	105.5	175.8	-166.8	157.4	2.6	0	0	109	V9	V9-Q11 PolarHBondContact O-N 3.32Å
12	L	36.9	Very low	33.7	Very low	158 Å²	158	150 Å²	150	83%	0.827	79%	0.788	S	S	*	*			trans	-107	112	168.7	-77.2	171.4	0	0	0	109.3
13	L	36	Very low	33.7	Very low	159 Å²	159	144.2 Å²	144.2	83%	0.832	78%	0.778	S	S	*	*			trans	-76.9	126.1	174.1	-72	162.4	0	0	0	109.6
14	G	31.3	Very low	33.8	Very low	75 Å²	75	146.5 Å²	146.5	77%	0.773	77%	0.769	S	S	*	*			trans	-150.9	127.1	168.8	0	0	0	0	0	109.7
15	V	31.5	Very low	33.8	Very low	129 Å²	129	145.5 Å²	145.5	78%	0.782	77%	0.767	S	S	*	*			trans	-98.5	111.7	-163.1	168.2	0	0	0	0	111.2
16	F	28.1	Very low	33.5	Very low	174 Å²	174	143.2 Å²	143.2	76%	0.763	76%	0.759	S	S	*	*			trans	51.5	161.9	147.1	-63.2	-72.2	0	0	0	123
17	P	41.2	Very low	33.4	Very low	107 Å²	107	145.9 Å²	145.9	70%	0.695	76%	0.759	S	S	*	*			cis	-134.5	166.6	6.1	41.2	-22.5	0	0	0	118.2
18	T	37.4	Very low	33.4	Very low	123 Å²	123	145.2 Å²	145.2	76%	0.755	76%	0.756	S	S	*	*	S	Bend	trans	67.2	82.8	159.5	70.2	0	0	0	0	121.4
19	H	32.9	Very low	33.3	Very low	188 Å²	188	144.9 Å²	144.9	87%	0.87	76%	0.755	S	S	*	*				-177.7	122.9	108.3	-116.4	-98.6	0	0	0	109.6	Y21	H19-Y21 PolarHBondContact O-N 3.07Å
20	Y	30	Very low	33.8	Very low	204 Å²	204	145.9 Å²	145.9	80%	0.8	75%	0.753	S	S	*	*			trans	-74.4	115.5	-179	-95	-106.6	0	0	0	111.1
21	Y	27.9	Very low	33.7	Very low	221 Å²	221	148.2 Å²	148.2	87%	0.867	76%	0.761	S	S	*	*			trans	-144.8	109.4	143.8	-153.4	-98.5	0	0	0	106.8	H19 G23	H19-Y21 PolarHBondContact O-N 3.07Å; Y21-G23 VanDerWaalsContact C-N 3.26Å; Y21-G23 PolarHBondContact O-N 2.99Å
22	E	27.7	Very low	33.6	Very low	134 Å²	134	143.5 Å²	143.5	63%	0.626	75%	0.746	S	S	*	*			trans	-78.5	77.3	-176.3	-158.2	172.5	156	0	0	109.3	Y24	E22-Y24 HydrophobicContact CG-CD2 4.24Å; E22-Y24 HydrophobicContact CG-CE2 3.7Å; E22-Y24 PolarHBondContact O-N 3.27Å; E22-Y24 WeakPolarHBondContact OE1-CE2 3.5Å; E22-Y24 VanDerWaalsContact OE1-CZ 3.28Å; E22-Y24 PolarHBondContact OE1-OH 3.46Å
23	G	30.5	Very low	34	Very low	62 Å²	62	140.4 Å²	140.4	64%	0.639	73%	0.733	S	S	*	*			trans	-79.6	99	169.7	0	0	0	0	0	109.6	Y21 S25	Y21-G23 VanDerWaalsContact C-N 3.26Å; Y21-G23 PolarHBondContact O-N 2.99Å; G23-S25 PolarHBondContact O-N 3.4Å
24	Y	30	Very low	34.5	Very low	184 Å²	184	141.4 Å²	141.4	72%	0.722	73%	0.734	S	S	*	*			trans	-66.5	97	164	-76.7	-92.3	0	0	0	108.4	E22 V26	E22-Y24 HydrophobicContact CG-CD2 4.24Å; E22-Y24 HydrophobicContact CG-CE2 3.7Å; E22-Y24 PolarHBondContact O-N 3.27Å; E22-Y24 WeakPolarHBondContact OE1-CE2 3.5Å; E22-Y24 VanDerWaalsContact OE1-CZ 3.28Å; E22-Y24 PolarHBondContact OE1-OH 3.46Å; Y24-V26 PolarHBondContact O-N 3.48Å
25	S	31.6	Very low	35.3	Very low	105 Å²	105	141.4 Å²	141.4	73%	0.734	72%	0.719	S	S	*	*			trans	-78.8	94.8	166.4	-162.1	0	0	0	0	107.8	G23 E27	G23-S25 PolarHBondContact O-N 3.4Å; S25-E27 VanDerWaalsContact C-N 3.3Å; S25-E27 PolarHBondContact O-N 2.85Å; S25-E27 VanDerWaalsContact O-N 3.12Å
26	V	28.6	Very low	36.6	Very low	114 Å²	114	137 Å²	137	69%	0.691	69%	0.691	S	S	*	*			trans	-77.4	89.3	166.2	-178.5	0	0	0	0	106.3	Y24 L28	Y24-V26 PolarHBondContact O-N 3.48Å; V26-L28 HydrophobicContact CG1-CD1 4.05Å; V26-L28 PolarHBondContact O-N 2.96Å
27	E	31.1	Very low	38	Very low	168 Å²	168	135.5 Å²	135.5	79%	0.785	69%	0.686	S	S	*	*			trans	-68.3	91.3	165.8	-74.9	-166	123.8	0	0	108.1	S25 Q29	S25-E27 VanDerWaalsContact C-N 3.3Å; S25-E27 PolarHBondContact O-N 2.85Å; S25-E27 VanDerWaalsContact O-N 3.12Å; E27-Q29 PolarHBondContact O-N 3.31Å
28	L	37.6	Very low	39.2	Very low	132 Å²	132	132 Å²	132	69%	0.691	67%	0.67	S	S	*	*			trans	-71	85.1	170.1	-144.4	92	0	0	0	107.2	V26 M30	V26-L28 HydrophobicContact CG1-CD1 4.05Å; V26-L28 PolarHBondContact O-N 2.96Å; L28-M30 VanDerWaalsContact C-N 3.33Å; L28-M30 PolarHBondContact O-N 3.39Å
29	Q	31.6	Very low	41.1	Very low	173 Å²	173	127.2 Å²	127.2	81%	0.808	64%	0.639	S	S	*	*			trans	-69.2	92.8	-178.4	-147.9	170.2	29	0	0	109.1	E27 K31	E27-Q29 PolarHBondContact O-N 3.31Å; Q29-K31 PolarHBondContact O-N 2.94Å
30	M	45.4	Very low	43.7	Very low	144 Å²	144	120.5 Å²	120.5	71%	0.709	61%	0.608	S	S	*	*			trans	-64	104.8	166.4	-66.6	178.3	122.9	0	0	106.9	L28 S32	L28-M30 VanDerWaalsContact C-N 3.33Å; L28-M30 PolarHBondContact O-N 3.39Å; M30-S32 PolarHBondContact O-N 2.76Å
31	K	37.5	Very low	46.4	Very low	198 Å²	198	112.8 Å²	112.8	86%	0.861	58%	0.582	S	S	*	*			trans	-67.5	87	168.4	-84.3	-177.2	173.7	-172.2	0	108.2	Q29 T33	Q29-K31 PolarHBondContact O-N 2.94Å; K31-T33 PolarHBondContact O-N 3.1Å
32	S	41.9	Very low	49.1	Very low	61 Å²	61	107.7 Å²	107.7	43%	0.427	57%	0.57	S	S	.	*			trans	-67.9	117.3	175.5	-58.7	0	0	0	0	109.7	M30	M30-S32 PolarHBondContact O-N 2.76Å
33	T	43.4	Very low	51.9	Low	93 Å²	93	104.4 Å²	104.4	57%	0.571	56%	0.561	S	S	*	*			trans	-64.6	143.9	152.3	41	0	0	0	0	108.1	K31 V35 D36	K31-T33 PolarHBondContact O-N 3.1Å; T33-V35 PolarHBondContact O-N 3.18Å; T33-D36 PolarHBondContact O-N 3.4Å
34	E	47.2	Very low	54.7	Low	181 Å²	181	105.3 Å²	105.3	85%	0.846	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-19	-171	-57.9	-176.7	175.4	0	0	114.4
35	V	49.4	Very low	57.5	Low	74 Å²	74	96.5 Å²	96.5	45%	0.448	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-24.8	176	179.2	0	0	0	0	113.4	T33 V80	T33-V35 PolarHBondContact O-N 3.18Å; V35-V80 HydrophobicContact CG1-CG1 3.86Å; V35-V80 HydrophobicContact CG1-CG2 4.43Å; V35-V80 HydrophobicContact CG2-CG1 4.01Å
36	D	56.9	Low	60	Low	37 Å²	37	96.7 Å²	96.7	20%	0.198	50%	0.499	C	S	.	.	G	3₁₀ helix	trans	-85.6	-23.1	-171.9	-75.7	-1.9	0	0	0	113.7	T33 G38 L39 F40 Y75	T33-D36 PolarHBondContact O-N 3.4Å; D36-G38 PolarHBondContact O-N 3.07Å; D36-G38 VanDerWaalsContact O-N 3.14Å; D36-L39 PolarHBondContact O-N 3.41Å; D36-L39 VanDerWaalsContact O-N 3.11Å; D36-F40 HydrophobicContact CB-CD2 4.35Å; D36-F40 PolarHBondContact O-N 2.9Å; D36-Y75 VanDerWaalsContact CG-OH 3.28Å; D36-Y75 PolarHBondContact OD1-OH 2.91Å
37	Q	58.4	Low	62.7	Low	142 Å²	142	91.7 Å²	91.7	66%	0.664	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-63.2	-21.8	-179.7	-78.5	173.7	14.8	0	0	113
38	G	67.3	Low	65.2	Low	34 Å²	34	84.8 Å²	84.8	35%	0.351	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-86.3	-23.2	176.7	0	0	0	0	0	114.6	D36 K46	D36-G38 PolarHBondContact O-N 3.07Å; D36-G38 VanDerWaalsContact O-N 3.14Å; G38-K46 WeakPolarHBondContact O-CD 3.46Å; G38-K46 WeakPolarHBondContact O-CE 3.29Å; G38-K46 PolarHBondContact O-NZ 3.16Å
39	L	76.6	Confident	67.5	Low	22 Å²	22	82.5 Å²	82.5	12%	0.115	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-28.3	-170.4	-70.9	168.9	0	0	0	113.2	D36 K46 V47 Y74	D36-L39 PolarHBondContact O-N 3.41Å; D36-L39 VanDerWaalsContact O-N 3.11Å; L39-K46 HydrophobicContact CD2-CB 4.37Å; L39-K46 PolarHBondContact O-N 3.05Å; L39-V47 HydrophobicContact CB-CG2 4.45Å; L39-Y74 HydrophobicContact CD1-CD1 4.39Å; L39-Y74 HydrophobicContact CD1-CE1 3.59Å; L39-Y74 HydrophobicContact CD2-CE1 3.94Å; L39-Y74 WeakPolarHBondContact CD2-OH 3.45Å; L39-Y74 HydrophobicContact CG-CE1 4.43Å
40	F	87.3	Confident	70.2	Confident	47 Å²	47	75.5 Å²	75.5	21%	0.206	41%	0.406	C	S	.	.	B	Isolated β-bridge	trans	-123.2	111.1	-179.5	-49.1	-70.5	0	0	0	108.7	D36 V47 Y62 H67 V71	D36-F40 HydrophobicContact CB-CD2 4.35Å; D36-F40 PolarHBondContact O-N 2.9Å; F40-V47 HydrophobicContact CE1-CB 4.17Å; F40-V47 HydrophobicContact CE1-CG2 3.65Å; F40-V47 HydrophobicContact CZ-CG2 3.85Å; F40-Y62 HydrophobicContact CB-CE1 4.4Å; F40-Y62 AromaticContact CD1-CE1 4Å; F40-Y62 HydrophobicContact CD1-CE1 4Å; F40-H67 AromaticContact CD1-CE1 3.76Å; F40-H67 AromaticContact CD1-NE2 3.89Å; F40-H67 AromaticContact CE1-CE1 3.52Å; F40-H67 AromaticContact CE1-NE2 3.57Å; F40-V71 HydrophobicContact CE1-CG2 3.55Å; F40-V71 HydrophobicContact CZ-CB 4.45Å; F40-V71 HydrophobicContact CZ-CG1 3.89Å; F40-V71 HydrophobicContact CZ-CG2 3.65Å
41	T	87.4	Confident	72.4	Confident	43 Å²	43	74 Å²	74	26%	0.264	40%	0.397	S	S	.	.			trans	-120.4	167.4	174.5	78.3	0	0	0	0	111	S43 Y44 Y62	T41-S43 VanDerWaalsContact C-N 3.27Å; T41-S43 PolarHBondContact O-N 3.47Å; T41-Y44 PolarHBondContact N-O 3.25Å; T41-Y44 VanDerWaalsContact N-O 3.09Å; T41-Y44 PolarHBondContact OG1-N 3.4Å; T41-Y44 PolarHBondContact OG1-O 3.22Å; T41-Y62 PolarHBondContact N-OH 3.18Å; T41-Y62 PolarHBondContact O-OH 3.3Å
42	D	83.5	Confident	75	Confident	114 Å²	114	65 Å²	65	61%	0.61	36%	0.358	S	S	*	.	S	Bend	trans	-66.9	-30.4	-178.1	-70.3	-14.3	0	0	0	113.5	R58	D42-R58 VanDerWaalsContact CB-NH1 3.29Å; D42-R58 IonicContact OD1-CZ 3.35Å; D42-R58 IonicContact OD1-NH1 2.73Å; D42-R58 PolarHBondContact OD1-NH1 2.97Å; D42-R58 IonicContact OD2-NH1 3.8Å; D42-R58 PolarHBondContact OD2-NH1 3.37Å
43	S	86.8	Confident	77.3	Confident	64 Å²	64	68.9 Å²	68.9	45%	0.448	37%	0.373	S	S	.	.	S	Bend	trans	-102.8	-17.6	-178.5	57.2	0	0	0	0	113	T41 Q51 L52	T41-S43 VanDerWaalsContact C-N 3.27Å; T41-S43 PolarHBondContact O-N 3.47Å; S43-Q51 PolarHBondContact O-NE2 3.29Å; S43-L52 PolarHBondContact O-N 3.4Å
44	Y	88.9	Confident	79.6	Confident	81 Å²	81	66.9 Å²	66.9	32%	0.318	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	129	-173.5	-169.4	-101.1	0	0	0	113.7	T41 K46 S49 A50 Q51	T41-Y44 PolarHBondContact N-O 3.25Å; T41-Y44 VanDerWaalsContact N-O 3.09Å; T41-Y44 PolarHBondContact OG1-N 3.4Å; T41-Y44 PolarHBondContact OG1-O 3.22Å; Y44-K46 HydrophobicContact CD1-CG 3.79Å; Y44-K46 HydrophobicContact CE1-CB 4.38Å; Y44-K46 HydrophobicContact CE1-CG 3.86Å; Y44-S49 WeakPolarHBondContact OH-CA 3.44Å; Y44-A50 WeakPolarHBondContact CA-O 3.41Å; Y44-A50 WeakPolarHBondContact CD2-O 3.47Å; Y44-Q51 HydrophobicContact CD2-CB 4.43Å
45	C	90.2	Very high	81.6	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	113.4	170.2	179.2	0	0	0	0	110.1	C48 S49 A50 Y62 H67	C45-C48 HydrophobicContact CB-CB 4.05Å; C45-C48 PolarHBondContact O-N 2.8Å; C45-C48 VanDerWaalsContact SG-CB 3.58Å; C45-C48 PolarHBondContact SG-N 3.17Å; C45-S49 WeakPolarHBondContact O-CA 3.18Å; C45-S49 PolarHBondContact O-N 3.5Å; C45-A50 PolarHBondContact N-O 3.17Å; C45-A50 PolarHBondContact O-N 3.33Å; C45-Y62 HydrophobicContact CB-CE1 3.86Å; C45-H67 PolarHBondContact SG-CE1 3.1Å
46	K	82.9	Confident	83.6	Confident	109 Å²	109	65.3 Å²	65.3	47%	0.474	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-37.3	179.6	-63.1	-169.2	-174.2	159.7	0	112.5	G38 L39 Y44 C48 S49	G38-K46 WeakPolarHBondContact O-CD 3.46Å; G38-K46 WeakPolarHBondContact O-CE 3.29Å; G38-K46 PolarHBondContact O-NZ 3.16Å; L39-K46 HydrophobicContact CD2-CB 4.37Å; L39-K46 PolarHBondContact O-N 3.05Å; Y44-K46 HydrophobicContact CD1-CG 3.79Å; Y44-K46 HydrophobicContact CE1-CB 4.38Å; Y44-K46 HydrophobicContact CE1-CG 3.86Å; K46-C48 VanDerWaalsContact C-N 3.31Å; K46-C48 PolarHBondContact O-N 3.49Å; K46-S49 PolarHBondContact O-N 3.21Å; K46-S49 PolarHBondContact O-OG 3.42Å
47	V	85.1	Confident	85	Confident	9 Å²	9	67.3 Å²	67.3	6%	0.055	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-41.9	175.9	175.6	0	0	0	0	111.4	L39 F40 K70 V71 Y74	L39-V47 HydrophobicContact CB-CG2 4.45Å; F40-V47 HydrophobicContact CE1-CB 4.17Å; F40-V47 HydrophobicContact CE1-CG2 3.65Å; F40-V47 HydrophobicContact CZ-CG2 3.85Å; V47-K70 HydrophobicContact CG1-CB 4.21Å; V47-K70 HydrophobicContact CG1-CD 4.28Å; V47-K70 HydrophobicContact CG1-CG 3.94Å; V47-K70 WeakPolarHBondContact O-CD 3.31Å; V47-K70 WeakPolarHBondContact O-CE 3.5Å; V47-K70 PolarHBondContact O-NZ 2.75Å; V47-K70 VanDerWaalsContact O-NZ 3.09Å; V47-V71 HydrophobicContact CB-CG2 4.44Å; V47-V71 HydrophobicContact CG1-CG2 3.97Å; V47-V71 HydrophobicContact CG2-CG2 4.47Å; V47-Y74 HydrophobicContact CG1-CG 4.35Å; V47-Y74 HydrophobicContact CG2-CD1 4.13Å; V47-Y74 HydrophobicContact CG2-CD2 4.31Å; V47-Y74 HydrophobicContact CG2-CG 4Å
48	C	83.6	Confident	86.6	Confident	23 Å²	23	62.9 Å²	62.9	16%	0.155	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-16	178.7	-72.3	0	0	0	0	113.8	C45 K46 A50 H61 H67 K70	C45-C48 HydrophobicContact CB-CB 4.05Å; C45-C48 PolarHBondContact O-N 2.8Å; C45-C48 VanDerWaalsContact SG-CB 3.58Å; C45-C48 PolarHBondContact SG-N 3.17Å; K46-C48 VanDerWaalsContact C-N 3.31Å; K46-C48 PolarHBondContact O-N 3.49Å; C48-A50 VanDerWaalsContact C-N 3.26Å; C48-A50 HydrophobicContact CB-CB 3.9Å; C48-H61 VanDerWaalsContact CB-CE1 3.44Å; C48-H61 WeakPolarHBondContact CB-CE1 3.29Å; C48-H61 WeakPolarHBondContact CB-NE2 3.45Å; C48-H61 VanDerWaalsContact SG-CE1 3.5Å; C48-H61 PolarHBondContact SG-NE2 3.48Å; C48-H67 PolarHBondContact SG-ND1 2.91Å; C48-H67 VanDerWaalsContact SG-ND1 3.42Å; C48-K70 HydrophobicContact CB-CD 4.42Å; C48-K70 PolarHBondContact O-NZ 2.89Å
49	S	86.6	Confident	87.7	Confident	84 Å²	84	64 Å²	64	59%	0.587	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	48.5	-166	-44.1	0	0	0	0	111.1	Y44 C45 K46	Y44-S49 WeakPolarHBondContact OH-CA 3.44Å; C45-S49 WeakPolarHBondContact O-CA 3.18Å; C45-S49 PolarHBondContact O-N 3.5Å; K46-S49 PolarHBondContact O-N 3.21Å; K46-S49 PolarHBondContact O-OG 3.42Å
50	A	86.9	Confident	88.4	Confident	26 Å²	26	66.1 Å²	66.1	22%	0.215	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	127.2	-171.7	0	0	0	0	0	111	Y44 C45 C48	Y44-A50 WeakPolarHBondContact CA-O 3.41Å; Y44-A50 WeakPolarHBondContact CD2-O 3.47Å; C45-A50 PolarHBondContact N-O 3.17Å; C45-A50 PolarHBondContact O-N 3.33Å; C48-A50 VanDerWaalsContact C-N 3.26Å; C48-A50 HydrophobicContact CB-CB 3.9Å
51	Q	92.3	Very high	88.6	Confident	113 Å²	113	65.6 Å²	65.6	53%	0.528	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	130.2	169.9	-169.8	72.1	33.8	0	0	109.5	S43 Y44 I53	S43-Q51 PolarHBondContact O-NE2 3.29Å; Y44-Q51 HydrophobicContact CD2-CB 4.43Å; Q51-I53 HydrophobicContact CG-CG2 3.97Å
52	L	91.9	Very high	88.8	Confident	9 Å²	9	65.7 Å²	65.7	5%	0.047	36%	0.36	C	S	.	.			trans	-107.4	111.3	176.9	-55.9	172.3	0	0	0	106.7	S43 Q57 R58 H61 Y62	S43-L52 PolarHBondContact O-N 3.4Å; L52-Q57 HydrophobicContact CD2-CG 4.3Å; L52-R58 HydrophobicContact CB-CB 4.28Å; L52-R58 HydrophobicContact CD1-CB 4.05Å; L52-R58 HydrophobicContact CD1-CG 3.97Å; L52-H61 HydrophobicContact CD2-CB 3.76Å; L52-Y62 HydrophobicContact CD1-CE1 4.21Å; L52-Y62 HydrophobicContact CD1-CE2 3.85Å; L52-Y62 WeakPolarHBondContact CD1-OH 3.37Å
53	I	90.3	Very high	89.1	Confident	142 Å²	142	67.2 Å²	67.2	73%	0.728	36%	0.363	S	S	*	.			trans	-99	-5.3	-172.9	58.7	162.5	0	0	0	113	Q51 Q57	Q51-I53 HydrophobicContact CG-CG2 3.97Å; I53-Q57 VanDerWaalsContact CG1-OE1 3.24Å
54	S	92.8	Very high	89	Confident	50 Å²	50	65.8 Å²	65.8	35%	0.35	35%	0.353	S	S	.	.	S	Bend	trans	-149.7	157.8	175	74.1	0	0	0	0	111.5	S56 Q57 R58	S54-S56 PolarHBondContact OG-OG 3.18Å; S54-S56 VanDerWaalsContact OG-OG 3.05Å; S54-Q57 PolarHBondContact O-N 3.34Å; S54-Q57 VanDerWaalsContact OG-CB 3.29Å; S54-Q57 WeakPolarHBondContact OG-CB 3.11Å; S54-Q57 PolarHBondContact OG-N 3.22Å; S54-Q57 VanDerWaalsContact OG-N 3.13Å; S54-R58 WeakPolarHBondContact O-CB 2.99Å; S54-R58 PolarHBondContact O-N 2.99Å
55	E	88.7	Confident	88.7	Confident	131 Å²	131	72.4 Å²	72.4	61%	0.612	38%	0.378	S	S	*	.	H	α-helix	trans	-60.9	-43.6	175	172.8	159	-136.3	0	0	112.4	Q57 R58 V59	E55-Q57 VanDerWaalsContact C-N 3.29Å; E55-Q57 PolarHBondContact O-N 3.48Å; E55-R58 WeakPolarHBondContact O-CB 3.42Å; E55-R58 PolarHBondContact O-N 3.08Å; E55-R58 VanDerWaalsContact O-N 3.16Å; E55-R58 IonicContact OE1-NH2 3.05Å; E55-R58 PolarHBondContact OE1-NH2 2.75Å; E55-V59 HydrophobicContact CG-CG2 4.49Å; E55-V59 WeakPolarHBondContact O-CG2 3.48Å; E55-V59 PolarHBondContact O-N 3.5Å
56	S	90.5	Very high	88.4	Confident	91 Å²	91	81.1 Å²	81.1	64%	0.636	42%	0.416	S	S	*	.	H	α-helix	trans	-60.9	-37.9	176.9	55.6	0	0	0	0	112.7	S54 A60	S54-S56 PolarHBondContact OG-OG 3.18Å; S54-S56 VanDerWaalsContact OG-OG 3.05Å; S56-A60 VanDerWaalsContact O-CB 3.31Å; S56-A60 WeakPolarHBondContact O-CB 3.41Å; S56-A60 PolarHBondContact O-N 3.05Å; S56-A60 VanDerWaalsContact O-N 3.08Å
57	Q	87.3	Confident	88.7	Confident	80 Å²	80	76.5 Å²	76.5	37%	0.374	40%	0.396	S	S	.	.	H	α-helix	trans	-70.5	-38.9	176.1	-174.4	-178	55.4	0	0	111.6	L52 I53 S54 E55 H61	L52-Q57 HydrophobicContact CD2-CG 4.3Å; I53-Q57 VanDerWaalsContact CG1-OE1 3.24Å; S54-Q57 PolarHBondContact O-N 3.34Å; S54-Q57 VanDerWaalsContact OG-CB 3.29Å; S54-Q57 WeakPolarHBondContact OG-CB 3.11Å; S54-Q57 PolarHBondContact OG-N 3.22Å; S54-Q57 VanDerWaalsContact OG-N 3.13Å; E55-Q57 VanDerWaalsContact C-N 3.29Å; E55-Q57 PolarHBondContact O-N 3.48Å; Q57-H61 WeakPolarHBondContact O-CB 3.43Å; Q57-H61 PolarHBondContact O-N 2.99Å
58	R	92.2	Very high	88.7	Confident	48 Å²	48	78.7 Å²	78.7	18%	0.181	42%	0.415	C	S	.	.	H	α-helix	trans	-60.2	-51.1	176	174.5	-177.3	65.6	179	-6.7	111.4	D42 L52 S54 E55 H61 Y62	D42-R58 VanDerWaalsContact CB-NH1 3.29Å; D42-R58 IonicContact OD1-CZ 3.35Å; D42-R58 IonicContact OD1-NH1 2.73Å; D42-R58 PolarHBondContact OD1-NH1 2.97Å; D42-R58 IonicContact OD2-NH1 3.8Å; D42-R58 PolarHBondContact OD2-NH1 3.37Å; L52-R58 HydrophobicContact CB-CB 4.28Å; L52-R58 HydrophobicContact CD1-CB 4.05Å; L52-R58 HydrophobicContact CD1-CG 3.97Å; S54-R58 WeakPolarHBondContact O-CB 2.99Å; S54-R58 PolarHBondContact O-N 2.99Å; E55-R58 WeakPolarHBondContact O-CB 3.42Å; E55-R58 PolarHBondContact O-N 3.08Å; E55-R58 VanDerWaalsContact O-N 3.16Å; E55-R58 IonicContact OE1-NH2 3.05Å; E55-R58 PolarHBondContact OE1-NH2 2.75Å; R58-H61 WeakPolarHBondContact O-CB 3.19Å; R58-H61 PolarHBondContact O-N 3.38Å; R58-Y62 HydrophobicContact CG-CD2 3.6Å; R58-Y62 HydrophobicContact CG-CE2 3.51Å; R58-Y62 PolarHBondContact O-N 3.19Å
59	V	89.6	Confident	88.7	Confident	59 Å²	59	81.6 Å²	81.6	36%	0.358	43%	0.429	S	S	.	.	H	α-helix	trans	-60.7	-52.5	178.7	175.3	0	0	0	0	110.2	E55 H61 Y62 E63	E55-V59 HydrophobicContact CG-CG2 4.49Å; E55-V59 WeakPolarHBondContact O-CG2 3.48Å; E55-V59 PolarHBondContact O-N 3.5Å; V59-H61 PolarHBondContact O-N 2.84Å; V59-Y62 PolarHBondContact O-N 3.29Å; V59-E63 HydrophobicContact CG1-CG 4.26Å; V59-E63 WeakPolarHBondContact O-CB 3.47Å; V59-E63 WeakPolarHBondContact O-CG 3.45Å; V59-E63 PolarHBondContact O-N 2.98Å
60	A	91.3	Very high	88.4	Confident	65 Å²	65	80.7 Å²	80.7	54%	0.537	41%	0.414	S	S	.	.	H	α-helix	trans	-59.4	-33.2	178.2	0	0	0	0	0	112.9	S56 S64	S56-A60 VanDerWaalsContact O-CB 3.31Å; S56-A60 WeakPolarHBondContact O-CB 3.41Å; S56-A60 PolarHBondContact O-N 3.05Å; S56-A60 VanDerWaalsContact O-N 3.08Å; A60-S64 WeakPolarHBondContact O-CB 3.48Å; A60-S64 PolarHBondContact O-N 2.86Å
61	H	91.9	Very high	88.2	Confident	37 Å²	37	80.6 Å²	80.6	17%	0.171	41%	0.411	C	S	.	.	H	α-helix	trans	-68.9	-55.2	176	-176.7	93.7	0	0	0	111.4	C48 L52 Q57 R58 V59 E63 S64 H67	C48-H61 VanDerWaalsContact CB-CE1 3.44Å; C48-H61 WeakPolarHBondContact CB-CE1 3.29Å; C48-H61 WeakPolarHBondContact CB-NE2 3.45Å; C48-H61 VanDerWaalsContact SG-CE1 3.5Å; C48-H61 PolarHBondContact SG-NE2 3.48Å; L52-H61 HydrophobicContact CD2-CB 3.76Å; Q57-H61 WeakPolarHBondContact O-CB 3.43Å; Q57-H61 PolarHBondContact O-N 2.99Å; R58-H61 WeakPolarHBondContact O-CB 3.19Å; R58-H61 PolarHBondContact O-N 3.38Å; V59-H61 PolarHBondContact O-N 2.84Å; H61-E63 VanDerWaalsContact C-N 3.35Å; H61-E63 PolarHBondContact O-N 2.92Å; H61-S64 VanDerWaalsContact O-CB 3.3Å; H61-S64 WeakPolarHBondContact O-CB 3.39Å; H61-S64 PolarHBondContact O-N 3.08Å; H61-S64 VanDerWaalsContact O-N 3.11Å; H61-S64 PolarHBondContact O-OG 2.97Å; H61-H67 AromaticContact CD2-CG 3.93Å; H61-H67 AromaticContact CD2-ND1 3.38Å; H61-H67 PolarHBondContact CD2-ND1 3.06Å; H61-H67 AromaticContact NE2-CE1 3.95Å; H61-H67 AromaticContact NE2-CG 3.9Å; H61-H67 AromaticContact NE2-ND1 3.08Å; H61-H67 PolarHBondContact NE2-ND1 3.47Å; H61-H67 WeakPolarHBondContact O-CB 3.41Å
62	Y	91.5	Very high	87.8	Confident	44 Å²	44	83 Å²	83	17%	0.173	42%	0.415	C	S	.	.	H	α-helix	trans	-68.8	-31.9	-174.1	-69.8	-36.8	0	0	0	113.3	F40 T41 C45 L52 R58 V59 S64 H67	F40-Y62 HydrophobicContact CB-CE1 4.4Å; F40-Y62 AromaticContact CD1-CE1 4Å; F40-Y62 HydrophobicContact CD1-CE1 4Å; T41-Y62 PolarHBondContact N-OH 3.18Å; T41-Y62 PolarHBondContact O-OH 3.3Å; C45-Y62 HydrophobicContact CB-CE1 3.86Å; L52-Y62 HydrophobicContact CD1-CE1 4.21Å; L52-Y62 HydrophobicContact CD1-CE2 3.85Å; L52-Y62 WeakPolarHBondContact CD1-OH 3.37Å; R58-Y62 HydrophobicContact CG-CD2 3.6Å; R58-Y62 HydrophobicContact CG-CE2 3.51Å; R58-Y62 PolarHBondContact O-N 3.19Å; V59-Y62 PolarHBondContact O-N 3.29Å; Y62-S64 VanDerWaalsContact C-N 3.27Å; Y62-S64 PolarHBondContact O-N 2.99Å; Y62-H67 AromaticContact CD1-CD2 3.96Å; Y62-H67 AromaticContact CD1-CE1 3.41Å; Y62-H67 VanDerWaalsContact CD1-CE1 3.41Å; Y62-H67 WeakPolarHBondContact CD1-CE1 3.38Å; Y62-H67 AromaticContact CD1-ND1 3.86Å; Y62-H67 AromaticContact CD1-NE2 3.46Å; Y62-H67 WeakPolarHBondContact CD1-NE2 3.19Å; Y62-H67 AromaticContact CE1-CE1 3.61Å; Y62-H67 PolarHBondContact O-CD2 2.87Å
63	E	89.6	Confident	87.1	Confident	146 Å²	146	83.3 Å²	83.3	68%	0.682	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-8.3	174.3	-63.7	-177.6	166.3	0	0	113.2	V59 H61	V59-E63 HydrophobicContact CG1-CG 4.26Å; V59-E63 WeakPolarHBondContact O-CB 3.47Å; V59-E63 WeakPolarHBondContact O-CG 3.45Å; V59-E63 PolarHBondContact O-N 2.98Å; H61-E63 VanDerWaalsContact C-N 3.35Å; H61-E63 PolarHBondContact O-N 2.92Å
64	S	84.6	Confident	86.6	Confident	34 Å²	34	79.3 Å²	79.3	24%	0.238	39%	0.393	C	S	.	.	S	Bend	trans	-69.9	139.7	-176.9	76.3	0	0	0	0	112.2	A60 H61 Y62 K66 H67 A68	A60-S64 WeakPolarHBondContact O-CB 3.48Å; A60-S64 PolarHBondContact O-N 2.86Å; H61-S64 VanDerWaalsContact O-CB 3.3Å; H61-S64 WeakPolarHBondContact O-CB 3.39Å; H61-S64 PolarHBondContact O-N 3.08Å; H61-S64 VanDerWaalsContact O-N 3.11Å; H61-S64 PolarHBondContact O-OG 2.97Å; Y62-S64 VanDerWaalsContact C-N 3.27Å; Y62-S64 PolarHBondContact O-N 2.99Å; S64-K66 PolarHBondContact O-N 3.08Å; S64-K66 VanDerWaalsContact O-N 3.1Å; S64-H67 PolarHBondContact O-N 3.19Å; S64-H67 VanDerWaalsContact O-N 3.09Å; S64-H67 VanDerWaalsContact OG-CB 3.26Å; S64-H67 WeakPolarHBondContact OG-CB 3.48Å; S64-H67 PolarHBondContact OG-N 2.84Å; S64-A68 PolarHBondContact O-N 3.16Å
65	R	83.6	Confident	86	Confident	220 Å²	220	80.2 Å²	80.2	83%	0.83	39%	0.389	S	S	*	.	H	α-helix	trans	-56.7	-27.1	169.6	-68.7	-174.8	179.8	179.5	0.4	112.9	N69	R65-N69 WeakPolarHBondContact O-CB 3.45Å; R65-N69 PolarHBondContact O-N 2.82Å; R65-N69 VanDerWaalsContact O-N 3.16Å; R65-N69 PolarHBondContact O-ND2 3.41Å
66	K	83.4	Confident	85.4	Confident	183 Å²	183	78.9 Å²	78.9	80%	0.796	38%	0.384	S	S	*	.	H	α-helix	trans	-68.9	-47.2	177.1	-67.4	-179.2	-178.4	176.3	0	110.6	S64 N69 K70	S64-K66 PolarHBondContact O-N 3.08Å; S64-K66 VanDerWaalsContact O-N 3.1Å; K66-N69 PolarHBondContact O-N 3.34Å; K66-K70 PolarHBondContact O-N 3.36Å; K66-K70 VanDerWaalsContact O-N 3.1Å
67	H	88.9	Confident	84.3	Confident	12 Å²	12	76 Å²	76	6%	0.056	36%	0.361	C	S	.	.	H	α-helix	trans	-62.2	-50.4	175.9	178.6	83.3	0	0	0	111.1	F40 C45 C48 H61 Y62 S64 N69 K70 V71	F40-H67 AromaticContact CD1-CE1 3.76Å; F40-H67 AromaticContact CD1-NE2 3.89Å; F40-H67 AromaticContact CE1-CE1 3.52Å; F40-H67 AromaticContact CE1-NE2 3.57Å; C45-H67 PolarHBondContact SG-CE1 3.1Å; C48-H67 PolarHBondContact SG-ND1 2.91Å; C48-H67 VanDerWaalsContact SG-ND1 3.42Å; H61-H67 AromaticContact CD2-CG 3.93Å; H61-H67 AromaticContact CD2-ND1 3.38Å; H61-H67 PolarHBondContact CD2-ND1 3.06Å; H61-H67 AromaticContact NE2-CE1 3.95Å; H61-H67 AromaticContact NE2-CG 3.9Å; H61-H67 AromaticContact NE2-ND1 3.08Å; H61-H67 PolarHBondContact NE2-ND1 3.47Å; H61-H67 WeakPolarHBondContact O-CB 3.41Å; Y62-H67 AromaticContact CD1-CD2 3.96Å; Y62-H67 AromaticContact CD1-CE1 3.41Å; Y62-H67 VanDerWaalsContact CD1-CE1 3.41Å; Y62-H67 WeakPolarHBondContact CD1-CE1 3.38Å; Y62-H67 AromaticContact CD1-ND1 3.86Å; Y62-H67 AromaticContact CD1-NE2 3.46Å; Y62-H67 WeakPolarHBondContact CD1-NE2 3.19Å; Y62-H67 AromaticContact CE1-CE1 3.61Å; Y62-H67 PolarHBondContact O-CD2 2.87Å; S64-H67 PolarHBondContact O-N 3.19Å; S64-H67 VanDerWaalsContact O-N 3.09Å; S64-H67 VanDerWaalsContact OG-CB 3.26Å; S64-H67 WeakPolarHBondContact OG-CB 3.48Å; S64-H67 PolarHBondContact OG-N 2.84Å; H67-N69 VanDerWaalsContact C-N 3.29Å; H67-N69 PolarHBondContact O-N 3.01Å; H67-K70 WeakPolarHBondContact O-CA 2.96Å; H67-K70 PolarHBondContact O-N 3.04Å; H67-V71 VanDerWaalsContact NE2-CG2 3.28Å; H67-V71 WeakPolarHBondContact NE2-CG2 3.32Å; H67-V71 WeakPolarHBondContact O-CG2 3.37Å; H67-V71 PolarHBondContact O-N 3.11Å
68	A	85.1	Confident	83.2	Confident	55 Å²	55	76.7 Å²	76.7	46%	0.455	36%	0.364	S	S	.	.	H	α-helix	trans	-54.8	-42.5	178.7	0	0	0	0	0	113.1	S64 R72	S64-A68 PolarHBondContact O-N 3.16Å; A68-R72 WeakPolarHBondContact O-CB 3.45Å; A68-R72 PolarHBondContact O-N 2.94Å
69	N	82.9	Confident	81.8	Confident	84 Å²	84	77 Å²	77	45%	0.449	37%	0.373	S	S	.	.	H	α-helix	trans	-67.7	-36.3	176.1	-79.1	-53.3	0	0	0	112.9	R65 K66 H67 R72 L73	R65-N69 WeakPolarHBondContact O-CB 3.45Å; R65-N69 PolarHBondContact O-N 2.82Å; R65-N69 VanDerWaalsContact O-N 3.16Å; R65-N69 PolarHBondContact O-ND2 3.41Å; K66-N69 PolarHBondContact O-N 3.34Å; H67-N69 VanDerWaalsContact C-N 3.29Å; H67-N69 PolarHBondContact O-N 3.01Å; N69-R72 PolarHBondContact OD1-NH2 3.44Å; N69-L73 WeakPolarHBondContact O-CB 3.47Å; N69-L73 PolarHBondContact O-N 3.22Å
70	K	81.1	Confident	80.2	Confident	66 Å²	66	78.4 Å²	78.4	29%	0.287	38%	0.381	S	S	.	.	H	α-helix	trans	-70.2	-38.3	178	-158.3	178.4	-172.9	-174.7	0	111.7	V47 C48 K66 H67 L73 Y74	V47-K70 HydrophobicContact CG1-CB 4.21Å; V47-K70 HydrophobicContact CG1-CD 4.28Å; V47-K70 HydrophobicContact CG1-CG 3.94Å; V47-K70 WeakPolarHBondContact O-CD 3.31Å; V47-K70 WeakPolarHBondContact O-CE 3.5Å; V47-K70 PolarHBondContact O-NZ 2.75Å; V47-K70 VanDerWaalsContact O-NZ 3.09Å; C48-K70 HydrophobicContact CB-CD 4.42Å; C48-K70 PolarHBondContact O-NZ 2.89Å; K66-K70 PolarHBondContact O-N 3.36Å; K66-K70 VanDerWaalsContact O-N 3.1Å; H67-K70 WeakPolarHBondContact O-CA 2.96Å; H67-K70 PolarHBondContact O-N 3.04Å; K70-L73 PolarHBondContact O-N 3.1Å; K70-Y74 WeakPolarHBondContact O-CB 3.49Å; K70-Y74 PolarHBondContact O-N 2.92Å
71	V	82.9	Confident	78.2	Confident	23 Å²	23	82.9 Å²	82.9	14%	0.139	40%	0.396	C	S	.	.	H	α-helix	trans	-63.6	-47.5	173.7	173.8	0	0	0	0	111.3	F40 V47 H67 L73 Y74 Y75	F40-V71 HydrophobicContact CE1-CG2 3.55Å; F40-V71 HydrophobicContact CZ-CB 4.45Å; F40-V71 HydrophobicContact CZ-CG1 3.89Å; F40-V71 HydrophobicContact CZ-CG2 3.65Å; V47-V71 HydrophobicContact CB-CG2 4.44Å; V47-V71 HydrophobicContact CG1-CG2 3.97Å; V47-V71 HydrophobicContact CG2-CG2 4.47Å; H67-V71 VanDerWaalsContact NE2-CG2 3.28Å; H67-V71 WeakPolarHBondContact NE2-CG2 3.32Å; H67-V71 WeakPolarHBondContact O-CG2 3.37Å; H67-V71 PolarHBondContact O-N 3.11Å; V71-L73 PolarHBondContact O-N 2.9Å; V71-Y74 WeakPolarHBondContact O-CB 2.91Å; V71-Y74 PolarHBondContact O-N 3.21Å; V71-Y74 VanDerWaalsContact O-N 3.07Å; V71-Y75 HydrophobicContact CG1-CD2 3.75Å; V71-Y75 HydrophobicContact CG1-CE2 3.38Å; V71-Y75 VanDerWaalsContact O-CD2 3.25Å; V71-Y75 WeakPolarHBondContact O-CD2 3.3Å; V71-Y75 PolarHBondContact O-N 3.32Å
72	R	83.2	Confident	76.2	Confident	165 Å²	165	84.7 Å²	84.7	62%	0.623	43%	0.425	S	S	*	.	H	α-helix	trans	-58.4	-39.2	175.2	-172	175.8	65.3	167.4	-1.6	112.1	A68 N69 M76	A68-R72 WeakPolarHBondContact O-CB 3.45Å; A68-R72 PolarHBondContact O-N 2.94Å; N69-R72 PolarHBondContact OD1-NH2 3.44Å; R72-M76 WeakPolarHBondContact O-CB 3.46Å; R72-M76 PolarHBondContact O-N 2.96Å
73	L	78.6	Confident	73.6	Confident	14 Å²	14	84.5 Å²	84.5	7%	0.073	44%	0.436	C	S	.	.	H	α-helix	trans	-68.3	-40.1	175	-179.3	56.4	0	0	0	112	N69 K70 V71 M76 L77 C105 N110	N69-L73 WeakPolarHBondContact O-CB 3.47Å; N69-L73 PolarHBondContact O-N 3.22Å; K70-L73 PolarHBondContact O-N 3.1Å; V71-L73 PolarHBondContact O-N 2.9Å; L73-M76 WeakPolarHBondContact O-CB 3.45Å; L73-M76 PolarHBondContact O-N 3.38Å; L73-L77 HydrophobicContact CD1-CD1 3.86Å; L73-L77 HydrophobicContact CD1-CG 4.05Å; L73-L77 HydrophobicContact CG-CD1 3.88Å; L73-L77 HydrophobicContact CG-CG 4.47Å; L73-L77 WeakPolarHBondContact O-CB 3.37Å; L73-L77 WeakPolarHBondContact O-CG 3.47Å; L73-L77 PolarHBondContact O-N 2.93Å; L73-C105 HydrophobicContact CD1-CB 4.3Å; L73-N110 VanDerWaalsContact CD2-O 3.29Å; L73-N110 WeakPolarHBondContact CD2-O 3.07Å
74	Y	80	Confident	71.3	Confident	59 Å²	59	82.6 Å²	82.6	23%	0.231	44%	0.438	C	S	.	.	H	α-helix	trans	-59.2	-49.5	178.5	178.8	-93.6	0	0	0	111.6	L39 V47 K70 V71 M76 L77 H78	L39-Y74 HydrophobicContact CD1-CD1 4.39Å; L39-Y74 HydrophobicContact CD1-CE1 3.59Å; L39-Y74 HydrophobicContact CD2-CE1 3.94Å; L39-Y74 WeakPolarHBondContact CD2-OH 3.45Å; L39-Y74 HydrophobicContact CG-CE1 4.43Å; V47-Y74 HydrophobicContact CG1-CG 4.35Å; V47-Y74 HydrophobicContact CG2-CD1 4.13Å; V47-Y74 HydrophobicContact CG2-CD2 4.31Å; V47-Y74 HydrophobicContact CG2-CG 4Å; K70-Y74 WeakPolarHBondContact O-CB 3.49Å; K70-Y74 PolarHBondContact O-N 2.92Å; V71-Y74 WeakPolarHBondContact O-CB 2.91Å; V71-Y74 PolarHBondContact O-N 3.21Å; V71-Y74 VanDerWaalsContact O-N 3.07Å; Y74-M76 VanDerWaalsContact C-N 3.31Å; Y74-M76 PolarHBondContact O-N 2.99Å; Y74-L77 PolarHBondContact O-N 3.27Å; Y74-L77 VanDerWaalsContact O-N 3.17Å; Y74-H78 AromaticContact CD2-CD2 3.86Å; Y74-H78 HydrophobicContact CE1-CB 4.45Å; Y74-H78 AromaticContact CE2-CD2 3.74Å; Y74-H78 WeakPolarHBondContact O-CB 2.93Å; Y74-H78 PolarHBondContact O-N 3.26Å
75	Y	79.3	Confident	69.6	Low	68 Å²	68	85.4 Å²	85.4	27%	0.267	46%	0.455	S	S	.	.	H	α-helix	trans	-68.7	-27.6	176.6	-68.2	-68.7	0	0	0	113.8	D36 V71 L77 H78 V80	D36-Y75 VanDerWaalsContact CG-OH 3.28Å; D36-Y75 PolarHBondContact OD1-OH 2.91Å; V71-Y75 HydrophobicContact CG1-CD2 3.75Å; V71-Y75 HydrophobicContact CG1-CE2 3.38Å; V71-Y75 VanDerWaalsContact O-CD2 3.25Å; V71-Y75 WeakPolarHBondContact O-CD2 3.3Å; V71-Y75 PolarHBondContact O-N 3.32Å; Y75-L77 VanDerWaalsContact C-N 3.3Å; Y75-H78 CarbonylContact O-C 3.59Å; Y75-V80 HydrophobicContact CD1-CG2 4.12Å; Y75-V80 HydrophobicContact CE1-CG2 4.29Å
76	M	76.3	Confident	67.7	Low	104 Å²	104	78.7 Å²	78.7	51%	0.512	45%	0.447	S	S	.	.	H	α-helix	trans	-67.9	-33	173.1	-176.1	-179.6	-63.4	0	0	112	R72 L73 Y74	R72-M76 WeakPolarHBondContact O-CB 3.46Å; R72-M76 PolarHBondContact O-N 2.96Å; L73-M76 WeakPolarHBondContact O-CB 3.45Å; L73-M76 PolarHBondContact O-N 3.38Å; Y74-M76 VanDerWaalsContact C-N 3.31Å; Y74-M76 PolarHBondContact O-N 2.99Å
77	L	68	Low	65.6	Low	29 Å²	29	79.7 Å²	79.7	15%	0.152	45%	0.451	C	S	.	.	H	α-helix	trans	-89.6	-29.4	-179.3	-76.9	176.1	0	0	0	113.7	L73 Y74 Y75 P79 C105 T107	L73-L77 HydrophobicContact CD1-CD1 3.86Å; L73-L77 HydrophobicContact CD1-CG 4.05Å; L73-L77 HydrophobicContact CG-CD1 3.88Å; L73-L77 HydrophobicContact CG-CG 4.47Å; L73-L77 WeakPolarHBondContact O-CB 3.37Å; L73-L77 WeakPolarHBondContact O-CG 3.47Å; L73-L77 PolarHBondContact O-N 2.93Å; Y74-L77 PolarHBondContact O-N 3.27Å; Y74-L77 VanDerWaalsContact O-N 3.17Å; Y75-L77 VanDerWaalsContact C-N 3.3Å; L77-P79 VanDerWaalsContact C-CD 3.43Å; L77-P79 WeakPolarHBondContact O-CD 3.42Å; L77-C105 HydrophobicContact CD2-CB 3.75Å; L77-C105 WeakPolarHBondContact CD2-SG 3.44Å; L77-C105 HydrophobicContact CG-CB 4.38Å; L77-T107 HydrophobicContact CD1-CG2 4.42Å; L77-T107 HydrophobicContact CD2-CG2 3.63Å
78	H	64.3	Low	63.5	Low	96 Å²	96	88 Å²	88	44%	0.444	49%	0.487	S	S	.	.	S	Bend	trans	-123.4	73	-179.2	-63.1	-82.8	0	0	0	109.2	Y74 Y75 V80	Y74-H78 AromaticContact CD2-CD2 3.86Å; Y74-H78 HydrophobicContact CE1-CB 4.45Å; Y74-H78 AromaticContact CE2-CD2 3.74Å; Y74-H78 WeakPolarHBondContact O-CB 2.93Å; Y74-H78 PolarHBondContact O-N 3.26Å; Y75-H78 CarbonylContact O-C 3.59Å; H78-V80 PolarHBondContact O-N 2.76Å
79	P	62.3	Low	61.5	Low	54 Å²	54	91.8 Å²	91.8	35%	0.351	50%	0.499	S	S	.	.			trans	-61.3	123.4	172.1	24.8	-31.1	0	0	0	108.7	L77 D81 G82	L77-P79 VanDerWaalsContact C-CD 3.43Å; L77-P79 WeakPolarHBondContact O-CD 3.42Å; P79-D81 PolarHBondContact O-N 3.36Å; P79-G82 PolarHBondContact O-N 3.42Å
80	V	56	Low	59.3	Low	89 Å²	89	98.4 Å²	98.4	54%	0.539	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-20	-170.2	-171.5	0	0	0	0	112.7	V35 Y75 H78	V35-V80 HydrophobicContact CG1-CG1 3.86Å; V35-V80 HydrophobicContact CG1-CG2 4.43Å; V35-V80 HydrophobicContact CG2-CG1 4.01Å; Y75-V80 HydrophobicContact CD1-CG2 4.12Å; Y75-V80 HydrophobicContact CE1-CG2 4.29Å; H78-V80 PolarHBondContact O-N 2.76Å
81	D	48.8	Very low	57.4	Low	158 Å²	158	101.8 Å²	101.8	85%	0.845	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	5.2	-176.9	-66.6	-48.7	0	0	0	115.2	P79 G83	P79-D81 PolarHBondContact O-N 3.36Å; D81-G83 PolarHBondContact O-N 2.95Å
82	G	50.1	Low	55.4	Low	75 Å²	75	107 Å²	107	77%	0.773	57%	0.571	S	S	*	*	S	Bend	trans	60.2	13.5	-174.4	0	0	0	0	0	114.2	P79	P79-G82 PolarHBondContact O-N 3.42Å
83	G	37.2	Very low	53.2	Low	40 Å²	40	106.3 Å²	106.3	41%	0.412	58%	0.579	S	S	.	*			trans	-96.2	126.8	179.1	0	0	0	0	0	111.5	D81	D81-G83 PolarHBondContact O-N 2.95Å
84	C	41.6	Very low	51.6	Low	106 Å²	106	109 Å²	109	72%	0.716	61%	0.61	S	S	*	*			trans	-50.7	142.4	174.5	-66.3	0	0	0	0	111.9	A86	C84-A86 PolarHBondContact O-N 3.04Å
85	P	47	Very low	49.7	Very low	93 Å²	93	112 Å²	112	60%	0.604	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-0.2	-177.1	-16.8	29	0	0	0	115.5
86	A	43.8	Very low	47.7	Very low	79 Å²	79	116 Å²	116	65%	0.653	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-10.9	-165.3	0	0	0	0	0	115.4	C84 K88	C84-A86 PolarHBondContact O-N 3.04Å; A86-K88 VanDerWaalsContact C-N 3.29Å; A86-K88 PolarHBondContact O-N 3.07Å; A86-K88 VanDerWaalsContact O-N 3.11Å
87	K	41	Very low	46.1	Very low	204 Å²	204	118 Å²	118	89%	0.887	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	19.5	-168.5	-91	-173.6	177.5	177.6	0	117
88	K	44.5	Very low	45.1	Very low	187 Å²	187	121.6 Å²	121.6	81%	0.813	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.4	48.2	170	-59.1	-172.1	-162.2	-77.7	0	112.9	A86	A86-K88 VanDerWaalsContact C-N 3.29Å; A86-K88 PolarHBondContact O-N 3.07Å; A86-K88 VanDerWaalsContact O-N 3.11Å
89	L	42.4	Very low	44.3	Very low	134 Å²	134	122.3 Å²	122.3	70%	0.702	71%	0.709	S	S	*	*	S	Bend	trans	-165.6	116.8	148.1	-107.9	143.5	0	0	0	110.7
90	R	36.8	Very low	43.6	Very low	224 Å²	224	125.3 Å²	125.3	85%	0.845	73%	0.726	S	S	*	*			trans	87.3	105.8	160.1	-54.3	-74.5	162.5	83.1	-5.8	116.8
91	T	41.8	Very low	43.6	Very low	137 Å²	137	125.5 Å²	125.5	84%	0.84	72%	0.724	S	S	*	*			trans	-53.5	145.9	149.2	-45.8	0	0	0	0	111.4
92	D	41	Very low	44.1	Very low	133 Å²	133	124.6 Å²	124.6	71%	0.711	71%	0.713	S	S	*	*			trans	95.1	127	155.5	-146	-108.4	0	0	0	120.4
93	N	36.9	Very low	44.9	Very low	149 Å²	149	123.1 Å²	123.1	80%	0.797	69%	0.687	S	S	*	*			trans	66.4	114	164.5	-88.5	-2.9	0	0	0	120.5
94	G	43.8	Very low	46.3	Very low	70 Å²	70	125.9 Å²	125.9	72%	0.722	69%	0.687	S	S	*	*			trans	-80.2	151.1	-179.2	0	0	0	0	0	114.6
95	S	40.2	Very low	47.6	Very low	122 Å²	122	121.7 Å²	121.7	85%	0.853	66%	0.659	S	S	*	*			trans	-167.1	134.3	135.5	-14.7	0	0	0	0	108.3
96	D	37.5	Very low	49.1	Very low	152 Å²	152	117.3 Å²	117.3	81%	0.813	63%	0.631	S	S	*	*			trans	71.6	104.8	149.3	-138.2	26.6	0	0	0	121.3
97	E	43.5	Very low	50.5	Low	148 Å²	148	118 Å²	118	69%	0.692	63%	0.627	S	S	*	*			trans	51.1	85.4	133.1	-62.8	-65.9	101.7	0	0	120.4	D99	E97-D99 PolarHBondContact O-N 3.01Å
98	S	45.6	Very low	52.2	Low	104 Å²	104	111.2 Å²	111.2	73%	0.727	60%	0.6	S	S	*	*				46.9	14.9	124.5	78.1	0	0	0	0	124.1
99	D	49.2	Very low	53.6	Low	111 Å²	111	102.8 Å²	102.8	59%	0.594	57%	0.565	S	S	*	*			trans	-98.7	6.7	-179.3	-155.8	42.2	0	0	0	116.7	E97 K102	E97-D99 PolarHBondContact O-N 3.01Å; D99-K102 IonicContact OD1-NZ 2.92Å; D99-K102 PolarHBondContact OD1-NZ 3.46Å
100	V	47.1	Very low	55	Low	117 Å²	117	99.1 Å²	99.1	71%	0.709	55%	0.546	S	S	*	.	S	Bend	trans	-92.6	-10.5	-170.4	-151.8	0	0	0	0	114.4
101	D	56.7	Low	56.8	Low	93 Å²	93	92.9 Å²	92.9	50%	0.497	53%	0.527	S	S	.	.	S	Bend	trans	-100.6	-16	-171.8	-129.4	-95.3	0	0	0	115.5	N103 K104	D101-N103 PolarHBondContact O-N 3.43Å; D101-K104 IonicContact OD2-NZ 3.39Å; D101-K104 PolarHBondContact OD2-NZ 3.22Å
102	K	58.8	Low	58.2	Low	139 Å²	139	89.5 Å²	89.5	60%	0.604	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-10.3	173	-68.1	171.7	-169.8	151.8	0	113.2	D99 Y123	D99-K102 IonicContact OD1-NZ 2.92Å; D99-K102 PolarHBondContact OD1-NZ 3.46Å; K102-Y123 WeakPolarHBondContact O-CE2 3.42Å; K102-Y123 PolarHBondContact O-OH 2.74Å
103	N	66.8	Low	60	Low	44 Å²	44	84.4 Å²	84.4	24%	0.235	48%	0.481	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-5.5	-161.2	-155.5	64.3	0	0	0	114.6	D101 A116 A119	D101-N103 PolarHBondContact O-N 3.43Å; N103-A116 VanDerWaalsContact CG-CB 3.44Å; N103-A116 WeakPolarHBondContact ND2-CA 3.47Å; N103-A116 WeakPolarHBondContact ND2-CB 3.31Å; N103-A116 PolarHBondContact ND2-N 2.99Å; N103-A116 WeakPolarHBondContact OD1-CA 3Å; N103-A116 WeakPolarHBondContact OD1-CB 3.47Å; N103-A116 PolarHBondContact OD1-O 3.25Å; N103-A119 WeakPolarHBondContact OD1-CB 3.38Å
104	K	66.7	Low	61.6	Low	97 Å²	97	84 Å²	84	42%	0.422	48%	0.484	S	S	.	.	S	Bend	trans	-95.5	-31.1	-173.7	-65.3	176.8	-176.2	167.7	0	112.2	D101 S112 F113	D101-K104 IonicContact OD2-NZ 3.39Å; D101-K104 PolarHBondContact OD2-NZ 3.22Å; K104-S112 WeakPolarHBondContact O-CA 3.49Å; K104-S112 WeakPolarHBondContact O-CB 3.25Å; K104-F113 PolarHBondContact O-N 3.25Å
105	C	69.4	Low	63	Low	18 Å²	18	83 Å²	83	12%	0.122	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.1	145.9	-173.1	37.9	0	0	0	0	113.7	L73 L77 M111 Y123	L73-C105 HydrophobicContact CD1-CB 4.3Å; L77-C105 HydrophobicContact CD2-CB 3.75Å; L77-C105 WeakPolarHBondContact CD2-SG 3.44Å; L77-C105 HydrophobicContact CG-CB 4.38Å; C105-M111 CarbonylContact C-O 3.54Å; C105-M111 WeakPolarHBondContact CA-O 3.46Å; C105-M111 VanDerWaalsContact CB-O 3.27Å; C105-M111 WeakPolarHBondContact CB-O 3.34Å; C105-Y123 VanDerWaalsContact C-OH 3.24Å; C105-Y123 PolarHBondContact O-OH 3.33Å
106	C	78.6	Confident	64.7	Low	2 Å²	2	79.1 Å²	79.1	1%	0.014	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	110.1	171.3	172.8	0	0	0	0	110	C109 N110 M111 F113 H122 Y123 H128	C106-C109 HydrophobicContact CB-CB 4.37Å; C106-C109 CarbonylContact O-C 3.6Å; C106-C109 PolarHBondContact O-N 3.41Å; C106-C109 PolarHBondContact SG-N 3.44Å; C106-C109 VanDerWaalsContact SG-N 3.38Å; C106-N110 WeakPolarHBondContact O-CA 3.19Å; C106-N110 PolarHBondContact O-N 3.24Å; C106-M111 PolarHBondContact N-O 3.32Å; C106-M111 PolarHBondContact O-N 3.31Å; C106-M111 VanDerWaalsContact O-N 3.09Å; C106-F113 HydrophobicContact CB-CE2 3.84Å; C106-F113 HydrophobicContact CB-CZ 3.79Å; C106-H122 WeakPolarHBondContact CB-NE2 3.31Å; C106-H122 PolarHBondContact SG-NE2 2.84Å; C106-Y123 WeakPolarHBondContact CA-OH 2.99Å; C106-Y123 HydrophobicContact CB-CE1 3.72Å; C106-Y123 PolarHBondContact N-OH 3.18Å; C106-H128 PolarHBondContact SG-CE1 3.17Å; C106-H128 PolarHBondContact SG-ND1 3.18Å
107	T	72.8	Confident	66.6	Low	92 Å²	92	77.1 Å²	77.1	56%	0.564	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-64.1	-38.7	175.7	49.2	0	0	0	0	112.4	L77 C109 N110	L77-T107 HydrophobicContact CD1-CG2 4.42Å; L77-T107 HydrophobicContact CD2-CG2 3.63Å; T107-C109 PolarHBondContact O-N 2.83Å; T107-C109 VanDerWaalsContact O-N 3.09Å; T107-N110 PolarHBondContact O-N 3.03Å
108	L	75.4	Confident	68.2	Low	62 Å²	62	73.3 Å²	73.3	33%	0.325	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-61.1	-23.1	177.6	-60.9	177.5	0	0	0	114	L132 L135	L108-L132 HydrophobicContact CD1-CB 4.48Å; L108-L132 HydrophobicContact CD1-CD1 3.32Å; L108-L132 HydrophobicContact CD1-CG 4.49Å; L108-L135 HydrophobicContact CD2-CD1 4.05Å
109	C	74.1	Confident	69.9	Low	11 Å²	11	68.4 Å²	68.4	7%	0.074	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-118.7	-0.1	-178.7	-66.4	0	0	0	0	112.6	C106 T107 M111 H122 R131	C106-C109 HydrophobicContact CB-CB 4.37Å; C106-C109 CarbonylContact O-C 3.6Å; C106-C109 PolarHBondContact O-N 3.41Å; C106-C109 PolarHBondContact SG-N 3.44Å; C106-C109 VanDerWaalsContact SG-N 3.38Å; T107-C109 PolarHBondContact O-N 2.83Å; T107-C109 VanDerWaalsContact O-N 3.09Å; C109-M111 HydrophobicContact CB-CG 4.04Å; C109-M111 VanDerWaalsContact O-CG 3.31Å; C109-M111 WeakPolarHBondContact O-CG 3.48Å; C109-M111 PolarHBondContact O-N 3.41Å; C109-H122 WeakPolarHBondContact CB-NE2 3.46Å; C109-R131 VanDerWaalsContact SG-CD 3.57Å
110	N	72	Confident	71.3	Confident	57 Å²	57	68.4 Å²	68.4	31%	0.305	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	45	47.3	-172.9	-148.3	78.3	0	0	0	112.9	L73 C106 T107	L73-N110 VanDerWaalsContact CD2-O 3.29Å; L73-N110 WeakPolarHBondContact CD2-O 3.07Å; C106-N110 WeakPolarHBondContact O-CA 3.19Å; C106-N110 PolarHBondContact O-N 3.24Å; T107-N110 PolarHBondContact O-N 3.03Å
111	M	75	Confident	73	Confident	92 Å²	92	66.8 Å²	66.8	45%	0.453	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	138.9	-177.5	-67.6	-148.7	70.6	0	0	111	C105 C106 C109 F113	C105-M111 CarbonylContact C-O 3.54Å; C105-M111 WeakPolarHBondContact CA-O 3.46Å; C105-M111 VanDerWaalsContact CB-O 3.27Å; C105-M111 WeakPolarHBondContact CB-O 3.34Å; C106-M111 PolarHBondContact N-O 3.32Å; C106-M111 PolarHBondContact O-N 3.31Å; C106-M111 VanDerWaalsContact O-N 3.09Å; C109-M111 HydrophobicContact CB-CG 4.04Å; C109-M111 VanDerWaalsContact O-CG 3.31Å; C109-M111 WeakPolarHBondContact O-CG 3.48Å; C109-M111 PolarHBondContact O-N 3.41Å; M111-F113 HydrophobicContact CB-CE1 4.11Å; M111-F113 HydrophobicContact CB-CZ 4.09Å
112	S	70.8	Confident	74.4	Confident	66 Å²	66	63.8 Å²	63.8	46%	0.462	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	152.6	168.8	50.9	0	0	0	0	112.3	K104	K104-S112 WeakPolarHBondContact O-CA 3.49Å; K104-S112 WeakPolarHBondContact O-CB 3.25Å
113	F	79.9	Confident	75.6	Confident	26 Å²	26	60.7 Å²	60.7	11%	0.114	35%	0.345	C	S	.	.			trans	-118.9	143.5	-176.7	-49.3	-62.4	0	0	0	110.7	K104 C106 M111 V118 A119 H122 Y123	K104-F113 PolarHBondContact O-N 3.25Å; C106-F113 HydrophobicContact CB-CE2 3.84Å; C106-F113 HydrophobicContact CB-CZ 3.79Å; M111-F113 HydrophobicContact CB-CE1 4.11Å; M111-F113 HydrophobicContact CB-CZ 4.09Å; F113-V118 HydrophobicContact CB-CG1 4.35Å; F113-V118 HydrophobicContact CD1-CG1 4Å; F113-A119 HydrophobicContact CB-CB 3.79Å; F113-A119 VanDerWaalsContact CD2-CA 3.44Å; F113-A119 HydrophobicContact CD2-CB 3.28Å; F113-A119 HydrophobicContact CE2-CB 4.02Å; F113-A119 VanDerWaalsContact CG-CA 3.44Å; F113-A119 HydrophobicContact CG-CB 3.61Å; F113-H122 HydrophobicContact CD1-CB 4.28Å; F113-H122 HydrophobicContact CE1-CB 3.37Å; F113-H122 AromaticContact CE1-CG 3.45Å; F113-H122 VanDerWaalsContact CE1-CG 3.45Å; F113-H122 AromaticContact CE1-ND1 3.73Å; F113-H122 HydrophobicContact CE2-CB 4.32Å; F113-H122 HydrophobicContact CZ-CB 3.42Å; F113-H122 VanDerWaalsContact CZ-CB 3.42Å; F113-H122 AromaticContact CZ-CD2 3.34Å; F113-H122 WeakPolarHBondContact CZ-CD2 3.39Å; F113-H122 AromaticContact CZ-CG 3.2Å; F113-H122 AromaticContact CZ-ND1 3.73Å; F113-H122 AromaticContact CZ-NE2 3.91Å; F113-Y123 HydrophobicContact CE2-CE2 4.05Å
114	T	69.8	Low	76.3	Confident	140 Å²	140	66.4 Å²	66.4	86%	0.859	37%	0.37	S	S	*	.	S	Bend	trans	-87.4	-9	178.8	51.9	0	0	0	0	113
115	S	73.5	Confident	77	Confident	50 Å²	50	62.8 Å²	62.8	35%	0.35	36%	0.361	S	S	.	.	S	Bend	trans	-163.8	167.4	178.9	66.8	0	0	0	0	111.7	V118 A119	S115-V118 PolarHBondContact O-N 3.42Å; S115-V118 VanDerWaalsContact OG-CG2 3.22Å; S115-V118 WeakPolarHBondContact OG-CG2 3.17Å; S115-A119 PolarHBondContact O-N 3.01Å; S115-A119 VanDerWaalsContact O-N 3.08Å
116	A	75.9	Confident	77.1	Confident	40 Å²	40	70.6 Å²	70.6	33%	0.331	39%	0.393	S	S	.	.	H	α-helix	trans	-65.5	-41.9	-178.5	0	0	0	0	0	115.8	N103 V118 A119 Q120	N103-A116 VanDerWaalsContact CG-CB 3.44Å; N103-A116 WeakPolarHBondContact ND2-CA 3.47Å; N103-A116 WeakPolarHBondContact ND2-CB 3.31Å; N103-A116 PolarHBondContact ND2-N 2.99Å; N103-A116 WeakPolarHBondContact OD1-CA 3Å; N103-A116 WeakPolarHBondContact OD1-CB 3.47Å; N103-A116 PolarHBondContact OD1-O 3.25Å; A116-V118 PolarHBondContact O-N 3.04Å; A116-A119 PolarHBondContact O-N 2.82Å; A116-A119 VanDerWaalsContact O-N 3.17Å; A116-Q120 WeakPolarHBondContact O-CB 3.22Å; A116-Q120 WeakPolarHBondContact O-CG 3.41Å; A116-Q120 PolarHBondContact O-N 3.48Å
117	V	77.8	Confident	77.1	Confident	110 Å²	110	76.5 Å²	76.5	67%	0.667	42%	0.423	S	S	*	.	H	α-helix	trans	-61.2	-37.3	178.3	-175.8	0	0	0	0	110.5	S121	V117-S121 WeakPolarHBondContact O-CB 3.05Å; V117-S121 PolarHBondContact O-N 2.94Å
118	V	76.9	Confident	77.5	Confident	69 Å²	69	72.7 Å²	72.7	42%	0.418	40%	0.399	S	S	.	.	H	α-helix	trans	-72.1	-39.7	178.2	178.2	0	0	0	0	111.4	F113 S115 A116 H122	F113-V118 HydrophobicContact CB-CG1 4.35Å; F113-V118 HydrophobicContact CD1-CG1 4Å; S115-V118 PolarHBondContact O-N 3.42Å; S115-V118 VanDerWaalsContact OG-CG2 3.22Å; S115-V118 WeakPolarHBondContact OG-CG2 3.17Å; A116-V118 PolarHBondContact O-N 3.04Å; V118-H122 PolarHBondContact O-N 3.25Å; V118-H122 VanDerWaalsContact O-N 3.12Å
119	A	79.9	Confident	77.8	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-63	-48.8	175.2	0	0	0	0	0	111.6	N103 F113 S115 A116 S121 H122 Y123	N103-A119 WeakPolarHBondContact OD1-CB 3.38Å; F113-A119 HydrophobicContact CB-CB 3.79Å; F113-A119 VanDerWaalsContact CD2-CA 3.44Å; F113-A119 HydrophobicContact CD2-CB 3.28Å; F113-A119 HydrophobicContact CE2-CB 4.02Å; F113-A119 VanDerWaalsContact CG-CA 3.44Å; F113-A119 HydrophobicContact CG-CB 3.61Å; S115-A119 PolarHBondContact O-N 3.01Å; S115-A119 VanDerWaalsContact O-N 3.08Å; A116-A119 PolarHBondContact O-N 2.82Å; A116-A119 VanDerWaalsContact O-N 3.17Å; A119-S121 VanDerWaalsContact C-N 3.35Å; A119-S121 PolarHBondContact O-N 2.87Å; A119-H122 WeakPolarHBondContact O-CA 2.98Å; A119-H122 VanDerWaalsContact O-CB 3.31Å; A119-H122 WeakPolarHBondContact O-CB 3.41Å; A119-H122 PolarHBondContact O-N 2.78Å; A119-Y123 HydrophobicContact CB-CE2 4.11Å; A119-Y123 WeakPolarHBondContact O-CD2 3.48Å; A119-Y123 PolarHBondContact O-N 3.5Å
120	Q	80.3	Confident	77.9	Confident	111 Å²	111	78.2 Å²	78.2	52%	0.519	43%	0.425	S	S	.	.	H	α-helix	trans	-59.5	-44.4	177.9	-73.2	179.6	-21.6	0	0	112.1	A116 H122 Y123 Q124	A116-Q120 WeakPolarHBondContact O-CB 3.22Å; A116-Q120 WeakPolarHBondContact O-CG 3.41Å; A116-Q120 PolarHBondContact O-N 3.48Å; Q120-H122 PolarHBondContact O-N 3.42Å; Q120-Y123 PolarHBondContact O-N 3.21Å; Q120-Q124 WeakPolarHBondContact O-CB 3.16Å; Q120-Q124 WeakPolarHBondContact O-CG 3.25Å; Q120-Q124 PolarHBondContact O-N 3.23Å
121	S	82.8	Confident	77.9	Confident	83 Å²	83	81.2 Å²	81.2	58%	0.58	43%	0.433	S	S	*	.	H	α-helix	trans	-60.6	-31.6	174.9	-179.6	0	0	0	0	112.5	V117 A119 G125	V117-S121 WeakPolarHBondContact O-CB 3.05Å; V117-S121 PolarHBondContact O-N 2.94Å; A119-S121 VanDerWaalsContact C-N 3.35Å; A119-S121 PolarHBondContact O-N 2.87Å; S121-G125 PolarHBondContact O-N 3.29Å
122	H	85.6	Confident	77.9	Confident	30 Å²	30	79.8 Å²	79.8	14%	0.139	43%	0.427	C	S	.	.	H	α-helix	trans	-70.3	-49.6	174.6	174.6	94.1	0	0	0	111.8	C106 C109 F113 V118 A119 Q120 Q124 G125 H128	C106-H122 WeakPolarHBondContact CB-NE2 3.31Å; C106-H122 PolarHBondContact SG-NE2 2.84Å; C109-H122 WeakPolarHBondContact CB-NE2 3.46Å; F113-H122 HydrophobicContact CD1-CB 4.28Å; F113-H122 HydrophobicContact CE1-CB 3.37Å; F113-H122 AromaticContact CE1-CG 3.45Å; F113-H122 VanDerWaalsContact CE1-CG 3.45Å; F113-H122 AromaticContact CE1-ND1 3.73Å; F113-H122 HydrophobicContact CE2-CB 4.32Å; F113-H122 HydrophobicContact CZ-CB 3.42Å; F113-H122 VanDerWaalsContact CZ-CB 3.42Å; F113-H122 AromaticContact CZ-CD2 3.34Å; F113-H122 WeakPolarHBondContact CZ-CD2 3.39Å; F113-H122 AromaticContact CZ-CG 3.2Å; F113-H122 AromaticContact CZ-ND1 3.73Å; F113-H122 AromaticContact CZ-NE2 3.91Å; V118-H122 PolarHBondContact O-N 3.25Å; V118-H122 VanDerWaalsContact O-N 3.12Å; A119-H122 WeakPolarHBondContact O-CA 2.98Å; A119-H122 VanDerWaalsContact O-CB 3.31Å; A119-H122 WeakPolarHBondContact O-CB 3.41Å; A119-H122 PolarHBondContact O-N 2.78Å; Q120-H122 PolarHBondContact O-N 3.42Å; H122-Q124 VanDerWaalsContact C-N 3.26Å; H122-Q124 PolarHBondContact O-N 3.24Å; H122-G125 PolarHBondContact O-N 3.08Å; H122-H128 AromaticContact CD2-ND1 3.6Å; H122-H128 AromaticContact NE2-CG 3.9Å; H122-H128 AromaticContact NE2-ND1 3.23Å; H122-H128 PolarHBondContact NE2-ND1 3.44Å; H122-H128 WeakPolarHBondContact O-CB 3.49Å
123	Y	83	Confident	77.9	Confident	74 Å²	74	84.2 Å²	84.2	29%	0.29	44%	0.437	S	S	.	.	H	α-helix	trans	-63.1	-33	-178.4	-67.5	-65.1	0	0	0	112.7	K102 C105 C106 F113 A119 Q120 G125 H128	K102-Y123 WeakPolarHBondContact O-CE2 3.42Å; K102-Y123 PolarHBondContact O-OH 2.74Å; C105-Y123 VanDerWaalsContact C-OH 3.24Å; C105-Y123 PolarHBondContact O-OH 3.33Å; C106-Y123 WeakPolarHBondContact CA-OH 2.99Å; C106-Y123 HydrophobicContact CB-CE1 3.72Å; C106-Y123 PolarHBondContact N-OH 3.18Å; F113-Y123 HydrophobicContact CE2-CE2 4.05Å; A119-Y123 HydrophobicContact CB-CE2 4.11Å; A119-Y123 WeakPolarHBondContact O-CD2 3.48Å; A119-Y123 PolarHBondContact O-N 3.5Å; Q120-Y123 PolarHBondContact O-N 3.21Å; Y123-G125 VanDerWaalsContact C-N 3.27Å; Y123-G125 PolarHBondContact O-N 3.45Å; Y123-H128 AromaticContact CD1-CE1 3.57Å; Y123-H128 AromaticContact CD1-NE2 3.59Å; Y123-H128 AromaticContact CE1-CE1 3.86Å; Y123-H128 PolarHBondContact O-CD2 3.03Å
124	Q	81.4	Confident	77.2	Confident	164 Å²	164	89.9 Å²	89.9	77%	0.766	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-2.4	174.7	-64.1	173.8	-4.6	0	0	113.2	Q120 H122	Q120-Q124 WeakPolarHBondContact O-CB 3.16Å; Q120-Q124 WeakPolarHBondContact O-CG 3.25Å; Q120-Q124 PolarHBondContact O-N 3.23Å; H122-Q124 VanDerWaalsContact C-N 3.26Å; H122-Q124 PolarHBondContact O-N 3.24Å
125	G	82.4	Confident	76.6	Confident	22 Å²	22	88.8 Å²	88.8	23%	0.227	46%	0.456	C	S	.	.	S	Bend	trans	-77.5	146.3	-176.1	0	0	0	0	0	113.7	S121 H122 Y123 I127 H128 A129	S121-G125 PolarHBondContact O-N 3.29Å; H122-G125 PolarHBondContact O-N 3.08Å; Y123-G125 VanDerWaalsContact C-N 3.27Å; Y123-G125 PolarHBondContact O-N 3.45Å; G125-I127 PolarHBondContact O-N 3.07Å; G125-I127 VanDerWaalsContact O-N 3.15Å; G125-H128 PolarHBondContact O-N 3Å; G125-H128 VanDerWaalsContact O-N 3.12Å; G125-A129 PolarHBondContact O-N 3.03Å
126	K	71.5	Confident	76.1	Confident	181 Å²	181	92.2 Å²	92.2	79%	0.787	47%	0.47	S	S	*	.	H	α-helix	trans	-58.5	-28.4	178.6	-62.4	-178.9	-178.2	178.9	0	113.6	K130	K126-K130 VanDerWaalsContact O-CB 3.25Å; K126-K130 WeakPolarHBondContact O-CB 2.96Å; K126-K130 PolarHBondContact O-N 3.07Å
127	I	77.8	Confident	74.7	Confident	126 Å²	126	93.1 Å²	93.1	65%	0.646	48%	0.483	S	S	*	.	H	α-helix	trans	-71.6	-46.2	177.5	-59.1	174.8	0	0	0	110.6	G125 K130 R131	G125-I127 PolarHBondContact O-N 3.07Å; G125-I127 VanDerWaalsContact O-N 3.15Å; I127-K130 PolarHBondContact O-N 2.87Å; I127-R131 PolarHBondContact O-N 3.02Å
128	H	82.2	Confident	73	Confident	13 Å²	13	96.2 Å²	96.2	6%	0.06	49%	0.49	C	S	.	.	H	α-helix	trans	-64.9	-46.5	176.8	-174.8	84.6	0	0	0	110.2	C106 H122 Y123 G125 K130 R131 L132	C106-H128 PolarHBondContact SG-CE1 3.17Å; C106-H128 PolarHBondContact SG-ND1 3.18Å; H122-H128 AromaticContact CD2-ND1 3.6Å; H122-H128 AromaticContact NE2-CG 3.9Å; H122-H128 AromaticContact NE2-ND1 3.23Å; H122-H128 PolarHBondContact NE2-ND1 3.44Å; H122-H128 WeakPolarHBondContact O-CB 3.49Å; Y123-H128 AromaticContact CD1-CE1 3.57Å; Y123-H128 AromaticContact CD1-NE2 3.59Å; Y123-H128 AromaticContact CE1-CE1 3.86Å; Y123-H128 PolarHBondContact O-CD2 3.03Å; G125-H128 PolarHBondContact O-N 3Å; G125-H128 VanDerWaalsContact O-N 3.12Å; H128-K130 VanDerWaalsContact C-N 3.33Å; H128-K130 PolarHBondContact O-N 3.17Å; H128-R131 PolarHBondContact O-N 3.29Å; H128-L132 VanDerWaalsContact O-CB 3.23Å; H128-L132 WeakPolarHBondContact O-CB 3.45Å; H128-L132 PolarHBondContact O-N 3.48Å
129	A	81.3	Confident	71.1	Confident	37 Å²	37	101 Å²	101	31%	0.306	51%	0.508	S	S	.	.	H	α-helix	trans	-59.3	-40	176.3	0	0	0	0	0	113	G125 K133	G125-A129 PolarHBondContact O-N 3.03Å; A129-K133 WeakPolarHBondContact O-CB 3.34Å; A129-K133 WeakPolarHBondContact O-CG 3.46Å; A129-K133 PolarHBondContact O-N 3.43Å
130	K	75.4	Confident	68.9	Low	151 Å²	151	106 Å²	106	66%	0.657	54%	0.541	S	S	*	.	H	α-helix	trans	-68.1	-41	177.2	-170	174.1	-177.5	178.5	0	112	K126 I127 H128 L134	K126-K130 VanDerWaalsContact O-CB 3.25Å; K126-K130 WeakPolarHBondContact O-CB 2.96Å; K126-K130 PolarHBondContact O-N 3.07Å; I127-K130 PolarHBondContact O-N 2.87Å; H128-K130 VanDerWaalsContact C-N 3.33Å; H128-K130 PolarHBondContact O-N 3.17Å; K130-L134 PolarHBondContact O-N 3.08Å; K130-L134 VanDerWaalsContact O-N 3.09Å
131	R	72.8	Confident	66.6	Low	121 Å²	121	105.1 Å²	105.1	46%	0.457	55%	0.552	S	S	.	*	H	α-helix	trans	-69.1	-39.9	175.7	-79.7	-177.6	172	177.7	-3.2	112.6	C109 I127 H128 L134 L135	C109-R131 VanDerWaalsContact SG-CD 3.57Å; I127-R131 PolarHBondContact O-N 3.02Å; H128-R131 PolarHBondContact O-N 3.29Å; R131-L134 PolarHBondContact O-N 3.3Å; R131-L135 WeakPolarHBondContact O-CB 3.33Å; R131-L135 PolarHBondContact O-N 3.05Å
132	L	75.1	Confident	64.6	Low	62 Å²	62	108.4 Å²	108.4	33%	0.325	56%	0.562	S	S	.	*	H	α-helix	trans	-59.8	-47.6	174.9	-175.7	71.4	0	0	0	110.4	L108 H128 L134 L135 L136	L108-L132 HydrophobicContact CD1-CB 4.48Å; L108-L132 HydrophobicContact CD1-CD1 3.32Å; L108-L132 HydrophobicContact CD1-CG 4.49Å; H128-L132 VanDerWaalsContact O-CB 3.23Å; H128-L132 WeakPolarHBondContact O-CB 3.45Å; H128-L132 PolarHBondContact O-N 3.48Å; L132-L134 VanDerWaalsContact C-N 3.33Å; L132-L134 PolarHBondContact O-N 3.33Å; L132-L135 PolarHBondContact O-N 3.02Å; L132-L136 HydrophobicContact CD1-CD1 3.83Å; L132-L136 HydrophobicContact CD1-CD2 4.3Å; L132-L136 WeakPolarHBondContact O-CB 3.23Å; L132-L136 PolarHBondContact O-N 3.24Å
133	K	70.9	Confident	62.1	Low	159 Å²	159	113.6 Å²	113.6	69%	0.691	60%	0.596	S	S	*	*	H	α-helix	trans	-63.1	-35	176.3	-74.1	176.8	178.9	-167.2	0	113.5	A129	A129-K133 WeakPolarHBondContact O-CB 3.34Å; A129-K133 WeakPolarHBondContact O-CG 3.46Å; A129-K133 PolarHBondContact O-N 3.43Å
134	L	64	Low	59.7	Low	144 Å²	144	115.3 Å²	115.3	75%	0.754	61%	0.614	S	S	*	*	H	α-helix	trans	-71.7	-33.4	178.1	-130.5	98.7	0	0	0	112.7	K130 R131 L132	K130-L134 PolarHBondContact O-N 3.08Å; K130-L134 VanDerWaalsContact O-N 3.09Å; R131-L134 PolarHBondContact O-N 3.3Å; L132-L134 VanDerWaalsContact C-N 3.33Å; L132-L134 PolarHBondContact O-N 3.33Å
135	L	58.3	Low	57.5	Low	118 Å²	118	116.5 Å²	116.5	62%	0.618	62%	0.617	S	S	*	*	H	α-helix	trans	-89.1	-31.6	-176.7	-80.6	162.2	0	0	0	113.5	L108 R131 L132 G137	L108-L135 HydrophobicContact CD2-CD1 4.05Å; R131-L135 WeakPolarHBondContact O-CB 3.33Å; R131-L135 PolarHBondContact O-N 3.05Å; L132-L135 PolarHBondContact O-N 3.02Å; L135-G137 VanDerWaalsContact C-N 3.28Å; L135-G137 PolarHBondContact O-N 3.49Å
136	L	61.8	Low	54.9	Low	121 Å²	121	124.7 Å²	124.7	63%	0.634	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-1.9	177.5	-96.1	65.6	0	0	0	113.9	L132 E138	L132-L136 HydrophobicContact CD1-CD1 3.83Å; L132-L136 HydrophobicContact CD1-CD2 4.3Å; L132-L136 WeakPolarHBondContact O-CB 3.23Å; L132-L136 PolarHBondContact O-N 3.24Å; L136-E138 PolarHBondContact O-N 3.01Å
137	G	48.3	Very low	53.3	Low	59 Å²	59	120 Å²	120	61%	0.608	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	59.3	49.9	166.7	0	0	0	0	0	114.5	L135	L135-G137 VanDerWaalsContact C-N 3.28Å; L135-G137 PolarHBondContact O-N 3.49Å
138	E	41.3	Very low	51	Low	175 Å²	175	119.1 Å²	119.1	82%	0.818	65%	0.649	S	S	*	*			trans	-88.3	111.1	160.3	-146.5	100.3	163.9	0	0	107.7	L136	L136-E138 PolarHBondContact O-N 3.01Å
139	Q	36.2	Very low	48.7	Very low	169 Å²	169	126.8 Å²	126.8	79%	0.79	69%	0.685	S	S	*	*			trans	-51.7	144	173.3	-70.3	-85.2	49.6	0	0	110.4	A141	Q139-A141 PolarHBondContact O-N 3.27Å
140	P	34.3	Very low	46.5	Very low	107 Å²	107	129.6 Å²	129.6	70%	0.695	70%	0.702	S	S	*	*			trans	-65.6	110	167	27.3	-29.4	0	0	0	108.3	I142	P140-I142 PolarHBondContact O-N 3.12Å
141	A	31.5	Very low	44.9	Very low	91 Å²	91	127.9 Å²	127.9	75%	0.752	71%	0.707	S	S	*	*			trans	-62.3	102.6	162	0	0	0	0	0	107.8	Q139 T143	Q139-A141 PolarHBondContact O-N 3.27Å; A141-T143 PolarHBondContact O-N 3Å; A141-T143 VanDerWaalsContact O-N 3.14Å
142	I	41.7	Very low	43.3	Very low	153 Å²	153	128.3 Å²	128.3	79%	0.785	72%	0.722	S	S	*	*			trans	-61.3	102.7	165	42	161.3	0	0	0	109.2	P140	P140-I142 PolarHBondContact O-N 3.12Å
143	T	33	Very low	41.2	Very low	138 Å²	138	134.5 Å²	134.5	85%	0.847	75%	0.747	S	S	*	*			trans	-103.2	95.7	156.4	56.5	0	0	0	0	108	A141	A141-T143 PolarHBondContact O-N 3Å; A141-T143 VanDerWaalsContact O-N 3.14Å
144	T	32	Very low	39.2	Very low	110 Å²	110	133.7 Å²	133.7	68%	0.675	75%	0.75	S	S	*	*			trans	-62.1	131.1	165.4	25.8	0	0	0	0	111.5
145	K	36.6	Very low	37.9	Very low	190 Å²	190	132 Å²	132	83%	0.826	75%	0.75	S	S	*	*			trans	66.2	131.4	143.7	-55.5	176.9	-177.5	-177.6	0	114.9
146	E	26.9	Very low	37.1	Very low	193 Å²	193	132.4 Å²	132.4	90%	0.902	76%	0.76	S	S	*	*				-140.2	144.9	66	-64.8	-171.1	117.5	0	0	114.5
147	A	37.8	Very low	36	Very low	83 Å²	83	135.1 Å²	135.1	69%	0.686	77%	0.769	S	S	*	*			trans	-94.2	148.8	164.6	0	0	0	0	0	109.5
148	S	29.8	Very low	35.1	Very low	108 Å²	108	139.2 Å²	139.2	76%	0.755	78%	0.782	S	S	*	*			trans	-164.4	93.8	156.3	-70.3	0	0	0	0	107
149	H	34.4	Very low	34.8	Very low	174 Å²	174	136.3 Å²	136.3	81%	0.806	78%	0.781	S	S	*	*				63.2	128.9	98	-69.1	-63.8	0	0	0	113.2
150	S	34.4	Very low	35.3	Very low	95 Å²	95	134 Å²	134	66%	0.664	78%	0.781	S	S	*	*			cis	-173.5	-149.4	1.6	-66.7	0	0	0	0	105.4
151	P	40.8	Very low	34.9	Very low	116 Å²	116	137.6 Å²	137.6	75%	0.753	79%	0.791	S	S	*	*				-121.2	156.4	-85.6	34.4	-16.2	0	0	0	115.6
152	V	40.2	Very low	35.6	Very low	129 Å²	129	142.1 Å²	142.1	78%	0.782	80%	0.799	S	S	*	*			trans	21.1	127	142.6	-164.3	0	0	0	0	119.9
153	K	30.8	Very low	35.1	Very low	193 Å²	193	138.9 Å²	138.9	84%	0.839	79%	0.79	S	S	*	*			trans	-149.1	111.3	142.8	-94.9	-179.4	-171.2	177.4	0	112.7
154	N	29.1	Very low	35.3	Very low	141 Å²	141	137.6 Å²	137.6	75%	0.754	78%	0.784	S	S	*	*			trans	56	126.3	131.2	-53.2	-8.7	0	0	0	122.2
155	S	36.3	Very low	35.5	Very low	110 Å²	110	142.9 Å²	142.9	77%	0.769	79%	0.791	S	S	*	*			trans	-68.7	163.7	159.7	-145.1	0	0	0	0	111.4
156	P	40.9	Very low	35.6	Very low	126 Å²	126	142.8 Å²	142.8	82%	0.818	79%	0.794	S	S	*	*				-147.4	170.9	88.5	35.3	-15.2	0	0	0	116.5
157	E	40.3	Very low	36.3	Very low	177 Å²	177	143.9 Å²	143.9	83%	0.827	79%	0.79	S	S	*	*			trans	-55.6	146.9	-180	-63.1	-167.9	90.9	0	0	116.8
158	T	29.2	Very low	36.6	Very low	145 Å²	145	149.8 Å²	149.8	89%	0.89	79%	0.794	S	S	*	*				-179.8	139.6	120.5	12.7	0	0	0	0	111.3
159	S	34.9	Very low	37.4	Very low	114 Å²	114	149.4 Å²	149.4	80%	0.797	78%	0.784	S	S	*	*			trans	-72.6	-171.4	179.1	-36.5	0	0	0	0	113
160	P	45.6	Very low	38.5	Very low	120 Å²	120	144.7 Å²	144.7	78%	0.779	77%	0.771	S	S	*	*			cis	-125.8	127	-29.4	31.8	-13.6	0	0	0	110.9
161	M	26.4	Very low	39.8	Very low	184 Å²	184	144.7 Å²	144.7	91%	0.906	76%	0.763	S	S	*	*			trans	-151	115.1	172.2	-161.4	82.2	161.1	0	0	111.1	S163	M161-S163 PolarHBondContact O-N 3.32Å
162	M	45.5	Very low	41.4	Very low	185 Å²	185	143.9 Å²	143.9	91%	0.911	75%	0.745	S	S	*	*			trans	-48.8	115.8	173.3	-67.5	-84.6	93.8	0	0	110.5
163	S	31.3	Very low	43.2	Very low	86 Å²	86	141 Å²	141	60%	0.601	72%	0.721	S	S	*	*			trans	-114.7	127	173.5	-143.6	0	0	0	0	109.6	M161 R165	M161-S163 PolarHBondContact O-N 3.32Å; S163-R165 PolarHBondContact O-N 3.4Å
164	P	39	Very low	45.8	Very low	110 Å²	110	132 Å²	132	71%	0.714	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-60.6	12	-175.9	-27	35.1	0	0	0	117.7	Q166	P164-Q166 PolarHBondContact O-N 2.96Å
165	R	35.5	Very low	48.2	Very low	222 Å²	222	132.4 Å²	132.4	84%	0.838	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-80	-11.9	-174	-71.9	-176.9	177	-119	1.6	114.7	S163 R167	S163-R165 PolarHBondContact O-N 3.4Å; R165-R167 VanDerWaalsContact C-N 3.28Å; R165-R167 PolarHBondContact O-N 3.15Å
166	Q	39	Very low	50.4	Low	188 Å²	188	131.1 Å²	131.1	88%	0.879	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-81.6	-2.8	173.3	-71.8	-163.3	-26	0	0	114.2	P164	P164-Q166 PolarHBondContact O-N 2.96Å
167	R	40.9	Very low	52.2	Low	216 Å²	216	127.5 Å²	127.5	82%	0.815	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-91.8	10.2	-179.5	-84.1	-80	-165.2	-146.3	0	115	R165	R165-R167 VanDerWaalsContact C-N 3.28Å; R165-R167 PolarHBondContact O-N 3.15Å
168	R	44.1	Very low	54	Low	206 Å²	206	125.1 Å²	125.1	78%	0.777	63%	0.633	S	S	*	*	S	Bend	trans	-112.6	-0.3	-178.5	-70.7	-161.6	-151.8	-155.7	5.9	116.4
169	D	47.6	Very low	56.2	Low	100 Å²	100	119.5 Å²	119.5	54%	0.535	60%	0.601	S	S	.	*	S	Bend	trans	-101	-8.7	179.2	-106.2	-40.6	0	0	0	114.2	D171	D169-D171 VanDerWaalsContact C-N 3.27Å; D169-D171 PolarHBondContact O-N 2.95Å
170	S	56.5	Low	58.5	Low	76 Å²	76	121.8 Å²	121.8	53%	0.531	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.5	-22.5	176	-80.1	0	0	0	0	113.9	Y191	S170-Y191 PolarHBondContact O-OH 3.12Å
171	D	61.8	Low	60.4	Low	94 Å²	94	117.9 Å²	117.9	50%	0.503	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.4	1.3	-173.6	-63.3	-20.6	0	0	0	113.7	D169 A187	D169-D171 VanDerWaalsContact C-N 3.27Å; D169-D171 PolarHBondContact O-N 2.95Å; D171-A187 WeakPolarHBondContact O-CB 3.37Å
172	R	74.3	Confident	62.8	Low	100 Å²	100	115.7 Å²	115.7	38%	0.377	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-121.3	-4.7	177.8	-80.4	-171.5	-88.5	-169.2	-3.3	113.6	F181	R172-F181 WeakPolarHBondContact CB-O 3.49Å; R172-F181 WeakPolarHBondContact CG-O 3.38Å; R172-F181 PolarHBondContact O-N 2.99Å
173	Y	79.3	Confident	64.4	Low	69 Å²	69	111 Å²	111	27%	0.271	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	120.7	-180	177.7	-110.4	0	0	0	111.5	Q175 N178 A179 W180 Y191	Y173-Q175 HydrophobicContact CD1-CG 3.86Å; Y173-Q175 HydrophobicContact CE1-CB 4.39Å; Y173-Q175 HydrophobicContact CE1-CG 3.58Å; Y173-N178 PolarHBondContact OH-ND2 3.09Å; Y173-N178 PolarHBondContact OH-OD1 3.35Å; Y173-A179 WeakPolarHBondContact CA-O 3.31Å; Y173-A179 WeakPolarHBondContact CD2-O 3.29Å; Y173-W180 HydrophobicContact CD2-CB 4.31Å; Y173-W180 HydrophobicContact CD2-CE3 4.03Å; Y173-W180 HydrophobicContact CG-CE3 4.28Å; Y173-Y191 VanDerWaalsContact C-OH 3.23Å; Y173-Y191 PolarHBondContact O-OH 2.71Å
174	C	83.9	Confident	66.6	Low	2 Å²	2	110 Å²	110	1%	0.014	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	110	175	174.3	0	0	0	0	109.8	C177 N178 A179 F181 H190 Y191 H196	C174-C177 HydrophobicContact CB-CB 4.45Å; C174-C177 PolarHBondContact O-N 3.03Å; C174-C177 PolarHBondContact SG-N 3.24Å; C174-N178 CarbonylContact O-C 3.53Å; C174-N178 WeakPolarHBondContact O-CA 3.43Å; C174-N178 PolarHBondContact O-N 3.22Å; C174-A179 HydrophobicContact CB-CB 4.49Å; C174-A179 PolarHBondContact N-O 3.42Å; C174-A179 PolarHBondContact O-N 2.96Å; C174-F181 HydrophobicContact CB-CE2 3.95Å; C174-H190 PolarHBondContact SG-NE2 3.2Å; C174-Y191 HydrophobicContact CB-CE1 3.8Å; C174-Y191 PolarHBondContact N-OH 3.47Å; C174-H196 PolarHBondContact SG-CE1 3.24Å; C174-H196 PolarHBondContact SG-ND1 3.23Å; C174-H196 VanDerWaalsContact SG-ND1 3.44Å
175	Q	80.1	Confident	68.7	Low	150 Å²	150	106.5 Å²	106.5	70%	0.701	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-38.7	177.1	-68.7	173.3	4.9	0	0	112	Y173 C177 N178	Y173-Q175 HydrophobicContact CD1-CG 3.86Å; Y173-Q175 HydrophobicContact CE1-CB 4.39Å; Y173-Q175 HydrophobicContact CE1-CG 3.58Å; Q175-C177 PolarHBondContact O-N 3.35Å; Q175-N178 PolarHBondContact O-N 3.38Å
176	L	82.1	Confident	70.8	Confident	84 Å²	84	101 Å²	101	44%	0.44	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-30.8	-179.8	-65.4	175.4	0	0	0	113.2	N199 A200 A203	L176-N199 PolarHBondContact O-ND2 2.86Å; L176-A200 HydrophobicContact CD1-CB 3.74Å; L176-A203 HydrophobicContact CD2-CB 3.66Å
177	C	78.3	Confident	72.9	Confident	49 Å²	49	92 Å²	92	33%	0.331	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	2.9	-179.7	-62.7	0	0	0	0	113	C174 Q175 A179 N199	C174-C177 HydrophobicContact CB-CB 4.45Å; C174-C177 PolarHBondContact O-N 3.03Å; C174-C177 PolarHBondContact SG-N 3.24Å; Q175-C177 PolarHBondContact O-N 3.35Å; C177-A179 HydrophobicContact CB-CB 4.23Å; C177-A179 PolarHBondContact O-N 3.3Å; C177-N199 PolarHBondContact SG-ND2 3.33Å; C177-N199 VanDerWaalsContact SG-ND2 3.41Å
178	N	79.4	Confident	75	Confident	127 Å²	127	86.4 Å²	86.4	68%	0.679	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.7	39.8	-174.2	-127.6	67	0	0	0	113.3	Y173 C174 Q175	Y173-N178 PolarHBondContact OH-ND2 3.09Å; Y173-N178 PolarHBondContact OH-OD1 3.35Å; C174-N178 CarbonylContact O-C 3.53Å; C174-N178 WeakPolarHBondContact O-CA 3.43Å; C174-N178 PolarHBondContact O-N 3.22Å; Q175-N178 PolarHBondContact O-N 3.38Å
179	A	75.4	Confident	77	Confident	27 Å²	27	83 Å²	83	22%	0.223	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	127.6	-169.2	0	0	0	0	0	111.3	Y173 C174 C177 F181	Y173-A179 WeakPolarHBondContact CA-O 3.31Å; Y173-A179 WeakPolarHBondContact CD2-O 3.29Å; C174-A179 HydrophobicContact CB-CB 4.49Å; C174-A179 PolarHBondContact N-O 3.42Å; C174-A179 PolarHBondContact O-N 2.96Å; C177-A179 HydrophobicContact CB-CB 4.23Å; C177-A179 PolarHBondContact O-N 3.3Å; A179-F181 HydrophobicContact CB-CE2 3.86Å; A179-F181 HydrophobicContact CB-CZ 3.76Å; A179-F181 WeakPolarHBondContact O-CE2 3.21Å
180	W	82.4	Confident	79	Confident	163 Å²	163	80.2 Å²	80.2	62%	0.617	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.6	132.8	176.1	-174.2	-76.8	0	0	0	111	Y173	Y173-W180 HydrophobicContact CD2-CB 4.31Å; Y173-W180 HydrophobicContact CD2-CE3 4.03Å; Y173-W180 HydrophobicContact CG-CE3 4.28Å
181	F	84.8	Confident	80.4	Confident	38 Å²	38	79.4 Å²	79.4	17%	0.167	40%	0.398	C	S	.	.			trans	-116.3	132.8	-178.6	-59.8	-78.8	0	0	0	110.4	R172 C174 A179 N183 A187 H190	R172-F181 WeakPolarHBondContact CB-O 3.49Å; R172-F181 WeakPolarHBondContact CG-O 3.38Å; R172-F181 PolarHBondContact O-N 2.99Å; C174-F181 HydrophobicContact CB-CE2 3.95Å; A179-F181 HydrophobicContact CB-CE2 3.86Å; A179-F181 HydrophobicContact CB-CZ 3.76Å; A179-F181 WeakPolarHBondContact O-CE2 3.21Å; F181-N183 VanDerWaalsContact C-N 3.29Å; F181-N183 PolarHBondContact O-N 2.8Å; F181-A187 HydrophobicContact CB-CB 3.78Å; F181-A187 HydrophobicContact CD2-CB 3.68Å; F181-A187 HydrophobicContact CG-CB 3.8Å; F181-H190 HydrophobicContact CE1-CB 3.79Å; F181-H190 HydrophobicContact CE2-CB 4.01Å; F181-H190 AromaticContact CE2-CD2 3.66Å; F181-H190 AromaticContact CE2-CG 3.77Å; F181-H190 HydrophobicContact CZ-CB 3.43Å; F181-H190 VanDerWaalsContact CZ-CB 3.43Å; F181-H190 AromaticContact CZ-CD2 3.59Å; F181-H190 AromaticContact CZ-CG 3.23Å; F181-H190 AromaticContact CZ-ND1 3.55Å
182	N	77.4	Confident	81.6	Confident	138 Å²	138	80.6 Å²	80.6	74%	0.738	40%	0.404	S	S	*	.	S	Bend	trans	-72	-25.1	-178.9	-113.2	4.2	0	0	0	113
183	N	78.9	Confident	82.3	Confident	86 Å²	86	76.9 Å²	76.9	46%	0.46	40%	0.397	S	S	.	.	S	Bend	trans	-132.7	132.9	-175.6	-179.1	19.9	0	0	0	109.9	F181 G185 M186 A187	F181-N183 VanDerWaalsContact C-N 3.29Å; F181-N183 PolarHBondContact O-N 2.8Å; N183-G185 PolarHBondContact O-N 2.79Å; N183-M186 HydrophobicContact CB-CG 4.38Å; N183-M186 PolarHBondContact O-N 3.22Å; N183-M186 VanDerWaalsContact O-N 3.08Å; N183-A187 PolarHBondContact O-N 3.49Å
184	P	78.1	Confident	82.5	Confident	64 Å²	64	82.2 Å²	82.2	42%	0.416	42%	0.421	S	S	.	.	H	α-helix	trans	-53.8	-35.1	175.4	20	-35.5	0	0	0	113.9	M186 A187 Q188	P184-M186 VanDerWaalsContact C-N 3.3Å; P184-M186 PolarHBondContact O-N 3.16Å; P184-A187 WeakPolarHBondContact O-CB 3.3Å; P184-A187 PolarHBondContact O-N 2.99Å; P184-Q188 PolarHBondContact O-N 3.09Å
185	G	83	Confident	82.6	Confident	37 Å²	37	91.1 Å²	91.1	38%	0.381	46%	0.46	S	S	.	.	H	α-helix	trans	-62.5	-34.6	177.6	0	0	0	0	0	113.8	N183 Q189	N183-G185 PolarHBondContact O-N 2.79Å; G185-Q189 WeakPolarHBondContact O-CG 3.35Å; G185-Q189 PolarHBondContact O-N 3.1Å
186	M	80.8	Confident	83.1	Confident	107 Å²	107	84.8 Å²	84.8	53%	0.527	43%	0.43	S	S	.	.	H	α-helix	trans	-76.5	-34.2	176.9	-69.9	-69.8	163.9	0	0	111.8	N183 P184 Q188 Q189 H190	N183-M186 HydrophobicContact CB-CG 4.38Å; N183-M186 PolarHBondContact O-N 3.22Å; N183-M186 VanDerWaalsContact O-N 3.08Å; P184-M186 VanDerWaalsContact C-N 3.3Å; P184-M186 PolarHBondContact O-N 3.16Å; M186-Q188 VanDerWaalsContact C-N 3.34Å; M186-Q189 PolarHBondContact O-N 3.1Å; M186-H190 PolarHBondContact O-N 3.22Å
187	A	82.8	Confident	83.3	Confident	0 Å²	0	87.8 Å²	87.8	0%	0	44%	0.44	C	S	.	.	H	α-helix	trans	-64.2	-42.3	172.4	0	0	0	0	0	110.8	D171 F181 N183 P184 Q189 H190 Y191	D171-A187 WeakPolarHBondContact O-CB 3.37Å; F181-A187 HydrophobicContact CB-CB 3.78Å; F181-A187 HydrophobicContact CD2-CB 3.68Å; F181-A187 HydrophobicContact CG-CB 3.8Å; N183-A187 PolarHBondContact O-N 3.49Å; P184-A187 WeakPolarHBondContact O-CB 3.3Å; P184-A187 PolarHBondContact O-N 2.99Å; A187-Q189 PolarHBondContact O-N 3Å; A187-H190 CarbonylContact O-C 3.56Å; A187-H190 WeakPolarHBondContact O-CA 3.39Å; A187-H190 VanDerWaalsContact O-CB 3.25Å; A187-H190 WeakPolarHBondContact O-CB 3.31Å; A187-H190 PolarHBondContact O-N 3.14Å; A187-Y191 VanDerWaalsContact C-CD2 3.47Å; A187-Y191 HydrophobicContact CB-CD2 4.39Å; A187-Y191 HydrophobicContact CB-CE2 3.83Å; A187-Y191 WeakPolarHBondContact O-CD2 3.14Å; A187-Y191 PolarHBondContact O-N 3.02Å
188	Q	83.8	Confident	83.6	Confident	98 Å²	98	93.1 Å²	93.1	46%	0.458	46%	0.457	S	S	.	.	H	α-helix	trans	-58.5	-48.2	176.1	-167.9	60.6	32.2	0	0	111.8	P184 M186 H190 Y191 D192	P184-Q188 PolarHBondContact O-N 3.09Å; M186-Q188 VanDerWaalsContact C-N 3.34Å; Q188-H190 PolarHBondContact O-N 3.09Å; Q188-Y191 PolarHBondContact O-N 3.04Å; Q188-Y191 VanDerWaalsContact O-N 3.1Å; Q188-D192 PolarHBondContact NE2-OD2 2.96Å; Q188-D192 VanDerWaalsContact NE2-OD2 3.11Å; Q188-D192 PolarHBondContact O-N 3.11Å
189	Q	86.3	Confident	83.6	Confident	133 Å²	133	89.7 Å²	89.7	62%	0.621	44%	0.439	S	S	*	.	H	α-helix	trans	-60	-30.7	174.1	-71.4	-178.9	-10.7	0	0	113.2	G185 M186 A187 G193	G185-Q189 WeakPolarHBondContact O-CG 3.35Å; G185-Q189 PolarHBondContact O-N 3.1Å; M186-Q189 PolarHBondContact O-N 3.1Å; A187-Q189 PolarHBondContact O-N 3Å; Q189-G193 PolarHBondContact O-N 2.85Å
190	H	89.3	Confident	84.1	Confident	43 Å²	43	89.7 Å²	89.7	20%	0.199	44%	0.439	C	S	.	.	H	α-helix	trans	-68.6	-48.5	172.3	169.2	83.2	0	0	0	111.9	C174 F181 M186 A187 Q188 D192 G193 H196	C174-H190 PolarHBondContact SG-NE2 3.2Å; F181-H190 HydrophobicContact CE1-CB 3.79Å; F181-H190 HydrophobicContact CE2-CB 4.01Å; F181-H190 AromaticContact CE2-CD2 3.66Å; F181-H190 AromaticContact CE2-CG 3.77Å; F181-H190 HydrophobicContact CZ-CB 3.43Å; F181-H190 VanDerWaalsContact CZ-CB 3.43Å; F181-H190 AromaticContact CZ-CD2 3.59Å; F181-H190 AromaticContact CZ-CG 3.23Å; F181-H190 AromaticContact CZ-ND1 3.55Å; M186-H190 PolarHBondContact O-N 3.22Å; A187-H190 CarbonylContact O-C 3.56Å; A187-H190 WeakPolarHBondContact O-CA 3.39Å; A187-H190 VanDerWaalsContact O-CB 3.25Å; A187-H190 WeakPolarHBondContact O-CB 3.31Å; A187-H190 PolarHBondContact O-N 3.14Å; Q188-H190 PolarHBondContact O-N 3.09Å; H190-D192 VanDerWaalsContact C-N 3.31Å; H190-D192 PolarHBondContact O-N 3.4Å; H190-G193 PolarHBondContact O-N 3.23Å; H190-H196 AromaticContact CD2-ND1 3.61Å; H190-H196 AromaticContact CE1-ND1 3.83Å; H190-H196 AromaticContact NE2-CE1 3.93Å; H190-H196 AromaticContact NE2-CG 3.78Å; H190-H196 AromaticContact NE2-ND1 3.03Å; H190-H196 PolarHBondContact NE2-ND1 2.96Å; H190-H196 WeakPolarHBondContact O-CB 3.13Å
191	Y	85.9	Confident	84.2	Confident	58 Å²	58	85.6 Å²	85.6	23%	0.227	43%	0.432	C	S	.	.	H	α-helix	trans	-61.4	-39.8	179.5	-64.5	-63.1	0	0	0	111.9	S170 Y173 C174 A187 Q188 G193 H196	S170-Y191 PolarHBondContact O-OH 3.12Å; Y173-Y191 VanDerWaalsContact C-OH 3.23Å; Y173-Y191 PolarHBondContact O-OH 2.71Å; C174-Y191 HydrophobicContact CB-CE1 3.8Å; C174-Y191 PolarHBondContact N-OH 3.47Å; A187-Y191 VanDerWaalsContact C-CD2 3.47Å; A187-Y191 HydrophobicContact CB-CD2 4.39Å; A187-Y191 HydrophobicContact CB-CE2 3.83Å; A187-Y191 WeakPolarHBondContact O-CD2 3.14Å; A187-Y191 PolarHBondContact O-N 3.02Å; Q188-Y191 PolarHBondContact O-N 3.04Å; Q188-Y191 VanDerWaalsContact O-N 3.1Å; Y191-G193 PolarHBondContact O-N 3.08Å; Y191-H196 AromaticContact CD1-CE1 3.73Å; Y191-H196 AromaticContact CD1-NE2 3.64Å; Y191-H196 PolarHBondContact O-CD2 3.35Å
192	D	87.9	Confident	84	Confident	119 Å²	119	89.7 Å²	89.7	64%	0.636	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-6.8	176.6	-62.9	-33.6	0	0	0	113	Q188 H190	Q188-D192 PolarHBondContact NE2-OD2 2.96Å; Q188-D192 VanDerWaalsContact NE2-OD2 3.11Å; Q188-D192 PolarHBondContact O-N 3.11Å; H190-D192 VanDerWaalsContact C-N 3.31Å; H190-D192 PolarHBondContact O-N 3.4Å
193	G	87.7	Confident	84	Confident	22 Å²	22	84.5 Å²	84.5	23%	0.227	42%	0.423	C	S	.	.	S	Bend	trans	-72.2	139	-176.7	0	0	0	0	0	113.7	Q189 H190 Y191 K195 H196 K197	Q189-G193 PolarHBondContact O-N 2.85Å; H190-G193 PolarHBondContact O-N 3.23Å; Y191-G193 PolarHBondContact O-N 3.08Å; G193-K195 PolarHBondContact O-N 3.35Å; G193-H196 PolarHBondContact O-N 3.28Å; G193-K197 PolarHBondContact O-N 3.01Å
194	K	84.7	Confident	84.1	Confident	181 Å²	181	84.2 Å²	84.2	79%	0.787	42%	0.422	S	S	*	.	H	α-helix	trans	-52.6	-31.7	177.4	-66.6	-179.1	-178.2	177.2	0	113.7	K198	K194-K198 VanDerWaalsContact O-CG 3.31Å; K194-K198 WeakPolarHBondContact O-CG 3.29Å; K194-K198 PolarHBondContact O-N 2.76Å
195	K	86.4	Confident	83.9	Confident	189 Å²	189	83.5 Å²	83.5	82%	0.822	41%	0.414	S	S	*	.	H	α-helix	trans	-74.3	-43.5	179.1	-168.5	-177.4	178.8	-170.9	0	111.9	G193 N199	G193-K195 PolarHBondContact O-N 3.35Å; K195-N199 PolarHBondContact O-N 3.13Å
196	H	89.4	Confident	83.3	Confident	17 Å²	17	85.5 Å²	85.5	8%	0.079	42%	0.415	C	S	.	.	H	α-helix	trans	-65.2	-47.3	175.9	-178.3	84	0	0	0	110.2	C174 H190 Y191 G193 K198 N199 A200	C174-H196 PolarHBondContact SG-CE1 3.24Å; C174-H196 PolarHBondContact SG-ND1 3.23Å; C174-H196 VanDerWaalsContact SG-ND1 3.44Å; H190-H196 AromaticContact CD2-ND1 3.61Å; H190-H196 AromaticContact CE1-ND1 3.83Å; H190-H196 AromaticContact NE2-CE1 3.93Å; H190-H196 AromaticContact NE2-CG 3.78Å; H190-H196 AromaticContact NE2-ND1 3.03Å; H190-H196 PolarHBondContact NE2-ND1 2.96Å; H190-H196 WeakPolarHBondContact O-CB 3.13Å; Y191-H196 AromaticContact CD1-CE1 3.73Å; Y191-H196 AromaticContact CD1-NE2 3.64Å; Y191-H196 PolarHBondContact O-CD2 3.35Å; G193-H196 PolarHBondContact O-N 3.28Å; H196-K198 VanDerWaalsContact C-N 3.32Å; H196-K198 PolarHBondContact O-N 3.09Å; H196-N199 CarbonylContact O-C 3.56Å; H196-N199 WeakPolarHBondContact O-CA 3.43Å; H196-N199 WeakPolarHBondContact O-CB 3.09Å; H196-N199 PolarHBondContact O-N 3.05Å; H196-A200 WeakPolarHBondContact O-CB 3.33Å; H196-A200 PolarHBondContact O-N 3.39Å
197	K	87.4	Confident	82.8	Confident	148 Å²	148	86.1 Å²	86.1	64%	0.643	42%	0.417	S	S	*	.	H	α-helix	trans	-53.5	-46.1	177.3	-170.4	169.1	-176	170.4	0	112.8	G193 N199 A200 T201	G193-K197 PolarHBondContact O-N 3.01Å; K197-N199 VanDerWaalsContact C-N 3.33Å; K197-N199 PolarHBondContact O-N 3.44Å; K197-A200 PolarHBondContact O-N 2.88Å; K197-T201 PolarHBondContact O-N 3.29Å; K197-T201 PolarHBondContact O-OG1 2.84Å
198	K	83.1	Confident	82.1	Confident	160 Å²	160	91 Å²	91	70%	0.696	44%	0.44	S	S	*	.	H	α-helix	trans	-61.7	-39.1	175.3	-75	178.6	-179.3	-172.5	0	112.9	K194 H196 R202	K194-K198 VanDerWaalsContact O-CG 3.31Å; K194-K198 WeakPolarHBondContact O-CG 3.29Å; K194-K198 PolarHBondContact O-N 2.76Å; H196-K198 VanDerWaalsContact C-N 3.32Å; H196-K198 PolarHBondContact O-N 3.09Å; K198-R202 WeakPolarHBondContact O-CB 3.14Å; K198-R202 PolarHBondContact O-N 3.3Å
199	N	80.8	Confident	81	Confident	55 Å²	55	89 Å²	89	29%	0.294	43%	0.432	S	S	.	.	H	α-helix	trans	-72.9	-37.4	178.7	-169.3	53.2	0	0	0	112.1	L176 C177 K195 H196 K197 R202 A203	L176-N199 PolarHBondContact O-ND2 2.86Å; C177-N199 PolarHBondContact SG-ND2 3.33Å; C177-N199 VanDerWaalsContact SG-ND2 3.41Å; K195-N199 PolarHBondContact O-N 3.13Å; H196-N199 CarbonylContact O-C 3.56Å; H196-N199 WeakPolarHBondContact O-CA 3.43Å; H196-N199 WeakPolarHBondContact O-CB 3.09Å; H196-N199 PolarHBondContact O-N 3.05Å; K197-N199 VanDerWaalsContact C-N 3.33Å; K197-N199 PolarHBondContact O-N 3.44Å; N199-R202 WeakPolarHBondContact O-CB 3.27Å; N199-R202 PolarHBondContact O-N 3.17Å; N199-A203 WeakPolarHBondContact O-CB 3.39Å; N199-A203 PolarHBondContact O-N 3.03Å
200	A	86.1	Confident	79.7	Confident	28 Å²	28	84.9 Å²	84.9	23%	0.231	43%	0.426	C	S	.	.	H	α-helix	trans	-64.5	-48.2	174.8	0	0	0	0	0	111.1	L176 H196 K197 R202 A203 D204	L176-A200 HydrophobicContact CD1-CB 3.74Å; H196-A200 WeakPolarHBondContact O-CB 3.33Å; H196-A200 PolarHBondContact O-N 3.39Å; K197-A200 PolarHBondContact O-N 2.88Å; A200-R202 VanDerWaalsContact C-N 3.27Å; A200-R202 PolarHBondContact O-N 3.05Å; A200-A203 PolarHBondContact O-N 2.92Å; A200-A203 VanDerWaalsContact O-N 3.1Å; A200-D204 WeakPolarHBondContact O-CB 3.49Å; A200-D204 PolarHBondContact O-N 3.27Å
201	T	83.6	Confident	78	Confident	76 Å²	76	89.4 Å²	89.4	47%	0.466	45%	0.447	S	S	.	.	H	α-helix	trans	-59.4	-39.9	173	-52.6	0	0	0	0	111.5	K197 L205	K197-T201 PolarHBondContact O-N 3.29Å; K197-T201 PolarHBondContact O-OG1 2.84Å; T201-L205 HydrophobicContact CG2-CD1 4.32Å; T201-L205 WeakPolarHBondContact O-CB 3.01Å; T201-L205 WeakPolarHBondContact O-CG 3.48Å; T201-L205 PolarHBondContact O-N 3.48Å
202	R	81.8	Confident	76.4	Confident	124 Å²	124	91.9 Å²	91.9	47%	0.468	47%	0.468	S	S	.	.	H	α-helix	trans	-61.6	-46.5	173.9	178.2	-176.3	174.4	89.3	3.7	111.4	K198 N199 A200 L205 L206	K198-R202 WeakPolarHBondContact O-CB 3.14Å; K198-R202 PolarHBondContact O-N 3.3Å; N199-R202 WeakPolarHBondContact O-CB 3.27Å; N199-R202 PolarHBondContact O-N 3.17Å; A200-R202 VanDerWaalsContact C-N 3.27Å; A200-R202 PolarHBondContact O-N 3.05Å; R202-L205 PolarHBondContact O-N 3.44Å; R202-L206 HydrophobicContact CG-CD1 3.73Å; R202-L206 WeakPolarHBondContact O-CD1 3.45Å; R202-L206 PolarHBondContact O-N 3.47Å
203	A	76.9	Confident	74.4	Confident	30 Å²	30	91.1 Å²	91.1	25%	0.248	46%	0.463	C	S	.	.	H	α-helix	trans	-65.5	-42.7	-178.7	0	0	0	0	0	112.2	L176 N199 A200 L205 L206 E207	L176-A203 HydrophobicContact CD2-CB 3.66Å; N199-A203 WeakPolarHBondContact O-CB 3.39Å; N199-A203 PolarHBondContact O-N 3.03Å; A200-A203 PolarHBondContact O-N 2.92Å; A200-A203 VanDerWaalsContact O-N 3.1Å; A203-L205 VanDerWaalsContact C-N 3.34Å; A203-L205 PolarHBondContact O-N 3.3Å; A203-L206 CarbonylContact O-C 3.55Å; A203-L206 WeakPolarHBondContact O-CA 3.47Å; A203-L206 WeakPolarHBondContact O-CB 3.44Å; A203-L206 PolarHBondContact O-N 3.41Å; A203-E207 PolarHBondContact O-N 3.05Å
204	D	80.1	Confident	72.3	Confident	80 Å²	80	95.9 Å²	95.9	43%	0.428	48%	0.483	S	S	.	.	H	α-helix	trans	-59.3	-43.8	174.2	-178.7	65.4	0	0	0	111.5	A200 L206 E207 Q208	A200-D204 WeakPolarHBondContact O-CB 3.49Å; A200-D204 PolarHBondContact O-N 3.27Å; D204-L206 VanDerWaalsContact C-N 3.33Å; D204-L206 PolarHBondContact O-N 2.88Å; D204-E207 PolarHBondContact O-N 2.95Å; D204-Q208 WeakPolarHBondContact O-CG 3.28Å; D204-Q208 PolarHBondContact O-N 2.79Å; D204-Q208 PolarHBondContact OD2-NE2 3.23Å
205	L	73.9	Confident	70.5	Confident	48 Å²	48	94.9 Å²	94.9	25%	0.251	48%	0.484	S	S	.	.	H	α-helix	trans	-61.2	-40.8	172.2	-70.4	170.6	0	0	0	112	T201 R202 A203 E207 L209	T201-L205 HydrophobicContact CG2-CD1 4.32Å; T201-L205 WeakPolarHBondContact O-CB 3.01Å; T201-L205 WeakPolarHBondContact O-CG 3.48Å; T201-L205 PolarHBondContact O-N 3.48Å; R202-L205 PolarHBondContact O-N 3.44Å; A203-L205 VanDerWaalsContact C-N 3.34Å; A203-L205 PolarHBondContact O-N 3.3Å; L205-E207 VanDerWaalsContact C-N 3.32Å; L205-E207 PolarHBondContact O-N 3.23Å; L205-L209 WeakPolarHBondContact O-CD1 3.36Å; L205-L209 PolarHBondContact O-N 3.09Å
206	L	70.1	Confident	68.6	Low	79 Å²	79	89.1 Å²	89.1	41%	0.414	48%	0.478	S	S	.	.	H	α-helix	trans	-64.8	-36.8	175.5	-91	85.8	0	0	0	112.1	R202 A203 D204 G210 V237	R202-L206 HydrophobicContact CG-CD1 3.73Å; R202-L206 WeakPolarHBondContact O-CD1 3.45Å; R202-L206 PolarHBondContact O-N 3.47Å; A203-L206 CarbonylContact O-C 3.55Å; A203-L206 WeakPolarHBondContact O-CA 3.47Å; A203-L206 WeakPolarHBondContact O-CB 3.44Å; A203-L206 PolarHBondContact O-N 3.41Å; D204-L206 VanDerWaalsContact C-N 3.33Å; D204-L206 PolarHBondContact O-N 2.88Å; L206-G210 PolarHBondContact O-N 3.28Å; L206-G210 VanDerWaalsContact O-N 3.08Å; L206-V237 HydrophobicContact CD1-CG2 4.19Å
207	E	71.9	Confident	66.4	Low	121 Å²	121	97.4 Å²	97.4	57%	0.565	52%	0.517	S	S	*	.	H	α-helix	trans	-70.7	-43.8	179.7	-170	173.5	151.9	0	0	111.8	A203 D204 L205 L209 G210 Q211	A203-E207 PolarHBondContact O-N 3.05Å; D204-E207 PolarHBondContact O-N 2.95Å; L205-E207 VanDerWaalsContact C-N 3.32Å; L205-E207 PolarHBondContact O-N 3.23Å; E207-L209 VanDerWaalsContact C-N 3.3Å; E207-L209 PolarHBondContact O-N 3.24Å; E207-G210 WeakPolarHBondContact O-CA 3.4Å; E207-G210 PolarHBondContact O-N 3.46Å; E207-Q211 PolarHBondContact O-N 3.42Å
208	Q	67.9	Low	64.3	Low	102 Å²	102	98.9 Å²	98.9	48%	0.477	53%	0.528	S	S	.	.	H	α-helix	trans	-60.2	-38.3	175.1	-72.7	178.4	6	0	0	112.2	D204 G210 Q211 T212	D204-Q208 WeakPolarHBondContact O-CG 3.28Å; D204-Q208 PolarHBondContact O-N 2.79Å; D204-Q208 PolarHBondContact OD2-NE2 3.23Å; Q208-G210 VanDerWaalsContact C-N 3.33Å; Q208-Q211 PolarHBondContact O-N 3.45Å; Q208-T212 PolarHBondContact O-N 3.42Å
209	L	60.4	Low	62.5	Low	56 Å²	56	101.5 Å²	101.5	29%	0.293	54%	0.539	S	S	.	.	H	α-helix	trans	-70	-30	172.9	-87.2	93.4	0	0	0	113	L205 E207 Q211 T212 Y225 Y240	L205-L209 WeakPolarHBondContact O-CD1 3.36Å; L205-L209 PolarHBondContact O-N 3.09Å; E207-L209 VanDerWaalsContact C-N 3.3Å; E207-L209 PolarHBondContact O-N 3.24Å; L209-Q211 VanDerWaalsContact C-N 3.3Å; L209-T212 WeakPolarHBondContact CA-OG1 3.46Å; L209-T212 PolarHBondContact O-N 3.08Å; L209-T212 PolarHBondContact O-OG1 3.38Å; L209-Y225 HydrophobicContact CD2-CD1 4.34Å; L209-Y240 HydrophobicContact CD2-CD1 4.39Å; L209-Y240 HydrophobicContact CD2-CE1 4.19Å
210	G	58.5	Low	60.9	Low	47 Å²	47	101.9 Å²	101.9	49%	0.485	56%	0.556	S	S	.	*	H	α-helix	trans	-67.7	-29.2	174.6	0	0	0	0	0	113.1	L206 E207 Q208	L206-G210 PolarHBondContact O-N 3.28Å; L206-G210 VanDerWaalsContact O-N 3.08Å; E207-G210 WeakPolarHBondContact O-CA 3.4Å; E207-G210 PolarHBondContact O-N 3.46Å; Q208-G210 VanDerWaalsContact C-N 3.33Å
211	Q	54.1	Low	59.2	Low	137 Å²	137	108 Å²	108	64%	0.64	58%	0.584	S	S	*	*	H	α-helix	trans	-81.5	-23.2	177.2	-66.6	175	16.1	0	0	113.1	E207 Q208 L209 L213	E207-Q211 PolarHBondContact O-N 3.42Å; Q208-Q211 PolarHBondContact O-N 3.45Å; L209-Q211 VanDerWaalsContact C-N 3.3Å; Q211-L213 VanDerWaalsContact C-N 3.31Å
212	T	51.6	Low	57.6	Low	110 Å²	110	111.7 Å²	111.7	68%	0.675	59%	0.594	S	S	*	*	S	Bend	trans	-80.7	-8.5	173.2	49.7	0	0	0	0	114.2	Q208 L209	Q208-T212 PolarHBondContact O-N 3.42Å; L209-T212 WeakPolarHBondContact CA-OG1 3.46Å; L209-T212 PolarHBondContact O-N 3.08Å; L209-T212 PolarHBondContact O-OG1 3.38Å
213	L	47.3	Very low	56.5	Low	104 Å²	104	115.4 Å²	115.4	55%	0.545	61%	0.608	S	S	.	*	S	Bend	trans	-118.9	74.6	176.6	-65.2	176.6	0	0	0	108.4	Q211	Q211-L213 VanDerWaalsContact C-N 3.31Å
214	D	42.3	Very low	55.9	Low	121 Å²	121	116.9 Å²	116.9	65%	0.647	62%	0.617	S	S	*	*			trans	-76.7	142.6	-175.7	-167.6	26.8	0	0	0	113
215	M	48.1	Very low	55.7	Low	161 Å²	161	115.4 Å²	115.4	79%	0.793	61%	0.605	S	S	*	*	S	Bend	trans	56.9	84.5	159.6	-113.4	79.3	77.5	0	0	119.6
216	G	46.4	Very low	56	Low	68 Å²	68	116.6 Å²	116.6	70%	0.701	62%	0.615	S	S	*	*			trans	139.9	134.2	149.7	0	0	0	0	0	114.1
217	E	41.5	Very low	56.6	Low	190 Å²	190	112.9 Å²	112.9	89%	0.888	60%	0.595	S	S	*	*			trans	82.7	88.7	161	-51.2	-166.8	121.7	0	0	117.7
218	M	43.5	Very low	56.9	Low	179 Å²	179	115.6 Å²	115.6	88%	0.882	61%	0.608	S	S	*	*				87.8	108.9	121.3	-152.4	138.7	85.8	0	0	117.5	G220	M218-G220 PolarHBondContact O-N 2.95Å
219	K	47	Very low	57.5	Low	215 Å²	215	112.5 Å²	112.5	94%	0.935	60%	0.596	S	S	*	*	S	Bend	trans	-41.1	103.5	156.2	-70.8	172.3	174.4	175.5	0	111
220	G	46.9	Very low	58.5	Low	63 Å²	63	111.7 Å²	111.7	65%	0.649	60%	0.595	S	S	*	*	S	Bend	trans	144	115.7	164.1	0	0	0	0	0	111.9	M218	M218-G220 PolarHBondContact O-N 2.95Å
221	L	49.9	Very low	59.6	Low	157 Å²	157	112.2 Å²	112.2	82%	0.822	60%	0.6	S	S	*	*			trans	76.8	77.9	158.7	-154	74.6	0	0	0	117.4
222	K	50.1	Low	60.9	Low	154 Å²	154	108.3 Å²	108.3	67%	0.67	59%	0.585	S	S	*	*			trans	-125	88.6	147.1	-93.7	-173.1	178.1	-178.6	0	110.7	S224	K222-S224 VanDerWaalsContact C-N 3.32Å
223	R	58.9	Low	62.3	Low	202 Å²	202	107 Å²	107	76%	0.762	58%	0.577	S	S	*	*			trans	-91.9	7	164.7	-73.5	177.8	68.4	101	-3.1	111.9
224	S	64.1	Low	63.9	Low	61 Å²	61	104 Å²	104	43%	0.427	56%	0.561	S	S	.	*			trans	-123.7	131.1	-178.3	44.3	0	0	0	0	110.8	K222 L234	K222-S224 VanDerWaalsContact C-N 3.32Å; S224-L234 CarbonylContact C-O 3.55Å; S224-L234 WeakPolarHBondContact CA-O 3.41Å
225	Y	76.4	Confident	65.6	Low	49 Å²	49	104 Å²	104	19%	0.192	56%	0.561	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.1	111.4	179.7	-58.8	-89.6	0	0	0	108	L209 T233 L234 V237 Y240	L209-Y225 HydrophobicContact CD2-CD1 4.34Å; Y225-T233 CarbonylContact O-C 3.59Å; Y225-T233 WeakPolarHBondContact O-CA 3.26Å; Y225-L234 PolarHBondContact N-O 3.34Å; Y225-L234 PolarHBondContact O-N 3.25Å; Y225-V237 HydrophobicContact CE1-CG2 3.66Å; Y225-V237 HydrophobicContact CE2-CG2 3.81Å; Y225-V237 WeakPolarHBondContact OH-CG2 3.38Å; Y225-Y240 HydrophobicContact CG-CG 4.39Å
226	T	79	Confident	66.9	Low	73 Å²	73	98.1 Å²	98.1	45%	0.448	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	130.5	-176.5	-53.9	0	0	0	0	110.1	V232 T233	T226-V232 CarbonylContact C-O 3.4Å; T226-V232 VanDerWaalsContact CA-O 3.32Å; T226-V232 WeakPolarHBondContact CA-O 3.44Å; T226-T233 WeakPolarHBondContact CG2-OG1 3.04Å; T226-T233 PolarHBondContact OG1-OG1 2.97Å
227	C	82.4	Confident	68.4	Low	1 Å²	1	95.5 Å²	95.5	1%	0.007	51%	0.507	C	S	.	.			trans	-88.8	120.2	174.9	175.7	0	0	0	0	109.1	C230 G231 V232 Y240 H243 H249	C227-C230 HydrophobicContact CB-CB 4.35Å; C227-C230 PolarHBondContact O-N 3.18Å; C227-C230 PolarHBondContact SG-N 2.86Å; C227-G231 WeakPolarHBondContact O-CA 3.42Å; C227-G231 PolarHBondContact O-N 2.69Å; C227-V232 HydrophobicContact CB-CG2 3.82Å; C227-V232 PolarHBondContact N-O 2.91Å; C227-Y240 HydrophobicContact CB-CE2 3.78Å; C227-H243 WeakPolarHBondContact CB-NE2 3.49Å; C227-H243 PolarHBondContact SG-NE2 2.95Å; C227-H249 PolarHBondContact SG-CE1 3.05Å; C227-H249 PolarHBondContact SG-ND1 3.11Å; C227-H249 VanDerWaalsContact SG-ND1 3.4Å
228	E	79.3	Confident	70.1	Confident	177 Å²	177	89.4 Å²	89.4	83%	0.827	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-32.3	-177.5	-63.8	177.3	-176.2	0	0	112.6
229	V	80.1	Confident	71.8	Confident	38 Å²	38	85.4 Å²	85.4	23%	0.23	47%	0.468	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-34	178.9	-179	0	0	0	0	111.8	N252 L253 Q256	V229-N252 HydrophobicContact CG1-CB 4.09Å; V229-L253 HydrophobicContact CG1-CB 4.3Å; V229-L253 HydrophobicContact CG1-CD1 4.44Å; V229-L253 HydrophobicContact CG2-CD1 3.91Å; V229-Q256 PolarHBondContact O-NE2 2.73Å; V229-Q256 VanDerWaalsContact O-NE2 3.1Å
230	C	81.3	Confident	73.5	Confident	39 Å²	39	77 Å²	77	26%	0.264	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-5.4	-173.2	-62.2	0	0	0	0	113.8	C227 V232 H249	C227-C230 HydrophobicContact CB-CB 4.35Å; C227-C230 PolarHBondContact O-N 3.18Å; C227-C230 PolarHBondContact SG-N 2.86Å; C230-V232 HydrophobicContact CB-CG1 4.35Å; C230-V232 HydrophobicContact CB-CG2 4.02Å; C230-V232 PolarHBondContact O-N 3.16Å; C230-H249 PolarHBondContact SG-ND1 2.9Å
231	G	81.8	Confident	75	Confident	57 Å²	57	77.4 Å²	77.4	59%	0.588	42%	0.415	S	S	*	.			trans	62.1	7.4	-175.2	0	0	0	0	0	115.3	C227	C227-G231 WeakPolarHBondContact O-CA 3.42Å; C227-G231 PolarHBondContact O-N 2.69Å
232	V	80.8	Confident	76.6	Confident	55 Å²	55	73.8 Å²	73.8	33%	0.333	40%	0.403	S	S	.	.			trans	-86.2	133.5	-173.6	-63.9	0	0	0	0	111.4	T226 C227 C230 L234 H243	T226-V232 CarbonylContact C-O 3.4Å; T226-V232 VanDerWaalsContact CA-O 3.32Å; T226-V232 WeakPolarHBondContact CA-O 3.44Å; C227-V232 HydrophobicContact CB-CG2 3.82Å; C227-V232 PolarHBondContact N-O 2.91Å; C230-V232 HydrophobicContact CB-CG1 4.35Å; C230-V232 HydrophobicContact CB-CG2 4.02Å; C230-V232 PolarHBondContact O-N 3.16Å; V232-L234 HydrophobicContact CG2-CD1 4.4Å; V232-H243 WeakPolarHBondContact CG2-CE1 3.4Å
233	T	80.7	Confident	78.3	Confident	84 Å²	84	68.6 Å²	68.6	52%	0.515	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	122.4	175.7	-59.5	0	0	0	0	110.3	Y225 T226	Y225-T233 CarbonylContact O-C 3.59Å; Y225-T233 WeakPolarHBondContact O-CA 3.26Å; T226-T233 WeakPolarHBondContact CG2-OG1 3.04Å; T226-T233 PolarHBondContact OG1-OG1 2.97Å
234	L	82.1	Confident	79.4	Confident	39 Å²	39	61.7 Å²	61.7	20%	0.204	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	144.5	-174.2	-63.1	170.6	0	0	0	109.9	S224 Y225 V232 Q239 Y240 H243	S224-L234 CarbonylContact C-O 3.55Å; S224-L234 WeakPolarHBondContact CA-O 3.41Å; Y225-L234 PolarHBondContact N-O 3.34Å; Y225-L234 PolarHBondContact O-N 3.25Å; V232-L234 HydrophobicContact CG2-CD1 4.4Å; L234-Q239 HydrophobicContact CB-CB 4.45Å; L234-Y240 HydrophobicContact CD1-CD2 4.11Å; L234-H243 HydrophobicContact CD1-CB 3.54Å
235	N	77.6	Confident	80.3	Confident	121 Å²	121	64.5 Å²	64.5	65%	0.647	37%	0.365	S	S	*	.	S	Bend	trans	-97	6.2	-172.1	65.9	20.8	0	0	0	113.8	Q239	N235-Q239 PolarHBondContact OD1-OE1 2.97Å; N235-Q239 VanDerWaalsContact OD1-OE1 3.07Å
236	S	76.3	Confident	80.6	Confident	38 Å²	38	63.4 Å²	63.4	27%	0.266	37%	0.369	S	S	.	.			trans	-147	135.2	-178.5	176.9	0	0	0	0	111.5	A238 Q239 Y240	S236-A238 PolarHBondContact O-N 2.81Å; S236-A238 PolarHBondContact OG-N 2.92Å; S236-Q239 WeakPolarHBondContact O-CB 3.34Å; S236-Q239 PolarHBondContact O-N 3.41Å; S236-Y240 PolarHBondContact O-N 3.29Å
237	V	76.1	Confident	80.9	Confident	14 Å²	14	63.9 Å²	63.9	9%	0.085	38%	0.375	C	S	.	.	H	α-helix	trans	-51.5	-43.8	173.5	-177.1	0	0	0	0	111.3	L206 Y225 Q239 Y240 H241	L206-V237 HydrophobicContact CD1-CG2 4.19Å; Y225-V237 HydrophobicContact CE1-CG2 3.66Å; Y225-V237 HydrophobicContact CE2-CG2 3.81Å; Y225-V237 WeakPolarHBondContact OH-CG2 3.38Å; V237-Q239 VanDerWaalsContact C-N 3.31Å; V237-Q239 PolarHBondContact O-N 2.85Å; V237-Y240 PolarHBondContact O-N 3.17Å; V237-H241 WeakPolarHBondContact O-CB 3.42Å; V237-H241 PolarHBondContact O-N 3Å
238	A	77.8	Confident	80.9	Confident	61 Å²	61	72.4 Å²	72.4	50%	0.504	41%	0.412	S	S	.	.	H	α-helix	trans	-65	-37.7	-178.4	0	0	0	0	0	111.4	S236 S242	S236-A238 PolarHBondContact O-N 2.81Å; S236-A238 PolarHBondContact OG-N 2.92Å; A238-S242 WeakPolarHBondContact O-CB 3.48Å; A238-S242 PolarHBondContact O-N 2.8Å; A238-S242 PolarHBondContact O-OG 3.07Å; A238-S242 VanDerWaalsContact O-OG 3.07Å
239	Q	79.4	Confident	81.2	Confident	95 Å²	95	64.6 Å²	64.6	44%	0.444	38%	0.376	S	S	.	.	H	α-helix	trans	-70	-39.9	175.8	-70	174.1	1.8	0	0	111.4	L234 N235 S236 V237 S242 H243	L234-Q239 HydrophobicContact CB-CB 4.45Å; N235-Q239 PolarHBondContact OD1-OE1 2.97Å; N235-Q239 VanDerWaalsContact OD1-OE1 3.07Å; S236-Q239 WeakPolarHBondContact O-CB 3.34Å; S236-Q239 PolarHBondContact O-N 3.41Å; V237-Q239 VanDerWaalsContact C-N 3.31Å; V237-Q239 PolarHBondContact O-N 2.85Å; Q239-S242 PolarHBondContact O-N 3.06Å; Q239-H243 VanDerWaalsContact O-CB 3.3Å; Q239-H243 WeakPolarHBondContact O-CB 3.46Å; Q239-H243 PolarHBondContact O-N 3.44Å
240	Y	83.4	Confident	81.3	Confident	39 Å²	39	67 Å²	67	15%	0.153	39%	0.385	C	S	.	.	H	α-helix	trans	-60.8	-46.9	176.2	-174	-108	0	0	0	111.7	L209 Y225 C227 L234 S236 V237 H243 L244	L209-Y240 HydrophobicContact CD2-CD1 4.39Å; L209-Y240 HydrophobicContact CD2-CE1 4.19Å; Y225-Y240 HydrophobicContact CG-CG 4.39Å; C227-Y240 HydrophobicContact CB-CE2 3.78Å; L234-Y240 HydrophobicContact CD1-CD2 4.11Å; S236-Y240 PolarHBondContact O-N 3.29Å; V237-Y240 PolarHBondContact O-N 3.17Å; Y240-H243 VanDerWaalsContact O-CB 3.31Å; Y240-H243 WeakPolarHBondContact O-CB 3.38Å; Y240-H243 PolarHBondContact O-N 3.49Å; Y240-H243 VanDerWaalsContact O-N 3.16Å; Y240-L244 HydrophobicContact CD1-CD1 4.06Å; Y240-L244 HydrophobicContact CD1-CG 4.45Å; Y240-L244 HydrophobicContact CE1-CD1 3.61Å; Y240-L244 HydrophobicContact CE1-CD2 4.43Å; Y240-L244 HydrophobicContact CE1-CG 4.15Å; Y240-L244 WeakPolarHBondContact O-CG 3.4Å; Y240-L244 PolarHBondContact O-N 2.97Å
241	H	78.1	Confident	81.4	Confident	72 Å²	72	69.4 Å²	69.4	33%	0.333	39%	0.394	S	S	.	.	H	α-helix	trans	-65.6	-44.6	177.4	-173.6	-95.5	0	0	0	112.7	V237 H243 L244 Q245	V237-H241 WeakPolarHBondContact O-CB 3.42Å; V237-H241 PolarHBondContact O-N 3Å; H241-H243 PolarHBondContact O-N 3.22Å; H241-L244 PolarHBondContact O-N 3.4Å; H241-Q245 PolarHBondContact CE1-NE2 2.89Å; H241-Q245 PolarHBondContact NE2-NE2 3.12Å; H241-Q245 WeakPolarHBondContact O-CG 3.19Å; H241-Q245 PolarHBondContact O-N 3.24Å; H241-Q245 VanDerWaalsContact O-N 3.08Å
242	S	83.1	Confident	81.2	Confident	80 Å²	80	70.3 Å²	70.3	56%	0.559	39%	0.386	S	S	*	.	H	α-helix	trans	-60.4	-32	173	-65.8	0	0	0	0	112.5	A238 Q239 G246	A238-S242 WeakPolarHBondContact O-CB 3.48Å; A238-S242 PolarHBondContact O-N 2.8Å; A238-S242 PolarHBondContact O-OG 3.07Å; A238-S242 VanDerWaalsContact O-OG 3.07Å; Q239-S242 PolarHBondContact O-N 3.06Å; S242-G246 PolarHBondContact O-N 3.19Å
243	H	85.6	Confident	81.2	Confident	45 Å²	45	71.1 Å²	71.1	21%	0.208	39%	0.388	C	S	.	.	H	α-helix	trans	-66.2	-48.9	173.3	166.5	81.8	0	0	0	111.6	C227 V232 L234 Q239 Y240 H241 Q245 G246 H249	C227-H243 WeakPolarHBondContact CB-NE2 3.49Å; C227-H243 PolarHBondContact SG-NE2 2.95Å; V232-H243 WeakPolarHBondContact CG2-CE1 3.4Å; L234-H243 HydrophobicContact CD1-CB 3.54Å; Q239-H243 VanDerWaalsContact O-CB 3.3Å; Q239-H243 WeakPolarHBondContact O-CB 3.46Å; Q239-H243 PolarHBondContact O-N 3.44Å; Y240-H243 VanDerWaalsContact O-CB 3.31Å; Y240-H243 WeakPolarHBondContact O-CB 3.38Å; Y240-H243 PolarHBondContact O-N 3.49Å; Y240-H243 VanDerWaalsContact O-N 3.16Å; H241-H243 PolarHBondContact O-N 3.22Å; H243-Q245 PolarHBondContact O-N 3.06Å; H243-G246 PolarHBondContact O-N 2.86Å; H243-H249 AromaticContact CD2-ND1 3.8Å; H243-H249 AromaticContact CE1-ND1 3.97Å; H243-H249 AromaticContact NE2-CG 3.86Å; H243-H249 AromaticContact NE2-ND1 3.18Å; H243-H249 PolarHBondContact NE2-ND1 3.2Å; H243-H249 VanDerWaalsContact NE2-ND1 3.18Å; H243-H249 WeakPolarHBondContact O-CB 3.42Å
244	L	83.2	Confident	80.9	Confident	57 Å²	57	73.4 Å²	73.4	30%	0.298	39%	0.391	S	S	.	.	H	α-helix	trans	-59.6	-35.4	178.9	-65.2	179.9	0	0	0	112.6	Y240 H241 G246 H249	Y240-L244 HydrophobicContact CD1-CD1 4.06Å; Y240-L244 HydrophobicContact CD1-CG 4.45Å; Y240-L244 HydrophobicContact CE1-CD1 3.61Å; Y240-L244 HydrophobicContact CE1-CD2 4.43Å; Y240-L244 HydrophobicContact CE1-CG 4.15Å; Y240-L244 WeakPolarHBondContact O-CG 3.4Å; Y240-L244 PolarHBondContact O-N 2.97Å; H241-L244 PolarHBondContact O-N 3.4Å; L244-G246 VanDerWaalsContact C-N 3.32Å; L244-H249 VanDerWaalsContact CD2-CE1 3.48Å; L244-H249 WeakPolarHBondContact CD2-CE1 3.46Å; L244-H249 WeakPolarHBondContact CD2-NE2 3.42Å; L244-H249 PolarHBondContact O-CD2 2.92Å; L244-H249 VanDerWaalsContact O-CD2 3.22Å
245	Q	82.4	Confident	80.4	Confident	120 Å²	120	76.5 Å²	76.5	56%	0.561	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-7.5	177.4	-63.8	-173.7	-22.7	0	0	113.7	H241 H243	H241-Q245 PolarHBondContact CE1-NE2 2.89Å; H241-Q245 PolarHBondContact NE2-NE2 3.12Å; H241-Q245 WeakPolarHBondContact O-CG 3.19Å; H241-Q245 PolarHBondContact O-N 3.24Å; H241-Q245 VanDerWaalsContact O-N 3.08Å; H243-Q245 PolarHBondContact O-N 3.06Å
246	G	83	Confident	79.7	Confident	26 Å²	26	76 Å²	76	27%	0.268	40%	0.402	S	S	.	.	S	Bend	trans	-73.6	141.9	-178.4	0	0	0	0	0	112.3	S242 H243 L244 K248 H249 Q250	S242-G246 PolarHBondContact O-N 3.19Å; H243-G246 PolarHBondContact O-N 2.86Å; L244-G246 VanDerWaalsContact C-N 3.32Å; G246-K248 PolarHBondContact O-N 3.31Å; G246-K248 VanDerWaalsContact O-N 3.08Å; G246-H249 PolarHBondContact O-N 2.86Å; G246-Q250 PolarHBondContact O-N 3.22Å
247	S	83.9	Confident	78.9	Confident	84 Å²	84	79.8 Å²	79.8	59%	0.587	42%	0.418	S	S	*	.	H	α-helix	trans	-54.8	-33.2	179.9	-41.2	0	0	0	0	112.8	N251	S247-N251 WeakPolarHBondContact O-CB 3.39Å; S247-N251 PolarHBondContact O-N 3.09Å; S247-N251 PolarHBondContact O-ND2 2.63Å
248	K	82.3	Confident	78	Confident	180 Å²	180	84.4 Å²	84.4	78%	0.783	45%	0.449	S	S	*	.	H	α-helix	trans	-63.8	-44.8	176.1	-66.8	-174.8	179.9	-178.2	0	112.3	G246 N252	G246-K248 PolarHBondContact O-N 3.31Å; G246-K248 VanDerWaalsContact O-N 3.08Å; K248-N252 PolarHBondContact O-N 2.97Å; K248-N252 PolarHBondContact O-ND2 3.38Å
249	H	85.5	Confident	76.8	Confident	12 Å²	12	87.6 Å²	87.6	6%	0.056	46%	0.462	C	S	.	.	H	α-helix	trans	-68.5	-45.2	178	177.7	84.7	0	0	0	110.6	C227 C230 H243 L244 G246 N251 N252 L253	C227-H249 PolarHBondContact SG-CE1 3.05Å; C227-H249 PolarHBondContact SG-ND1 3.11Å; C227-H249 VanDerWaalsContact SG-ND1 3.4Å; C230-H249 PolarHBondContact SG-ND1 2.9Å; H243-H249 AromaticContact CD2-ND1 3.8Å; H243-H249 AromaticContact CE1-ND1 3.97Å; H243-H249 AromaticContact NE2-CG 3.86Å; H243-H249 AromaticContact NE2-ND1 3.18Å; H243-H249 PolarHBondContact NE2-ND1 3.2Å; H243-H249 VanDerWaalsContact NE2-ND1 3.18Å; H243-H249 WeakPolarHBondContact O-CB 3.42Å; L244-H249 VanDerWaalsContact CD2-CE1 3.48Å; L244-H249 WeakPolarHBondContact CD2-CE1 3.46Å; L244-H249 WeakPolarHBondContact CD2-NE2 3.42Å; L244-H249 PolarHBondContact O-CD2 2.92Å; L244-H249 VanDerWaalsContact O-CD2 3.22Å; G246-H249 PolarHBondContact O-N 2.86Å; H249-N251 VanDerWaalsContact C-N 3.31Å; H249-N251 PolarHBondContact O-N 2.55Å; H249-N252 PolarHBondContact O-N 3.05Å; H249-N252 VanDerWaalsContact O-N 3.16Å; H249-L253 WeakPolarHBondContact O-CB 3.45Å; H249-L253 PolarHBondContact O-N 3.07Å
250	Q	82.9	Confident	75.2	Confident	90 Å²	90	94.6 Å²	94.6	42%	0.421	50%	0.495	S	S	.	.	H	α-helix	trans	-59	-39.6	177.9	-68.5	-175	-23.3	0	0	113	G246 L253 K254	G246-Q250 PolarHBondContact O-N 3.22Å; Q250-L253 PolarHBondContact O-N 2.84Å; Q250-K254 VanDerWaalsContact O-CG 3.29Å; Q250-K254 WeakPolarHBondContact O-CG 3.4Å; Q250-K254 PolarHBondContact O-N 2.75Å
251	N	83.3	Confident	74.7	Confident	88 Å²	88	97.4 Å²	97.4	47%	0.471	51%	0.512	S	S	.	.	H	α-helix	trans	-68.8	-40.9	176.6	-70.8	-11.1	0	0	0	111.9	S247 H249 L253 K254 N255	S247-N251 WeakPolarHBondContact O-CB 3.39Å; S247-N251 PolarHBondContact O-N 3.09Å; S247-N251 PolarHBondContact O-ND2 2.63Å; H249-N251 VanDerWaalsContact C-N 3.31Å; H249-N251 PolarHBondContact O-N 2.55Å; N251-L253 VanDerWaalsContact C-N 3.35Å; N251-K254 PolarHBondContact O-N 3.11Å; N251-N255 WeakPolarHBondContact O-CB 3.25Å; N251-N255 PolarHBondContact O-N 3.38Å; N251-N255 PolarHBondContact O-ND2 3.14Å
252	N	78.5	Confident	74.6	Confident	77 Å²	77	98.7 Å²	98.7	41%	0.412	52%	0.521	S	S	.	.	H	α-helix	trans	-63.5	-41.4	174.3	-81.5	-75.6	0	0	0	111.7	V229 K248 H249 N255 Q256	V229-N252 HydrophobicContact CG1-CB 4.09Å; K248-N252 PolarHBondContact O-N 2.97Å; K248-N252 PolarHBondContact O-ND2 3.38Å; H249-N252 PolarHBondContact O-N 3.05Å; H249-N252 VanDerWaalsContact O-N 3.16Å; N252-N255 PolarHBondContact O-N 2.84Å; N252-Q256 WeakPolarHBondContact O-CG 3.43Å; N252-Q256 PolarHBondContact O-N 3.35Å
253	L	79.3	Confident	74.1	Confident	72 Å²	72	99.8 Å²	99.8	38%	0.377	52%	0.519	S	S	.	.	H	α-helix	trans	-61.1	-46.5	176	-175.7	69	0	0	0	111.5	V229 H249 Q250 N251 N255 Q256 I257	V229-L253 HydrophobicContact CG1-CB 4.3Å; V229-L253 HydrophobicContact CG1-CD1 4.44Å; V229-L253 HydrophobicContact CG2-CD1 3.91Å; H249-L253 WeakPolarHBondContact O-CB 3.45Å; H249-L253 PolarHBondContact O-N 3.07Å; Q250-L253 PolarHBondContact O-N 2.84Å; N251-L253 VanDerWaalsContact C-N 3.35Å; L253-N255 VanDerWaalsContact C-N 3.34Å; L253-N255 PolarHBondContact O-N 2.87Å; L253-Q256 PolarHBondContact O-N 3.43Å; L253-I257 HydrophobicContact CD1-CD1 4.4Å; L253-I257 HydrophobicContact CG-CD1 4.04Å; L253-I257 WeakPolarHBondContact O-CD1 3.34Å; L253-I257 VanDerWaalsContact O-CG1 3.29Å; L253-I257 WeakPolarHBondContact O-CG1 3.22Å; L253-I257 PolarHBondContact O-N 2.96Å; L253-I257 VanDerWaalsContact O-N 3.09Å
254	K	75.3	Confident	73.4	Confident	132 Å²	132	103 Å²	103	57%	0.574	54%	0.537	S	S	*	.	H	α-helix	trans	-62.1	-40.5	175.9	-73.4	174.7	-178.5	-178.6	0	112.5	Q250 N251 Q256 I257 C258	Q250-K254 VanDerWaalsContact O-CG 3.29Å; Q250-K254 WeakPolarHBondContact O-CG 3.4Å; Q250-K254 PolarHBondContact O-N 2.75Å; N251-K254 PolarHBondContact O-N 3.11Å; K254-Q256 VanDerWaalsContact C-N 3.33Å; K254-I257 PolarHBondContact O-N 2.87Å; K254-C258 WeakPolarHBondContact O-CB 3.1Å; K254-C258 PolarHBondContact O-N 2.85Å; K254-C258 VanDerWaalsContact O-N 3.07Å
255	N	70.9	Confident	72.8	Confident	104 Å²	104	105.9 Å²	105.9	56%	0.556	55%	0.552	S	S	*	*	H	α-helix	trans	-67.5	-33.5	177.7	-71.4	-14.7	0	0	0	112.1	N251 N252 L253 V259	N251-N255 WeakPolarHBondContact O-CB 3.25Å; N251-N255 PolarHBondContact O-N 3.38Å; N251-N255 PolarHBondContact O-ND2 3.14Å; N252-N255 PolarHBondContact O-N 2.84Å; L253-N255 VanDerWaalsContact C-N 3.34Å; L253-N255 PolarHBondContact O-N 2.87Å; N255-V259 WeakPolarHBondContact O-CG2 3Å
256	Q	64.3	Low	72.2	Confident	111 Å²	111	104.9 Å²	104.9	52%	0.519	55%	0.552	S	S	.	*	H	α-helix	trans	-70.9	-34.9	173.7	-71.8	-157.3	48.7	0	0	112.7	V229 N252 L253 K254	V229-Q256 PolarHBondContact O-NE2 2.73Å; V229-Q256 VanDerWaalsContact O-NE2 3.1Å; N252-Q256 WeakPolarHBondContact O-CG 3.43Å; N252-Q256 PolarHBondContact O-N 3.35Å; L253-Q256 PolarHBondContact O-N 3.43Å; K254-Q256 VanDerWaalsContact C-N 3.33Å
257	I	59.4	Low	71.4	Confident	117 Å²	117	110.6 Å²	110.6	60%	0.6	57%	0.572	S	S	*	*	H	α-helix	trans	-72.8	-28.3	178	-64.2	164.2	0	0	0	112	L253 K254 V259	L253-I257 HydrophobicContact CD1-CD1 4.4Å; L253-I257 HydrophobicContact CG-CD1 4.04Å; L253-I257 WeakPolarHBondContact O-CD1 3.34Å; L253-I257 VanDerWaalsContact O-CG1 3.29Å; L253-I257 WeakPolarHBondContact O-CG1 3.22Å; L253-I257 PolarHBondContact O-N 2.96Å; L253-I257 VanDerWaalsContact O-N 3.09Å; K254-I257 PolarHBondContact O-N 2.87Å; I257-V259 VanDerWaalsContact C-N 3.33Å
258	C	55.6	Low	70.4	Confident	110 Å²	110	112.6 Å²	112.6	74%	0.743	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-5.2	-178.7	-162.6	0	0	0	0	114.3	K254	K254-C258 WeakPolarHBondContact O-CB 3.1Å; K254-C258 PolarHBondContact O-N 2.85Å; K254-C258 VanDerWaalsContact O-N 3.07Å
259	V	53.4	Low	69.4	Low	128 Å²	128	107 Å²	107	78%	0.776	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	11	-176.4	-179.9	0	0	0	0	111.6	N255 I257	N255-V259 WeakPolarHBondContact O-CG2 3Å; I257-V259 VanDerWaalsContact C-N 3.33Å
260	Q	44.8	Very low	68	Low	243 Å²	243	115.6 Å²	115.6	100%	1.136	60%	0.598	S	S	*	*			trans	-111.4	0	176.4	-123.8	166.9	36.8	0	0	112.2

Retrieved 260 of 260 residues in 355.4 ms (Link to these results)

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