A0A096MMZ5_PAPAN Loading...

Granzyme K

AlphaFold DB , UniProt , Accession A0A096MMZ5, Species PAPAN (Papio anubis, Olive baboon), Gene GZMK, Length 264 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	41.5	Very low	43.8	Very low	237 Å²	237	161.9 Å²	161.9	100%	1.167	83%	0.825	S	S	*	*				0	112.2	0	-83	158.1	161.4	0	0	108.5
2	T	39.1	Very low	44.1	Very low	130 Å²	130	162.3 Å²	162.3	80%	0.798	83%	0.829	S	S	*	*			trans	39.8	106.8	158.8	48.7	0	0	0	0	120.7
3	K	40.3	Very low	44.9	Very low	213 Å²	213	161.7 Å²	161.7	93%	0.926	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-69.2	135.2	162.4	-73.6	177.7	173.1	179.5	0	110.6
4	F	41.2	Very low	45.5	Very low	207 Å²	207	156.9 Å²	156.9	91%	0.908	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-80.4	122.4	168.3	-87.5	-93.4	0	0	0	110.1
5	S	42.1	Very low	45.8	Very low	93 Å²	93	150.9 Å²	150.9	65%	0.65	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-86.7	120.6	175	-168.7	0	0	0	0	109.2
6	S	47.9	Very low	46.2	Very low	112 Å²	112	147.3 Å²	147.3	78%	0.783	81%	0.811	S	S	*	*			trans	-88.2	115.1	171.4	-166.6	0	0	0	0	108.8
7	F	44.9	Very low	46.2	Very low	185 Å²	185	145.5 Å²	145.5	81%	0.811	81%	0.81	S	S	*	*			trans	-106	102.5	169.8	-93.7	-89.2	0	0	0	108	L9	F7-L9 PolarHBondContact O-N 3.44Å
8	S	48.1	Very low	46.2	Very low	102 Å²	102	147.1 Å²	147.1	71%	0.713	81%	0.813	S	S	*	*			trans	-76.5	114.3	166.2	-72.5	0	0	0	0	109.2	F10	S8-F10 PolarHBondContact O-N 3.35Å
9	L	45.3	Very low	46.2	Very low	138 Å²	138	144.7 Å²	144.7	72%	0.723	80%	0.803	S	S	*	*			trans	-81.8	102.1	174.4	-147	80.6	0	0	0	108.8	F7 F11	F7-L9 PolarHBondContact O-N 3.44Å; L9-F11 HydrophobicContact CD2-CD2 4.16Å; L9-F11 HydrophobicContact CD2-CE2 3.58Å; L9-F11 HydrophobicContact CD2-CZ 4.07Å; L9-F11 PolarHBondContact O-N 3.23Å
10	F	46.4	Very low	46.1	Very low	190 Å²	190	143.4 Å²	143.4	83%	0.833	80%	0.801	S	S	*	*			trans	-74.7	103.5	168.8	-104.6	-93.1	0	0	0	108.9	S8 L12	S8-F10 PolarHBondContact O-N 3.35Å; F10-L12 PolarHBondContact O-N 3.26Å
11	F	45.1	Very low	45.7	Very low	174 Å²	174	141.7 Å²	141.7	76%	0.763	79%	0.794	S	S	*	*			trans	-75.7	101.6	165.1	-90.8	-80.6	0	0	0	109	L9 I13	L9-F11 HydrophobicContact CD2-CD2 4.16Å; L9-F11 HydrophobicContact CD2-CE2 3.58Å; L9-F11 HydrophobicContact CD2-CZ 4.07Å; L9-F11 PolarHBondContact O-N 3.23Å; F11-I13 PolarHBondContact O-N 2.93Å; F11-I13 VanDerWaalsContact O-N 3.09Å
12	L	47.8	Very low	45.4	Very low	166 Å²	166	135.4 Å²	135.4	87%	0.869	77%	0.772	S	S	*	*			trans	-68.8	96.9	163.2	-84.7	157.9	0	0	0	108.3	F10 A14	F10-L12 PolarHBondContact O-N 3.26Å; L12-A14 VanDerWaalsContact C-N 3.33Å; L12-A14 PolarHBondContact O-N 3.02Å
13	I	54	Low	45	Very low	155 Å²	155	137.8 Å²	137.8	80%	0.795	77%	0.772	S	S	*	*			trans	-72.7	94.8	166.1	-58.7	179.7	0	0	0	106.6	F11 G15	F11-I13 PolarHBondContact O-N 2.93Å; F11-I13 VanDerWaalsContact O-N 3.09Å; I13-G15 VanDerWaalsContact C-N 3.31Å; I13-G15 PolarHBondContact O-N 2.96Å
14	A	53.1	Low	44.6	Very low	94 Å²	94	134.5 Å²	134.5	78%	0.777	76%	0.764	S	S	*	*			trans	-66.9	94.8	165.1	0	0	0	0	0	107.8	L12 A16	L12-A14 VanDerWaalsContact C-N 3.33Å; L12-A14 PolarHBondContact O-N 3.02Å; A14-A16 PolarHBondContact O-N 3.09Å
15	G	50.6	Low	44	Very low	68 Å²	68	132.2 Å²	132.2	70%	0.701	76%	0.758	S	S	*	*			trans	-62.8	101	169.2	0	0	0	0	0	108.9	I13 C17	I13-G15 VanDerWaalsContact C-N 3.31Å; I13-G15 PolarHBondContact O-N 2.96Å; G15-C17 VanDerWaalsContact C-N 3.34Å; G15-C17 PolarHBondContact O-N 2.97Å
16	A	51.2	Low	43.7	Very low	92 Å²	92	133.5 Å²	133.5	76%	0.76	75%	0.754	S	S	*	*			trans	-63.1	100.6	165.2	0	0	0	0	0	107.2	A14 M18	A14-A16 PolarHBondContact O-N 3.09Å; A16-M18 VanDerWaalsContact C-N 3.25Å; A16-M18 PolarHBondContact O-N 2.85Å
17	C	46.5	Very low	43.4	Very low	117 Å²	117	132.2 Å²	132.2	79%	0.791	74%	0.738	S	S	*	*			trans	-65.5	94.7	167.2	-161.7	0	0	0	0	106.1	G15 T19	G15-C17 VanDerWaalsContact C-N 3.34Å; G15-C17 PolarHBondContact O-N 2.97Å; C17-T19 PolarHBondContact O-N 2.7Å
18	M	45.8	Very low	44.1	Very low	174 Å²	174	125 Å²	125	86%	0.857	71%	0.707	S	S	*	*			trans	-62.5	95.6	165	-69.4	-123.7	-92.5	0	0	105.6	A16	A16-M18 VanDerWaalsContact C-N 3.25Å; A16-M18 PolarHBondContact O-N 2.85Å
19	T	47.2	Very low	44.7	Very low	103 Å²	103	120.4 Å²	120.4	63%	0.632	68%	0.676	S	S	*	*			trans	-48.7	132.7	169.2	51.7	0	0	0	0	106.9	C17 V21	C17-T19 PolarHBondContact O-N 2.7Å; T19-V21 VanDerWaalsContact C-N 3.29Å; T19-V21 PolarHBondContact O-N 3.06Å
20	P	44.9	Very low	46.2	Very low	118 Å²	118	114.5 Å²	114.5	77%	0.766	65%	0.649	S	S	*	*			trans	-62.4	105.9	168.9	26.9	-28.2	0	0	0	104.8	C22	P20-C22 PolarHBondContact O-N 3.06Å
21	V	37.4	Very low	48.2	Very low	107 Å²	107	111.5 Å²	111.5	65%	0.648	64%	0.636	S	S	*	*			trans	-56.1	104.8	158.7	-179.9	0	0	0	0	102.6	T19 F23	T19-V21 VanDerWaalsContact C-N 3.29Å; T19-V21 PolarHBondContact O-N 3.06Å; V21-F23 HydrophobicContact CG1-CD2 4.36Å; V21-F23 HydrophobicContact CG1-CE2 4.43Å; V21-F23 PolarHBondContact O-N 3.48Å
22	C	34.4	Very low	50.6	Low	106 Å²	106	107.7 Å²	107.7	72%	0.716	62%	0.62	S	S	*	*			trans	-56.8	89.9	162.8	-92.1	0	0	0	0	104.9	P20 N24	P20-C22 PolarHBondContact O-N 3.06Å; C22-N24 PolarHBondContact O-N 2.88Å
23	F	30.5	Very low	52.9	Low	179 Å²	179	100.1 Å²	100.1	79%	0.785	58%	0.581	S	S	*	*			trans	-58.1	94.9	149.4	-84.7	-84.7	0	0	0	103.4	V21 M25	V21-F23 HydrophobicContact CG1-CD2 4.36Å; V21-F23 HydrophobicContact CG1-CE2 4.43Å; V21-F23 PolarHBondContact O-N 3.48Å; F23-M25 PolarHBondContact O-N 3.44Å
24	N	31.6	Very low	54.9	Low	144 Å²	144	96.9 Å²	96.9	77%	0.77	57%	0.572	S	S	*	*			trans	-51.6	99.2	153	-75.6	-40.8	0	0	0	103.6	C22 E26	C22-N24 PolarHBondContact O-N 2.88Å; N24-E26 PolarHBondContact O-N 2.89Å
25	M	28.5	Very low	57.1	Low	159 Å²	159	96.2 Å²	96.2	78%	0.783	56%	0.56	S	S	*	*			trans	-58.1	99	161.5	-83.4	-170.4	149	0	0	103.6	F23 I27	F23-M25 PolarHBondContact O-N 3.44Å; M25-I27 HydrophobicContact CB-CD1 3.88Å; M25-I27 WeakPolarHBondContact O-CG1 3.34Å; M25-I27 PolarHBondContact O-N 3.25Å
26	E	37.3	Very low	59.3	Low	120 Å²	120	95 Å²	95	56%	0.561	54%	0.535	S	S	*	.			trans	-71.2	87.3	173.1	-161.7	171.2	-167.9	0	0	104.4	N24 K207	N24-E26 PolarHBondContact O-N 2.89Å; E26-K207 VanDerWaalsContact CD-CE 3.44Å; E26-K207 VanDerWaalsContact OE1-CE 3.29Å; E26-K207 WeakPolarHBondContact OE1-CE 3.46Å; E26-K207 IonicContact OE1-NZ 2.65Å; E26-K207 PolarHBondContact OE1-NZ 3.28Å; E26-K207 WeakPolarHBondContact OE2-CE 3.13Å; E26-K207 IonicContact OE2-NZ 3.95Å; E26-K207 PolarHBondContact OE2-NZ 2.72Å
27	I	40.5	Very low	61.6	Low	86 Å²	86	92.6 Å²	92.6	44%	0.441	51%	0.514	S	S	.	.			trans	-58.7	140	179.1	-54.9	-62.5	0	0	0	107.6	M25 G29 G30 T157	M25-I27 HydrophobicContact CB-CD1 3.88Å; M25-I27 WeakPolarHBondContact O-CG1 3.34Å; M25-I27 PolarHBondContact O-N 3.25Å; I27-G29 PolarHBondContact O-N 3.23Å; I27-G30 PolarHBondContact O-N 3.09Å; I27-T157 WeakPolarHBondContact CG2-O 3.36Å
28	I	59.7	Low	64	Low	32 Å²	32	89.7 Å²	89.7	16%	0.164	49%	0.486	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	139.6	170.1	-66.5	161.9	0	0	0	107.4	T157 P159	I28-T157 CarbonylContact C-O 3.53Å; I28-T157 CarbonylContact O-C 3.57Å; I28-T157 VanDerWaalsContact O-C 3.32Å; I28-T157 WeakPolarHBondContact O-CA 3.47Å; I28-T157 WeakPolarHBondContact O-CB 3.29Å; I28-P159 HydrophobicContact CD1-CB 4.47Å; I28-P159 HydrophobicContact CD1-CG 3.72Å
29	G	61.2	Low	66.5	Low	6 Å²	6	82.4 Å²	82.4	6%	0.062	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.8	14.1	-178.1	0	0	0	0	0	116.1	I27 R169	I27-G29 PolarHBondContact O-N 3.23Å; G29-R169 WeakPolarHBondContact O-CB 3.41Å; G29-R169 WeakPolarHBondContact O-CD 3.42Å; G29-R169 PolarHBondContact O-NE 2.66Å
30	G	75.6	Confident	69	Low	15 Å²	15	78.5 Å²	78.5	16%	0.155	43%	0.426	C	S	.	.			trans	76	-165.3	154.3	0	0	0	0	0	116	I27 R169 E170	I27-G30 PolarHBondContact O-N 3.09Å; G30-R169 VanDerWaalsContact O-CZ 3.31Å; G30-R169 PolarHBondContact O-NE 3.05Å; G30-R169 PolarHBondContact O-NH2 3.24Å; G30-E170 CarbonylContact C-O 3.52Å; G30-E170 VanDerWaalsContact CA-O 3.3Å; G30-E170 WeakPolarHBondContact CA-O 3.45Å
31	K	89.8	Confident	71.5	Confident	127 Å²	127	73 Å²	73	55%	0.552	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.4	147.4	-176.3	64.7	-179.6	-179.7	170.6	0	110.8	V33 R169 E170	K31-V33 PolarHBondContact O-N 2.76Å; K31-R169 CarbonylContact O-C 3.59Å; K31-R169 VanDerWaalsContact O-CA 3.29Å; K31-R169 WeakPolarHBondContact O-CA 3.39Å; K31-E170 WeakPolarHBondContact CE-OE1 3.42Å; K31-E170 HydrophobicContact CG-CG 3.96Å; K31-E170 PolarHBondContact N-O 3.33Å; K31-E170 IonicContact NZ-OE1 3.93Å; K31-E170 PolarHBondContact NZ-OE1 2.67Å; K31-E170 PolarHBondContact O-N 3.09Å
32	E	94.4	Very high	74.5	Confident	94 Å²	94	68 Å²	68	44%	0.439	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	136.3	171	179.8	166.9	163.8	0	0	110.3	H85 T167	E32-H85 IonicContact OE1-CD2 2.83Å; E32-H85 IonicContact OE1-CE1 3.54Å; E32-H85 IonicContact OE1-NE2 2.8Å; E32-H85 PolarHBondContact OE1-NE2 2.93Å; E32-T167 VanDerWaalsContact CD-OG1 3.26Å; E32-T167 PolarHBondContact OE2-OG1 3.06Å
33	V	95.8	Very high	77.5	Confident	7 Å²	7	62.9 Å²	62.9	4%	0.042	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-85.6	158.4	174.7	-58.4	0	0	0	0	110.9	K31 R38 H85 L168 E170	K31-V33 PolarHBondContact O-N 2.76Å; V33-R38 HydrophobicContact CG2-CG 4.38Å; V33-H85 PolarHBondContact O-CE1 2.83Å; V33-L168 HydrophobicContact CG2-CB 3.91Å; V33-L168 HydrophobicContact CG2-CD2 3.76Å; V33-L168 HydrophobicContact CG2-CG 3.82Å; V33-L168 WeakPolarHBondContact CG2-O 3.48Å; V33-L168 PolarHBondContact N-O 3.3Å; V33-L168 VanDerWaalsContact N-O 3.08Å; V33-E170 HydrophobicContact CG1-CB 3.61Å; V33-E170 HydrophobicContact CG1-CG 3.56Å; V33-E170 WeakPolarHBondContact CG1-OE2 3.07Å
34	S	97.8	Very high	80.7	Confident	87 Å²	87	54.4 Å²	54.4	61%	0.608	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-59.1	137.8	169.4	-55.8	0	0	0	0	110.3	H36 S37	S34-H36 PolarHBondContact O-N 3.38Å; S34-S37 WeakPolarHBondContact O-CB 3.26Å; S34-S37 PolarHBondContact O-N 2.8Å; S34-S37 PolarHBondContact O-OG 2.81Å
35	P	98.2	Very high	83.8	Confident	80 Å²	80	48.4 Å²	48.4	52%	0.519	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	131.5	-177.4	-29.8	34.5	0	0	0	113.5	S37 H85	P35-S37 PolarHBondContact O-N 2.84Å; P35-S37 VanDerWaalsContact O-N 3.09Å; P35-H85 HydrophobicContact CB-CB 4.09Å
36	H	97.9	Very high	86.8	Confident	41 Å²	41	41.4 Å²	41.4	19%	0.19	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	15.1	179.5	-40.7	-66.9	0	0	0	115.6	S34 R38 G83 E91 S93 H131	S34-H36 PolarHBondContact O-N 3.38Å; H36-R38 PolarHBondContact O-N 2.8Å; H36-G83 PolarHBondContact CE1-O 3.2Å; H36-G83 PolarHBondContact ND1-O 3.32Å; H36-E91 IonicContact CE1-OE2 3.29Å; H36-S93 PolarHBondContact CE1-OG 2.89Å; H36-H131 HydrophobicContact CB-CB 4.19Å; H36-H131 VanDerWaalsContact CB-ND1 3.34Å; H36-H131 WeakPolarHBondContact CB-ND1 3.48Å; H36-H131 AromaticContact CD2-ND1 3.98Å; H36-H131 AromaticContact CG-ND1 3.69Å
37	S	97.9	Very high	89.4	Confident	43 Å²	43	37.4 Å²	37.4	30%	0.301	21%	0.212	S	C	.	.	S	Bend	trans	-72.4	-5.9	177.2	65	0	0	0	0	114.2	S34 P35 P39	S34-S37 WeakPolarHBondContact O-CB 3.26Å; S34-S37 PolarHBondContact O-N 2.8Å; S34-S37 PolarHBondContact O-OG 2.81Å; P35-S37 PolarHBondContact O-N 2.84Å; P35-S37 VanDerWaalsContact O-N 3.09Å; S37-P39 VanDerWaalsContact C-CD 3.45Å; S37-P39 WeakPolarHBondContact O-CD 3.35Å
38	R	98.2	Very high	91.8	Very high	55 Å²	55	35.6 Å²	35.6	21%	0.208	21%	0.214	C	C	.	.			trans	-124.3	66.9	177.8	-59	-74.4	176.4	-93.2	6	109.1	V33 H36 F40 M41 E150 T152 L168 E170	V33-R38 HydrophobicContact CG2-CG 4.38Å; H36-R38 PolarHBondContact O-N 2.8Å; R38-F40 HydrophobicContact CB-CE2 4.3Å; R38-F40 HydrophobicContact CB-CZ 4.13Å; R38-F40 PolarHBondContact O-N 3.08Å; R38-M41 HydrophobicContact CB-CG 3.77Å; R38-M41 WeakPolarHBondContact O-CB 3.13Å; R38-M41 PolarHBondContact O-N 2.8Å; R38-E150 IonicContact NH2-OE2 3.66Å; R38-T152 HydrophobicContact CB-CG2 4.2Å; R38-T152 HydrophobicContact CG-CG2 3.77Å; R38-L168 HydrophobicContact CB-CD2 3.79Å; R38-L168 HydrophobicContact CG-CD2 4.17Å; R38-E170 IonicContact CZ-OE2 3.95Å; R38-E170 IonicContact NE-OE2 3.57Å; R38-E170 PolarHBondContact NE-OE2 3.21Å; R38-E170 IonicContact NH2-OE1 3.66Å; R38-E170 IonicContact NH2-OE2 3.37Å; R38-E170 PolarHBondContact NH2-OE2 3.14Å
39	P	98.5	Very high	93.4	Very high	21 Å²	21	40.7 Å²	40.7	14%	0.136	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-4.7	-166.4	29.5	-38.1	0	0	0	114.8	S37 H131 V132 K133	S37-P39 VanDerWaalsContact C-CD 3.45Å; S37-P39 WeakPolarHBondContact O-CD 3.35Å; P39-H131 VanDerWaalsContact CA-O 3.31Å; P39-H131 WeakPolarHBondContact CA-O 3.11Å; P39-H131 WeakPolarHBondContact CB-O 3.31Å; P39-V132 CarbonylContact O-C 3.57Å; P39-V132 WeakPolarHBondContact O-CA 3.5Å; P39-K133 HydrophobicContact CB-CB 4.03Å; P39-K133 HydrophobicContact CB-CD 4.41Å; P39-K133 HydrophobicContact CB-CG 4.04Å; P39-K133 HydrophobicContact CG-CB 3.97Å; P39-K133 HydrophobicContact CG-CD 4Å; P39-K133 HydrophobicContact CG-CG 4.09Å; P39-K133 PolarHBondContact O-N 3.48Å
40	F	98.6	Very high	94.9	Very high	22 Å²	22	41.3 Å²	41.3	10%	0.096	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	-9.1	175.9	49.9	-103.4	0	0	0	113.5	R38 V55 L56 K133 L135 P217 I219	R38-F40 HydrophobicContact CB-CE2 4.3Å; R38-F40 HydrophobicContact CB-CZ 4.13Å; R38-F40 PolarHBondContact O-N 3.08Å; F40-V55 HydrophobicContact CB-CG1 4.36Å; F40-V55 HydrophobicContact CD2-CG1 4.4Å; F40-V55 WeakPolarHBondContact O-CA 3.19Å; F40-L56 PolarHBondContact O-N 3.49Å; F40-K133 WeakPolarHBondContact CA-O 3.32Å; F40-K133 WeakPolarHBondContact CB-O 3.45Å; F40-L135 HydrophobicContact CB-CB 3.56Å; F40-L135 HydrophobicContact CD1-CB 4.02Å; F40-L135 HydrophobicContact CD1-CD1 4.34Å; F40-L135 HydrophobicContact CD1-CD2 4.12Å; F40-L135 HydrophobicContact CD1-CG 4.4Å; F40-L135 HydrophobicContact CD2-CB 4.34Å; F40-L135 HydrophobicContact CD2-CD2 3.78Å; F40-L135 HydrophobicContact CE1-CD2 4.26Å; F40-L135 HydrophobicContact CE2-CD2 3.95Å; F40-L135 HydrophobicContact CG-CB 3.71Å; F40-L135 HydrophobicContact CG-CD2 3.88Å; F40-L135 HydrophobicContact CG-CG 4.31Å; F40-L135 HydrophobicContact CZ-CD2 4.18Å; F40-P217 HydrophobicContact CD2-CG 4.46Å; F40-P217 HydrophobicContact CE2-CG 3.91Å; F40-I219 HydrophobicContact CE1-CD1 4.29Å; F40-I219 HydrophobicContact CE2-CD1 3.88Å; F40-I219 HydrophobicContact CZ-CD1 3.47Å; F40-I219 VanDerWaalsContact CZ-CD1 3.47Å
41	M	98.7	Very high	95.7	Very high	3 Å²	3	42.2 Å²	42.2	2%	0.015	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	135.5	-178.6	-74.5	-59	-60.7	0	0	111	R38 T152 W154 L168 P217	R38-M41 HydrophobicContact CB-CG 3.77Å; R38-M41 WeakPolarHBondContact O-CB 3.13Å; R38-M41 PolarHBondContact O-N 2.8Å; M41-T152 WeakPolarHBondContact CE-O 3.32Å; M41-T152 HydrophobicContact CG-CG2 4.07Å; M41-T152 HydrophobicContact SD-CG2 4.1Å; M41-W154 HydrophobicContact CB-CH2 3.94Å; M41-W154 HydrophobicContact CB-CZ3 4.15Å; M41-W154 HydrophobicContact CE-CE3 4.36Å; M41-W154 HydrophobicContact CE-CZ3 3.88Å; M41-L168 HydrophobicContact CB-CD2 4.35Å; M41-L168 HydrophobicContact CE-CD1 4.17Å; M41-L168 HydrophobicContact CG-CD1 4.26Å; M41-L168 HydrophobicContact CG-CD2 3.98Å; M41-P217 WeakPolarHBondContact SD-CD 3.41Å; M41-P217 HydrophobicContact SD-CG 3.68Å
42	A	98.8	Very high	95.9	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	136	174	0	0	0	0	0	109.1	G53 G54 V62 V80 L82	A42-G53 CarbonylContact O-C 3.44Å; A42-G53 WeakPolarHBondContact O-CA 3.42Å; A42-G54 PolarHBondContact N-O 2.89Å; A42-G54 PolarHBondContact O-N 2.8Å; A42-V62 HydrophobicContact CB-CG1 3.84Å; A42-V62 HydrophobicContact CB-CG2 4.09Å; A42-V80 HydrophobicContact CB-CG1 3.92Å; A42-L82 HydrophobicContact CB-CD2 3.63Å
43	S	98.5	Very high	96.1	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	114.2	168.7	162.5	0	0	0	0	108.4	Q45 H50 V80 V81	S43-Q45 VanDerWaalsContact OG-CG 3.32Å; S43-Q45 WeakPolarHBondContact OG-CG 3.2Å; S43-Q45 PolarHBondContact OG-NE2 3.39Å; S43-H50 PolarHBondContact OG-ND1 3.41Å; S43-V80 WeakPolarHBondContact O-CA 3.36Å; S43-V81 PolarHBondContact N-O 3.21Å; S43-V81 PolarHBondContact O-N 2.82Å
44	I	97.5	Very high	96.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	126.7	171.5	-60.1	169.7	0	0	0	107.6	Y46 V51 C52 G53 T64 V80	I44-Y46 HydrophobicContact CG2-CE2 4.28Å; I44-V51 HydrophobicContact CB-CG2 4.47Å; I44-V51 HydrophobicContact CG2-CG2 4.1Å; I44-V51 WeakPolarHBondContact O-CG2 3.39Å; I44-V51 PolarHBondContact O-N 3.24Å; I44-C52 HydrophobicContact CB-CB 4.32Å; I44-C52 HydrophobicContact CD1-CB 4.36Å; I44-C52 PolarHBondContact N-O 3.5Å; I44-C52 PolarHBondContact O-N 3.33Å; I44-G53 WeakPolarHBondContact CD1-O 3.06Å; I44-T64 VanDerWaalsContact CD1-CB 3.47Å; I44-T64 HydrophobicContact CD1-CG2 3.54Å; I44-T64 WeakPolarHBondContact CD1-OG1 3.49Å; I44-V80 HydrophobicContact CG1-CG2 4.34Å
45	Q	95.8	Very high	96.2	Very high	19 Å²	19	27.3 Å²	27.3	9%	0.089	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	145.9	-174.3	-58.2	-171.6	-12.3	0	0	111.9	S43 G48 H49 P78 T79 V81	S43-Q45 VanDerWaalsContact OG-CG 3.32Å; S43-Q45 WeakPolarHBondContact OG-CG 3.2Å; S43-Q45 PolarHBondContact OG-NE2 3.39Å; Q45-G48 PolarHBondContact OE1-O 2.98Å; Q45-H49 CarbonylContact C-O 3.51Å; Q45-H49 WeakPolarHBondContact CA-O 3.49Å; Q45-H49 WeakPolarHBondContact CB-O 3.32Å; Q45-P78 CarbonylContact O-C 3.57Å; Q45-P78 WeakPolarHBondContact O-CA 3.32Å; Q45-T79 PolarHBondContact N-O 2.73Å; Q45-T79 PolarHBondContact O-N 3.03Å; Q45-V81 HydrophobicContact CG-CG2 4.25Å
46	Y	92.5	Very high	96.2	Very high	11 Å²	11	23.5 Å²	23.5	4%	0.043	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	122.4	169	-77.8	-104.5	0	0	0	108.1	I44 G48 H49 V51 Y70 P78	I44-Y46 HydrophobicContact CG2-CE2 4.28Å; Y46-G48 PolarHBondContact O-N 2.98Å; Y46-H49 PolarHBondContact N-O 2.8Å; Y46-H49 PolarHBondContact O-N 2.91Å; Y46-V51 HydrophobicContact CD2-CB 4.4Å; Y46-V51 HydrophobicContact CD2-CG1 3.94Å; Y46-V51 HydrophobicContact CD2-CG2 3.56Å; Y46-V51 HydrophobicContact CE2-CG2 3.84Å; Y46-Y70 HydrophobicContact CD2-CD2 4.28Å; Y46-Y70 AromaticContact CE2-CD2 3.96Å; Y46-Y70 HydrophobicContact CE2-CD2 3.96Å; Y46-Y70 PolarHBondContact OH-N 3.04Å; Y46-P78 HydrophobicContact CD1-CB 3.97Å; Y46-P78 HydrophobicContact CD2-CB 4.36Å; Y46-P78 HydrophobicContact CE1-CB 3.76Å; Y46-P78 HydrophobicContact CE1-CG 4.3Å; Y46-P78 HydrophobicContact CE2-CB 4.17Å; Y46-P78 HydrophobicContact CG-CB 4.28Å
47	G	91.1	Very high	96.2	Very high	37 Å²	37	22.2 Å²	22.2	38%	0.381	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	31.4	-175.5	0	0	0	0	0	113.6	H49	G47-H49 VanDerWaalsContact C-N 3.27Å; G47-H49 PolarHBondContact O-CD2 3.46Å; G47-H49 PolarHBondContact O-N 3.44Å
48	G	92.1	Very high	96.2	Very high	48 Å²	48	22.8 Å²	22.8	50%	0.495	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.2	1	-177.3	0	0	0	0	0	115.2	Q45 Y46	Q45-G48 PolarHBondContact OE1-O 2.98Å; Y46-G48 PolarHBondContact O-N 2.98Å
49	H	92.6	Very high	96.2	Very high	138 Å²	138	22 Å²	22	64%	0.639	13%	0.134	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.8	131.3	177.9	-62.2	-72	0	0	0	111.3	Q45 Y46 G47 V51	Q45-H49 CarbonylContact C-O 3.51Å; Q45-H49 WeakPolarHBondContact CA-O 3.49Å; Q45-H49 WeakPolarHBondContact CB-O 3.32Å; Y46-H49 PolarHBondContact N-O 2.8Å; Y46-H49 PolarHBondContact O-N 2.91Å; G47-H49 VanDerWaalsContact C-N 3.27Å; G47-H49 PolarHBondContact O-CD2 3.46Å; G47-H49 PolarHBondContact O-N 3.44Å; H49-V51 PolarHBondContact O-N 3.21Å
50	H	93.9	Very high	96.2	Very high	19 Å²	19	23.8 Å²	23.8	9%	0.088	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	129.2	174.6	-178.4	84.6	0	0	0	111.5	S43 C52 L87 W154 G212	S43-H50 PolarHBondContact OG-ND1 3.41Å; H50-C52 PolarHBondContact CE1-O 3.04Å; H50-L87 HydrophobicContact CB-CD1 3.57Å; H50-L87 HydrophobicContact CB-CD2 4Å; H50-L87 HydrophobicContact CB-CG 4.41Å; H50-W154 AromaticContact CE1-CE3 3.79Å; H50-G212 PolarHBondContact NE2-O 2.62Å
51	V	91.9	Very high	96.2	Very high	35 Å²	35	23.8 Å²	23.8	21%	0.212	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	-37.3	173.6	-58.1	0	0	0	0	112.4	I44 Y46 H49 Y70	I44-V51 HydrophobicContact CB-CG2 4.47Å; I44-V51 HydrophobicContact CG2-CG2 4.1Å; I44-V51 WeakPolarHBondContact O-CG2 3.39Å; I44-V51 PolarHBondContact O-N 3.24Å; Y46-V51 HydrophobicContact CD2-CB 4.4Å; Y46-V51 HydrophobicContact CD2-CG1 3.94Å; Y46-V51 HydrophobicContact CD2-CG2 3.56Å; Y46-V51 HydrophobicContact CE2-CG2 3.84Å; H49-V51 PolarHBondContact O-N 3.21Å; V51-Y70 HydrophobicContact CB-CD2 4.44Å; V51-Y70 HydrophobicContact CB-CE2 3.89Å; V51-Y70 HydrophobicContact CG1-CE2 4.26Å; V51-Y70 HydrophobicContact CG2-CD2 4.31Å; V51-Y70 HydrophobicContact CG2-CE2 4.07Å
52	C	94.4	Very high	96.2	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.007	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	154.9	-176.2	-81.5	0	0	0	0	111.3	I44 H50 C68 S214	I44-C52 HydrophobicContact CB-CB 4.32Å; I44-C52 HydrophobicContact CD1-CB 4.36Å; I44-C52 PolarHBondContact N-O 3.5Å; I44-C52 PolarHBondContact O-N 3.33Å; H50-C52 PolarHBondContact CE1-O 3.04Å; C52-C68 HydrophobicContact CB-CB 3.63Å; C52-C68 WeakPolarHBondContact CB-SG 3.44Å; C52-C68 VanDerWaalsContact SG-CA 3.58Å; C52-C68 WeakPolarHBondContact SG-CB 3.23Å; C52-C68 CovalentContact SG-SG 2.03Å; C52-C68 PolarHBondContact SG-SG 3.39Å; C52-S214 CarbonylContact C-O 3.38Å; C52-S214 WeakPolarHBondContact CA-O 3.41Å; C52-S214 VanDerWaalsContact CB-O 3.27Å; C52-S214 WeakPolarHBondContact CB-O 3.09Å; C52-S214 VanDerWaalsContact SG-CB 3.54Å
53	G	96.6	Very high	96.2	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	176.8	161.2	0	0	0	0	0	113.4	A42 I44 T64 S214 G215	A42-G53 CarbonylContact O-C 3.44Å; A42-G53 WeakPolarHBondContact O-CA 3.42Å; I44-G53 WeakPolarHBondContact CD1-O 3.06Å; G53-T64 PolarHBondContact O-OG1 3.04Å; G53-S214 WeakPolarHBondContact CA-O 3.4Å; G53-S214 PolarHBondContact N-O 3.45Å; G53-G215 CarbonylContact O-C 3.57Å
54	G	98	Very high	96.2	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.8	174.6	175.5	0	0	0	0	0	110.4	A42 L63 G215	A42-G54 PolarHBondContact N-O 2.89Å; A42-G54 PolarHBondContact O-N 2.8Å; G54-L63 CarbonylContact C-O 3.54Å; G54-L63 VanDerWaalsContact CA-O 3.27Å; G54-L63 WeakPolarHBondContact CA-O 2.76Å; G54-G215 WeakPolarHBondContact CA-O 3.31Å
55	V	98.7	Very high	96	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	125.1	-178.6	-176.6	0	0	0	0	109.8	F40 I57 V62 L63 L135 P217 F224	F40-V55 HydrophobicContact CB-CG1 4.36Å; F40-V55 HydrophobicContact CD2-CG1 4.4Å; F40-V55 WeakPolarHBondContact O-CA 3.19Å; V55-I57 HydrophobicContact CB-CG2 4.37Å; V55-I57 HydrophobicContact CG1-CG2 4.03Å; V55-I57 PolarHBondContact O-N 2.92Å; V55-V62 CarbonylContact O-C 3.43Å; V55-V62 VanDerWaalsContact O-CA 3.26Å; V55-V62 WeakPolarHBondContact O-CA 3.18Å; V55-L63 PolarHBondContact N-O 3.41Å; V55-L63 PolarHBondContact O-N 2.88Å; V55-L135 HydrophobicContact CG1-CB 3.66Å; V55-L135 HydrophobicContact CG1-CD2 3.87Å; V55-L135 HydrophobicContact CG1-CG 4.21Å; V55-P217 HydrophobicContact CG2-CB 3.7Å; V55-P217 HydrophobicContact CG2-CG 3.87Å; V55-F224 HydrophobicContact CB-CE1 4.01Å; V55-F224 HydrophobicContact CB-CZ 3.98Å; V55-F224 HydrophobicContact CG1-CD1 4.3Å; V55-F224 HydrophobicContact CG1-CE1 3.77Å; V55-F224 HydrophobicContact CG1-CZ 4.17Å; V55-F224 HydrophobicContact CG2-CE1 4.07Å; V55-F224 HydrophobicContact CG2-CE2 4.11Å; V55-F224 HydrophobicContact CG2-CZ 3.59Å
56	L	98.8	Very high	95.9	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	111.3	170.3	-170.7	71	0	0	0	109.6	F40 D58 V62 L82 L122 A126 L128 V132 L134 L135	F40-L56 PolarHBondContact O-N 3.49Å; L56-D58 VanDerWaalsContact CD1-O 3.23Å; L56-D58 WeakPolarHBondContact CD1-O 3.45Å; L56-V62 HydrophobicContact CD1-CG2 3.93Å; L56-L82 HydrophobicContact CB-CD2 4.17Å; L56-L82 HydrophobicContact CD1-CD1 3.99Å; L56-L82 HydrophobicContact CD1-CD2 4.34Å; L56-L82 HydrophobicContact CD2-CD1 4Å; L56-L82 HydrophobicContact CD2-CD2 4.49Å; L56-L122 HydrophobicContact CD1-CD1 4.22Å; L56-A126 HydrophobicContact CD1-CB 4.41Å; L56-A126 HydrophobicContact CD2-CB 4.19Å; L56-L128 HydrophobicContact CD2-CD2 3.98Å; L56-V132 HydrophobicContact CD2-CG1 3.78Å; L56-L134 HydrophobicContact CD2-CD2 3.7Å; L56-L134 HydrophobicContact CG-CD2 3.68Å; L56-L134 CarbonylContact O-C 3.52Å; L56-L134 WeakPolarHBondContact O-CA 3.42Å; L56-L135 PolarHBondContact O-N 2.98Å
57	I	98.3	Very high	95.8	Very high	13 Å²	13	24.1 Å²	24.1	7%	0.067	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	-17.9	-176.9	60.3	160.1	0	0	0	113	V55 W61 L63 L119 V137 F224 I254 L258	V55-I57 HydrophobicContact CB-CG2 4.37Å; V55-I57 HydrophobicContact CG1-CG2 4.03Å; V55-I57 PolarHBondContact O-N 2.92Å; I57-W61 HydrophobicContact CD1-CB 4.49Å; I57-W61 HydrophobicContact CG1-CB 4.08Å; I57-W61 WeakPolarHBondContact CG1-O 3.34Å; I57-W61 PolarHBondContact N-O 2.69Å; I57-L63 HydrophobicContact CD1-CB 4.15Å; I57-L63 HydrophobicContact CG1-CB 4.35Å; I57-L63 HydrophobicContact CG2-CB 3.81Å; I57-L63 HydrophobicContact CG2-CD2 4.45Å; I57-L119 HydrophobicContact CD1-CD2 3.59Å; I57-V137 HydrophobicContact CG2-CG2 4.04Å; I57-F224 HydrophobicContact CG2-CE1 4.22Å; I57-I254 HydrophobicContact CD1-CG2 3.72Å; I57-L258 HydrophobicContact CD1-CD1 4.21Å; I57-L258 HydrophobicContact CD1-CD2 4.33Å
58	D	97.9	Very high	95.8	Very high	55 Å²	55	22.4 Å²	22.4	29%	0.294	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	156.7	175.5	-178.1	-88.2	0	0	0	108.5	L56 Q60 W61 L258	L56-D58 VanDerWaalsContact CD1-O 3.23Å; L56-D58 WeakPolarHBondContact CD1-O 3.45Å; D58-Q60 PolarHBondContact O-N 2.61Å; D58-Q60 PolarHBondContact OD1-N 3.39Å; D58-W61 HydrophobicContact CB-CB 3.98Å; D58-W61 HydrophobicContact CB-CG 4.27Å; D58-W61 PolarHBondContact N-O 2.7Å; D58-W61 PolarHBondContact O-N 2.98Å; D58-W61 VanDerWaalsContact OD1-CD1 3.31Å; D58-L258 HydrophobicContact CB-CD2 3.97Å; D58-L258 HydrophobicContact CB-CG 4.44Å
59	P	98.1	Very high	95.8	Very high	38 Å²	38	23.6 Å²	23.6	25%	0.247	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-25.2	-175.5	-31.2	38.1	0	0	0	115.4	A125 A126 L128 L134	P59-A125 HydrophobicContact CB-CB 4.21Å; P59-A125 CarbonylContact O-C 3.5Å; P59-A125 WeakPolarHBondContact O-CA 3.13Å; P59-A126 WeakPolarHBondContact O-CB 3.21Å; P59-A126 PolarHBondContact O-N 3.35Å; P59-L128 HydrophobicContact CG-CD1 4.29Å; P59-L134 HydrophobicContact CG-CD1 4.45Å
60	Q	97.9	Very high	95.3	Very high	59 Å²	59	22.1 Å²	22.1	28%	0.276	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.8	13	175.9	-74.7	-168.1	-59	0	0	114.4	D58 K121 L122 A125	D58-Q60 PolarHBondContact O-N 2.61Å; D58-Q60 PolarHBondContact OD1-N 3.39Å; Q60-K121 HydrophobicContact CB-CD 4.31Å; Q60-L122 PolarHBondContact O-N 2.87Å; Q60-A125 VanDerWaalsContact CG-CA 3.44Å; Q60-A125 HydrophobicContact CG-CB 3.7Å
61	W	98.5	Very high	94.5	Very high	23 Å²	23	26.4 Å²	26.4	9%	0.087	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	126	-175.5	-58.4	93.9	0	0	0	112.7	I57 D58 I103 L119 V120 K121 N257 L258	I57-W61 HydrophobicContact CD1-CB 4.49Å; I57-W61 HydrophobicContact CG1-CB 4.08Å; I57-W61 WeakPolarHBondContact CG1-O 3.34Å; I57-W61 PolarHBondContact N-O 2.69Å; D58-W61 HydrophobicContact CB-CB 3.98Å; D58-W61 HydrophobicContact CB-CG 4.27Å; D58-W61 PolarHBondContact N-O 2.7Å; D58-W61 PolarHBondContact O-N 2.98Å; D58-W61 VanDerWaalsContact OD1-CD1 3.31Å; W61-I103 HydrophobicContact CH2-CD1 3.78Å; W61-I103 HydrophobicContact CZ3-CD1 3.68Å; W61-L119 HydrophobicContact CE3-CB 4.03Å; W61-L119 HydrophobicContact CE3-CD1 4.46Å; W61-L119 HydrophobicContact CE3-CD2 4.44Å; W61-L119 HydrophobicContact CZ3-CB 4.08Å; W61-L119 HydrophobicContact CZ3-CD1 4.42Å; W61-V120 WeakPolarHBondContact CA-O 3.42Å; W61-K121 HydrophobicContact CD2-CD 3.76Å; W61-K121 VanDerWaalsContact CE2-CD 3.47Å; W61-K121 HydrophobicContact CE3-CB 4.01Å; W61-K121 HydrophobicContact CE3-CD 3.96Å; W61-K121 HydrophobicContact CH2-CB 4.14Å; W61-K121 HydrophobicContact CH2-CD 3.7Å; W61-K121 HydrophobicContact CH2-CG 4.36Å; W61-K121 HydrophobicContact CZ2-CD 3.47Å; W61-K121 VanDerWaalsContact CZ2-CD 3.47Å; W61-K121 HydrophobicContact CZ3-CB 3.72Å; W61-K121 HydrophobicContact CZ3-CD 3.92Å; W61-K121 HydrophobicContact CZ3-CG 4.37Å; W61-N257 HydrophobicContact CH2-CB 4.47Å; W61-N257 WeakPolarHBondContact CZ2-O 3.44Å; W61-L258 HydrophobicContact CB-CD1 4.33Å; W61-L258 HydrophobicContact CD2-CD1 4.11Å; W61-L258 HydrophobicContact CG-CD1 3.98Å; W61-L258 HydrophobicContact CG-CG 4.22Å
62	V	98.8	Very high	93.3	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	136.4	169.2	171.7	0	0	0	0	109.3	A42 V55 L56 V80 V120 L122	A42-V62 HydrophobicContact CB-CG1 3.84Å; A42-V62 HydrophobicContact CB-CG2 4.09Å; V55-V62 CarbonylContact O-C 3.43Å; V55-V62 VanDerWaalsContact O-CA 3.26Å; V55-V62 WeakPolarHBondContact O-CA 3.18Å; L56-V62 HydrophobicContact CD1-CG2 3.93Å; V62-V80 HydrophobicContact CG2-CG1 4.05Å; V62-V120 HydrophobicContact CB-CB 4.17Å; V62-V120 PolarHBondContact N-O 2.65Å; V62-V120 PolarHBondContact O-N 2.87Å; V62-L122 HydrophobicContact CG2-CD1 4.39Å; V62-L122 HydrophobicContact CG2-CD2 4.34Å
63	L	98.5	Very high	92.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	134.4	170.1	-167.1	67.3	0	0	0	109.4	G54 V55 I57 I117 L119 V137 F224 I227 L246 W253 I254	G54-L63 CarbonylContact C-O 3.54Å; G54-L63 VanDerWaalsContact CA-O 3.27Å; G54-L63 WeakPolarHBondContact CA-O 2.76Å; V55-L63 PolarHBondContact N-O 3.41Å; V55-L63 PolarHBondContact O-N 2.88Å; I57-L63 HydrophobicContact CD1-CB 4.15Å; I57-L63 HydrophobicContact CG1-CB 4.35Å; I57-L63 HydrophobicContact CG2-CB 3.81Å; I57-L63 HydrophobicContact CG2-CD2 4.45Å; L63-I117 HydrophobicContact CD1-CD1 3.98Å; L63-I117 HydrophobicContact CD1-CG1 3.83Å; L63-I117 HydrophobicContact CD2-CD1 4.41Å; L63-I117 HydrophobicContact CG-CD1 4.47Å; L63-I117 HydrophobicContact CG-CG1 4.44Å; L63-L119 HydrophobicContact CD1-CD2 3.77Å; L63-L119 HydrophobicContact CD1-CG 4.3Å; L63-V137 HydrophobicContact CD2-CG2 4.19Å; L63-F224 HydrophobicContact CD2-CE1 3.96Å; L63-F224 HydrophobicContact CD2-CZ 3.99Å; L63-I227 HydrophobicContact CD2-CG2 4.21Å; L63-I227 HydrophobicContact CG-CG2 4.38Å; L63-L246 HydrophobicContact CD2-CD1 4.17Å; L63-L246 HydrophobicContact CD2-CD2 3.79Å; L63-W253 HydrophobicContact CD1-CZ3 4.4Å; L63-I254 HydrophobicContact CD1-CD1 3.87Å; L63-I254 HydrophobicContact CD1-CG1 4.16Å; L63-I254 HydrophobicContact CD2-CD1 3.85Å
64	T	97.6	Very high	90.4	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	-176.8	-178.9	-171.7	0	0	0	0	110.1	I44 G53 I117 M118 V120 G215 I227	I44-T64 VanDerWaalsContact CD1-CB 3.47Å; I44-T64 HydrophobicContact CD1-CG2 3.54Å; I44-T64 WeakPolarHBondContact CD1-OG1 3.49Å; G53-T64 PolarHBondContact O-OG1 3.04Å; T64-I117 WeakPolarHBondContact O-CA 3.46Å; T64-M118 HydrophobicContact CG2-CB 4.2Å; T64-M118 HydrophobicContact CG2-CE 3.57Å; T64-M118 HydrophobicContact CG2-CG 4.45Å; T64-M118 PolarHBondContact N-O 2.96Å; T64-M118 PolarHBondContact O-N 2.98Å; T64-V120 HydrophobicContact CG2-CG2 3.68Å; T64-G215 WeakPolarHBondContact OG1-CA 3.4Å; T64-I227 WeakPolarHBondContact O-CD1 3.01Å
65	A	94.6	Very high	88.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.257	C	S	.	.			trans	-81.3	147.4	173.2	0	0	0	0	0	110.9	H67 C68 I227	A65-H67 WeakPolarHBondContact CB-CE1 3.45Å; A65-H67 WeakPolarHBondContact CB-ND1 3.33Å; A65-C68 VanDerWaalsContact O-CB 3.31Å; A65-C68 WeakPolarHBondContact O-CB 3.43Å; A65-C68 PolarHBondContact O-N 2.81Å; A65-I227 HydrophobicContact CB-CD1 4.48Å
66	A	93.9	Very high	87.6	Confident	3 Å²	3	52.6 Å²	52.6	3%	0.025	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-70.4	-33.6	-178.3	0	0	0	0	0	112.7	C68 Q69 P104 F108 D116 M118	A66-C68 PolarHBondContact O-N 2.83Å; A66-C68 VanDerWaalsContact O-N 3.11Å; A66-Q69 WeakPolarHBondContact O-CB 3.47Å; A66-Q69 PolarHBondContact O-N 2.88Å; A66-Q69 VanDerWaalsContact O-N 3.13Å; A66-P104 HydrophobicContact CB-CB 4.04Å; A66-F108 HydrophobicContact CB-CB 4.45Å; A66-F108 HydrophobicContact CB-CD1 3.66Å; A66-F108 HydrophobicContact CB-CD2 4.01Å; A66-F108 HydrophobicContact CB-CE1 3.8Å; A66-F108 HydrophobicContact CB-CE2 4.15Å; A66-F108 HydrophobicContact CB-CG 3.76Å; A66-F108 HydrophobicContact CB-CZ 4.05Å; A66-D116 WeakPolarHBondContact CA-OD1 3.4Å; A66-D116 WeakPolarHBondContact CB-OD1 3.24Å; A66-D116 PolarHBondContact N-OD1 2.78Å; A66-M118 HydrophobicContact CB-CB 4.1Å
67	H	90	Very high	86.9	Confident	37 Å²	37	56.6 Å²	56.6	17%	0.171	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-64.4	-14.4	176.9	77.5	-93.5	0	0	0	113.3	A65 Q69 F108 D116 S214 S229	A65-H67 WeakPolarHBondContact CB-CE1 3.45Å; A65-H67 WeakPolarHBondContact CB-ND1 3.33Å; H67-Q69 PolarHBondContact O-N 2.75Å; H67-F108 HydrophobicContact CB-CZ 4.07Å; H67-D116 IonicContact CE1-OD2 2.8Å; H67-D116 IonicContact CG-OD1 3.41Å; H67-D116 IonicContact CG-OD2 2.79Å; H67-D116 PolarHBondContact N-OD1 2.84Å; H67-D116 IonicContact ND1-OD1 2.88Å; H67-D116 PolarHBondContact ND1-OD1 2.69Å; H67-D116 IonicContact ND1-OD2 3.91Å; H67-D116 PolarHBondContact ND1-OD2 3.37Å; H67-S214 WeakPolarHBondContact CE1-CB 3.48Å; H67-S214 PolarHBondContact CE1-OG 3.46Å; H67-S214 VanDerWaalsContact CE1-OG 3.23Å; H67-S214 WeakPolarHBondContact NE2-CB 3.48Å; H67-S214 PolarHBondContact NE2-OG 2.75Å; H67-S229 PolarHBondContact CE1-O 2.63Å; H67-S229 PolarHBondContact ND1-O 3.35Å
68	C	91.4	Very high	86.7	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-68.9	-11.3	174.7	-64.3	0	0	0	0	113.5	C52 A65 A66 Y70	C52-C68 HydrophobicContact CB-CB 3.63Å; C52-C68 WeakPolarHBondContact CB-SG 3.44Å; C52-C68 VanDerWaalsContact SG-CA 3.58Å; C52-C68 WeakPolarHBondContact SG-CB 3.23Å; C52-C68 CovalentContact SG-SG 2.03Å; C52-C68 PolarHBondContact SG-SG 3.39Å; A65-C68 VanDerWaalsContact O-CB 3.31Å; A65-C68 WeakPolarHBondContact O-CB 3.43Å; A65-C68 PolarHBondContact O-N 2.81Å; A66-C68 PolarHBondContact O-N 2.83Å; A66-C68 VanDerWaalsContact O-N 3.11Å; C68-Y70 WeakPolarHBondContact O-CD2 3.29Å; C68-Y70 PolarHBondContact O-N 2.92Å
69	Q	90.4	Very high	86.6	Confident	74 Å²	74	55 Å²	55	35%	0.346	30%	0.297	S	S	.	.			trans	-80.1	102.7	173.6	-173.5	-177.7	-16.1	0	0	110.3	A66 H67 F102 M118	A66-Q69 WeakPolarHBondContact O-CB 3.47Å; A66-Q69 PolarHBondContact O-N 2.88Å; A66-Q69 VanDerWaalsContact O-N 3.13Å; H67-Q69 PolarHBondContact O-N 2.75Å; Q69-F102 HydrophobicContact CG-CB 4.37Å; Q69-F102 HydrophobicContact CG-CD2 4.16Å; Q69-F102 HydrophobicContact CG-CG 4.1Å; Q69-M118 HydrophobicContact CB-CE 4.01Å; Q69-M118 HydrophobicContact CB-SD 3.96Å
70	Y	82.9	Confident	86.7	Confident	107 Å²	107	53.2 Å²	53.2	42%	0.42	29%	0.286	S	S	.	.			trans	-87.4	152.7	171.7	-67.7	-79.6	0	0	0	112.1	Y46 V51 C68 F72	Y46-Y70 HydrophobicContact CD2-CD2 4.28Å; Y46-Y70 AromaticContact CE2-CD2 3.96Å; Y46-Y70 HydrophobicContact CE2-CD2 3.96Å; Y46-Y70 PolarHBondContact OH-N 3.04Å; V51-Y70 HydrophobicContact CB-CD2 4.44Å; V51-Y70 HydrophobicContact CB-CE2 3.89Å; V51-Y70 HydrophobicContact CG1-CE2 4.26Å; V51-Y70 HydrophobicContact CG2-CD2 4.31Å; V51-Y70 HydrophobicContact CG2-CE2 4.07Å; C68-Y70 WeakPolarHBondContact O-CD2 3.29Å; C68-Y70 PolarHBondContact O-N 2.92Å; Y70-F72 PolarHBondContact O-N 2.98Å
71	P	76.3	Confident	86.7	Confident	109 Å²	109	50.7 Å²	50.7	71%	0.708	27%	0.274	S	S	*	.			trans	-54.9	136.2	170	-22.2	32.5	0	0	0	111.1	T73	P71-T73 PolarHBondContact O-N 2.89Å; P71-T73 VanDerWaalsContact O-N 3.1Å
72	F	67.9	Low	86.7	Confident	138 Å²	138	49.6 Å²	49.6	61%	0.605	27%	0.27	S	S	*	.			trans	-66.1	112.1	177.6	-60.1	-78.3	0	0	0	109.9	Y70 P78 F102	Y70-F72 PolarHBondContact O-N 2.98Å; F72-P78 HydrophobicContact CD1-CG 4.4Å; F72-P78 HydrophobicContact CE1-CG 3.85Å; F72-F102 HydrophobicContact CE1-CE2 4.01Å; F72-F102 HydrophobicContact CZ-CD2 4.05Å; F72-F102 AromaticContact CZ-CE2 3.92Å; F72-F102 HydrophobicContact CZ-CE2 3.92Å
73	T	68.2	Low	86.7	Confident	72 Å²	72	49.9 Å²	49.9	44%	0.442	27%	0.273	S	S	.	.			trans	-86.5	141.5	163.3	66.2	0	0	0	0	108.6	P71 G75 Q76	P71-T73 PolarHBondContact O-N 2.89Å; P71-T73 VanDerWaalsContact O-N 3.1Å; T73-G75 PolarHBondContact O-N 2.89Å; T73-G75 VanDerWaalsContact O-N 3.1Å; T73-Q76 PolarHBondContact O-N 2.79Å; T73-Q76 WeakPolarHBondContact OG1-CB 3.34Å; T73-Q76 WeakPolarHBondContact OG1-CG 3.46Å; T73-Q76 PolarHBondContact OG1-OE1 2.84Å
74	K	61.5	Low	86.7	Confident	218 Å²	218	50.2 Å²	50.2	95%	0.948	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	117.3	-179.6	-166	176.9	-177.9	-179	0	109
75	G	63.7	Low	86.7	Confident	74 Å²	74	50.7 Å²	50.7	76%	0.763	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.4	-5.8	-178.6	0	0	0	0	0	115.9	T73	T73-G75 PolarHBondContact O-N 2.89Å; T73-G75 VanDerWaalsContact O-N 3.1Å
76	Q	74.6	Confident	86.9	Confident	83 Å²	83	50.8 Å²	50.8	39%	0.388	28%	0.278	S	S	.	.			trans	-103.7	73.5	172.3	-66.2	-175.2	-22.3	0	0	110.7	T73 P78	T73-Q76 PolarHBondContact O-N 2.79Å; T73-Q76 WeakPolarHBondContact OG1-CB 3.34Å; T73-Q76 WeakPolarHBondContact OG1-CG 3.46Å; T73-Q76 PolarHBondContact OG1-OE1 2.84Å; Q76-P78 WeakPolarHBondContact O-CD 3.5Å
77	S	84	Confident	87	Confident	85 Å²	85	52.2 Å²	52.2	59%	0.594	29%	0.285	S	S	*	.			trans	-65.3	124.5	172.6	-63	0	0	0	0	109.7
78	P	93.4	Very high	87.4	Confident	15 Å²	15	54.7 Å²	54.7	10%	0.097	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	140.2	-178.6	34.2	-35.8	0	0	0	111	Q45 Y46 F72 Q76 I99 F102	Q45-P78 CarbonylContact O-C 3.57Å; Q45-P78 WeakPolarHBondContact O-CA 3.32Å; Y46-P78 HydrophobicContact CD1-CB 3.97Å; Y46-P78 HydrophobicContact CD2-CB 4.36Å; Y46-P78 HydrophobicContact CE1-CB 3.76Å; Y46-P78 HydrophobicContact CE1-CG 4.3Å; Y46-P78 HydrophobicContact CE2-CB 4.17Å; Y46-P78 HydrophobicContact CG-CB 4.28Å; F72-P78 HydrophobicContact CD1-CG 4.4Å; F72-P78 HydrophobicContact CE1-CG 3.85Å; Q76-P78 WeakPolarHBondContact O-CD 3.5Å; P78-I99 HydrophobicContact CB-CD1 4.04Å; P78-I99 HydrophobicContact CG-CB 4.47Å; P78-I99 HydrophobicContact CG-CD1 4.46Å; P78-I99 PolarHBondContact O-N 2.89Å; P78-F102 HydrophobicContact CB-CE2 4.49Å; P78-F102 HydrophobicContact CB-CZ 4.02Å; P78-F102 HydrophobicContact CG-CE2 3.89Å; P78-F102 HydrophobicContact CG-CZ 3.89Å
79	T	97.2	Very high	87.6	Confident	21 Å²	21	60.9 Å²	60.9	13%	0.129	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	161.7	-178	59.4	0	0	0	0	111	Q45 T96 L97	Q45-T79 PolarHBondContact N-O 2.73Å; Q45-T79 PolarHBondContact O-N 3.03Å; T79-T96 HydrophobicContact CG2-CG2 4.14Å; T79-L97 CarbonylContact C-O 3.54Å; T79-L97 WeakPolarHBondContact CA-O 3.38Å
80	V	98.5	Very high	87.9	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	129.6	166.7	170.9	0	0	0	0	108.5	A42 S43 I44 V62 L82 T96 L97 I99 V120 L122	A42-V80 HydrophobicContact CB-CG1 3.92Å; S43-V80 WeakPolarHBondContact O-CA 3.36Å; I44-V80 HydrophobicContact CG1-CG2 4.34Å; V62-V80 HydrophobicContact CG2-CG1 4.05Å; V80-L82 HydrophobicContact CG1-CD2 3.9Å; V80-L82 HydrophobicContact CG1-CG 4.01Å; V80-T96 WeakPolarHBondContact O-CA 3.46Å; V80-L97 PolarHBondContact N-O 2.83Å; V80-L97 PolarHBondContact O-N 2.84Å; V80-I99 HydrophobicContact CG2-CD1 3.92Å; V80-I99 HydrophobicContact CG2-CG1 3.93Å; V80-V120 HydrophobicContact CG2-CG1 4.17Å; V80-L122 HydrophobicContact CB-CD2 3.79Å; V80-L122 HydrophobicContact CG1-CD2 4.28Å; V80-L122 HydrophobicContact CG2-CD2 3.68Å
81	V	98.7	Very high	88.7	Confident	5 Å²	5	62 Å²	62	3%	0.03	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	120.3	170.7	-174.6	0	0	0	0	109.3	S43 Q45 A84 K94 Q95 T96	S43-V81 PolarHBondContact N-O 3.21Å; S43-V81 PolarHBondContact O-N 2.82Å; Q45-V81 HydrophobicContact CG-CG2 4.25Å; V81-A84 HydrophobicContact CG1-CB 4.09Å; V81-K94 HydrophobicContact CG1-CB 4.39Å; V81-K94 HydrophobicContact CG1-CD 4.21Å; V81-K94 HydrophobicContact CG1-CG 4Å; V81-Q95 WeakPolarHBondContact CA-O 3.33Å; V81-T96 HydrophobicContact CG2-CG2 4.26Å
82	L	98.9	Very high	89.7	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.005	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	158.5	175.6	-59.7	172.3	0	0	0	110.6	A42 L56 V80 A84 K94 Q95 L97 A126 V132	A42-L82 HydrophobicContact CB-CD2 3.63Å; L56-L82 HydrophobicContact CB-CD2 4.17Å; L56-L82 HydrophobicContact CD1-CD1 3.99Å; L56-L82 HydrophobicContact CD1-CD2 4.34Å; L56-L82 HydrophobicContact CD2-CD1 4Å; L56-L82 HydrophobicContact CD2-CD2 4.49Å; V80-L82 HydrophobicContact CG1-CD2 3.9Å; V80-L82 HydrophobicContact CG1-CG 4.01Å; L82-A84 PolarHBondContact O-N 2.88Å; L82-K94 WeakPolarHBondContact O-CA 3.14Å; L82-Q95 HydrophobicContact CB-CB 4.42Å; L82-Q95 PolarHBondContact N-O 3.04Å; L82-Q95 PolarHBondContact O-N 2.84Å; L82-L97 HydrophobicContact CD1-CD1 3.64Å; L82-L97 HydrophobicContact CG-CD1 4.04Å; L82-A126 HydrophobicContact CD1-CB 3.44Å; L82-A126 VanDerWaalsContact CD1-CB 3.44Å; L82-V132 HydrophobicContact CB-CG1 4.1Å; L82-V132 HydrophobicContact CB-CG2 4.08Å; L82-V132 HydrophobicContact CD1-CG1 3.97Å
83	G	98.6	Very high	91.2	Very high	5 Å²	5	56.5 Å²	56.5	5%	0.052	34%	0.337	C	S	.	.	S	Bend	trans	70.1	13.5	173.9	0	0	0	0	0	114.4	H36 S93 H131	H36-G83 PolarHBondContact CE1-O 3.2Å; H36-G83 PolarHBondContact ND1-O 3.32Å; G83-S93 WeakPolarHBondContact O-CB 3.29Å; G83-S93 PolarHBondContact O-OG 3.47Å; G83-H131 WeakPolarHBondContact CA-O 3.17Å
84	A	98.4	Very high	92.6	Very high	8 Å²	8	55.4 Å²	55.4	7%	0.066	33%	0.326	C	S	.	.			trans	-82.9	146.1	177.4	0	0	0	0	0	112	V81 L82 E91 K94 W154	V81-A84 HydrophobicContact CG1-CB 4.09Å; L82-A84 PolarHBondContact O-N 2.88Å; A84-E91 WeakPolarHBondContact CA-OE2 3.46Å; A84-K94 HydrophobicContact CB-CD 4.36Å; A84-K94 HydrophobicContact CB-CG 3.98Å; A84-W154 HydrophobicContact CB-CZ2 4.15Å
85	H	98.4	Very high	94.4	Very high	10 Å²	10	46.4 Å²	46.4	5%	0.046	29%	0.287	C	S	.	.	S	Bend	trans	-109.4	-52	159	178.1	64.3	0	0	0	110.7	E32 V33 P35 E91 W154 T167 L168	E32-H85 IonicContact OE1-CD2 2.83Å; E32-H85 IonicContact OE1-CE1 3.54Å; E32-H85 IonicContact OE1-NE2 2.8Å; E32-H85 PolarHBondContact OE1-NE2 2.93Å; V33-H85 PolarHBondContact O-CE1 2.83Å; P35-H85 HydrophobicContact CB-CB 4.09Å; H85-E91 WeakPolarHBondContact CB-OE1 3.39Å; H85-E91 PolarHBondContact N-OE1 3.33Å; H85-E91 PolarHBondContact N-OE2 3.08Å; H85-W154 PolarHBondContact O-NE1 2.62Å; H85-T167 WeakPolarHBondContact O-CA 3.49Å; H85-L168 PolarHBondContact O-N 3.1Å
86	S	98.3	Very high	96	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.007	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-94.4	138.5	172.8	165.2	0	0	0	0	111.1	S88 K89 E91 K94 D166	S86-S88 PolarHBondContact OG-N 2.91Å; S86-S88 PolarHBondContact OG-OG 3.22Å; S86-K89 WeakPolarHBondContact OG-CB 3.48Å; S86-K89 VanDerWaalsContact OG-CG 3.32Å; S86-K89 WeakPolarHBondContact OG-CG 3.47Å; S86-K89 PolarHBondContact OG-N 2.97Å; S86-E91 PolarHBondContact N-OE1 2.96Å; S86-K94 WeakPolarHBondContact O-CE 3.43Å; S86-K94 PolarHBondContact O-NZ 3.47Å; S86-D166 CarbonylContact C-O 3.58Å; S86-D166 VanDerWaalsContact CA-O 3.23Å; S86-D166 WeakPolarHBondContact CA-O 3.47Å; S86-D166 WeakPolarHBondContact CB-OD2 3.4Å; S86-D166 VanDerWaalsContact OG-CG 3.26Å; S86-D166 PolarHBondContact OG-OD1 2.94Å; S86-D166 PolarHBondContact OG-OD2 2.94Å
87	L	96.7	Very high	97.2	Very high	34 Å²	34	43.9 Å²	43.9	18%	0.178	26%	0.262	C	S	.	.	S	Bend	trans	-69.7	-42.9	174.8	-66.9	178.2	0	0	0	111.4	H50 K94 W154 P164 S165 D166	H50-L87 HydrophobicContact CB-CD1 3.57Å; H50-L87 HydrophobicContact CB-CD2 4Å; H50-L87 HydrophobicContact CB-CG 4.41Å; L87-K94 PolarHBondContact O-NZ 2.8Å; L87-W154 HydrophobicContact CD1-CB 3.95Å; L87-W154 HydrophobicContact CD1-CG 4Å; L87-W154 HydrophobicContact CD2-CD2 3.98Å; L87-W154 HydrophobicContact CD2-CG 3.95Å; L87-W154 HydrophobicContact CG-CB 4.42Å; L87-W154 HydrophobicContact CG-CD2 4.44Å; L87-W154 HydrophobicContact CG-CG 3.93Å; L87-P164 HydrophobicContact CD1-CB 4.14Å; L87-S165 WeakPolarHBondContact CD1-O 3.34Å; L87-D166 PolarHBondContact N-O 3.33Å; L87-D166 PolarHBondContact N-OD1 3.27Å
88	S	96.4	Very high	97.8	Very high	88 Å²	88	45.9 Å²	45.9	62%	0.615	26%	0.262	S	S	*	.	S	Bend	trans	-86.3	-31.6	-174.2	62.5	0	0	0	0	115.1	S86 D166	S86-S88 PolarHBondContact OG-N 2.91Å; S86-S88 PolarHBondContact OG-OG 3.22Å; S88-D166 WeakPolarHBondContact CB-OD1 3.39Å; S88-D166 PolarHBondContact N-OD1 3.18Å; S88-D166 VanDerWaalsContact OG-CG 3.26Å; S88-D166 PolarHBondContact OG-OD1 2.76Å; S88-D166 PolarHBondContact OG-OD2 2.03Å
89	K	97.6	Very high	97.9	Very high	130 Å²	130	46.4 Å²	46.4	57%	0.565	26%	0.264	S	S	*	.	S	Bend	trans	-75.7	145.8	-175.6	-65.9	176.5	-176.7	178.7	0	112.2	S86 E91 K94	S86-K89 WeakPolarHBondContact OG-CB 3.48Å; S86-K89 VanDerWaalsContact OG-CG 3.32Å; S86-K89 WeakPolarHBondContact OG-CG 3.47Å; S86-K89 PolarHBondContact OG-N 2.97Å; K89-E91 PolarHBondContact O-N 2.84Å; K89-K94 WeakPolarHBondContact O-CE 3.18Å; K89-K94 PolarHBondContact O-NZ 3.3Å
90	N	96.6	Very high	97.8	Very high	168 Å²	168	52 Å²	52	90%	0.898	29%	0.286	S	S	*	.			trans	-76.4	123	168	-70.6	-29.1	0	0	0	109.5
91	E	98.3	Very high	97.6	Very high	36 Å²	36	58 Å²	58	17%	0.168	31%	0.313	C	S	.	.			trans	-128.5	130.4	-178.3	-62.3	170.3	156.6	0	0	108.4	H36 A84 H85 S86 K89 S93 K94	H36-E91 IonicContact CE1-OE2 3.29Å; A84-E91 WeakPolarHBondContact CA-OE2 3.46Å; H85-E91 WeakPolarHBondContact CB-OE1 3.39Å; H85-E91 PolarHBondContact N-OE1 3.33Å; H85-E91 PolarHBondContact N-OE2 3.08Å; S86-E91 PolarHBondContact N-OE1 2.96Å; K89-E91 PolarHBondContact O-N 2.84Å; E91-S93 PolarHBondContact O-N 2.9Å; E91-K94 HydrophobicContact CB-CD 4.27Å; E91-K94 HydrophobicContact CB-CG 4.11Å; E91-K94 WeakPolarHBondContact O-CB 3.42Å; E91-K94 PolarHBondContact O-N 2.88Å; E91-K94 WeakPolarHBondContact OE2-CE 3.35Å
92	A	98.1	Very high	97.4	Very high	119 Å²	119	58.7 Å²	58.7	98%	0.983	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-19.5	-177.3	0	0	0	0	0	113.7
93	S	98.3	Very high	97.3	Very high	13 Å²	13	60.1 Å²	60.1	9%	0.091	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-16.4	176.4	52.5	0	0	0	0	114.1	H36 G83 E91 Q95	H36-S93 PolarHBondContact CE1-OG 2.89Å; G83-S93 WeakPolarHBondContact O-CB 3.29Å; G83-S93 PolarHBondContact O-OG 3.47Å; E91-S93 PolarHBondContact O-N 2.9Å; S93-Q95 PolarHBondContact O-N 3.01Å
94	K	98.6	Very high	97.1	Very high	49 Å²	49	62.1 Å²	62.1	21%	0.213	34%	0.335	C	S	.	.			trans	-64.6	132.9	-175.8	-83.5	178.1	176.4	-175.1	0	111.1	V81 L82 A84 S86 L87 K89 E91	V81-K94 HydrophobicContact CG1-CB 4.39Å; V81-K94 HydrophobicContact CG1-CD 4.21Å; V81-K94 HydrophobicContact CG1-CG 4Å; L82-K94 WeakPolarHBondContact O-CA 3.14Å; A84-K94 HydrophobicContact CB-CD 4.36Å; A84-K94 HydrophobicContact CB-CG 3.98Å; S86-K94 WeakPolarHBondContact O-CE 3.43Å; S86-K94 PolarHBondContact O-NZ 3.47Å; L87-K94 PolarHBondContact O-NZ 2.8Å; K89-K94 WeakPolarHBondContact O-CE 3.18Å; K89-K94 PolarHBondContact O-NZ 3.3Å; E91-K94 HydrophobicContact CB-CD 4.27Å; E91-K94 HydrophobicContact CB-CG 4.11Å; E91-K94 WeakPolarHBondContact O-CB 3.42Å; E91-K94 PolarHBondContact O-N 2.88Å; E91-K94 WeakPolarHBondContact OE2-CE 3.35Å
95	Q	98.6	Very high	96.9	Very high	30 Å²	30	63 Å²	63	14%	0.14	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	115.1	168.1	-63.2	176.5	43.2	0	0	107.9	V81 L82 S93 L97 K127 N129	V81-Q95 WeakPolarHBondContact CA-O 3.33Å; L82-Q95 HydrophobicContact CB-CB 4.42Å; L82-Q95 PolarHBondContact N-O 3.04Å; L82-Q95 PolarHBondContact O-N 2.84Å; S93-Q95 PolarHBondContact O-N 3.01Å; Q95-L97 HydrophobicContact CB-CD1 3.88Å; Q95-L97 WeakPolarHBondContact O-CD1 3.34Å; Q95-K127 PolarHBondContact NE2-O 2.95Å; Q95-N129 PolarHBondContact NE2-ND2 2.87Å
96	T	98.4	Very high	96.4	Very high	95 Å²	95	66 Å²	66	58%	0.583	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.8	117.9	173.3	-55.8	0	0	0	0	108.3	T79 V80 V81	T79-T96 HydrophobicContact CG2-CG2 4.14Å; V80-T96 WeakPolarHBondContact O-CA 3.46Å; V81-T96 HydrophobicContact CG2-CG2 4.26Å
97	L	98.4	Very high	95.5	Very high	9 Å²	9	76.6 Å²	76.6	5%	0.047	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	136.4	-179	-58.3	101.7	0	0	0	110	T79 V80 L82 Q95 L122 T124 A126	T79-L97 CarbonylContact C-O 3.54Å; T79-L97 WeakPolarHBondContact CA-O 3.38Å; V80-L97 PolarHBondContact N-O 2.83Å; V80-L97 PolarHBondContact O-N 2.84Å; L82-L97 HydrophobicContact CD1-CD1 3.64Å; L82-L97 HydrophobicContact CG-CD1 4.04Å; Q95-L97 HydrophobicContact CB-CD1 3.88Å; Q95-L97 WeakPolarHBondContact O-CD1 3.34Å; L97-L122 HydrophobicContact CB-CD2 4.4Å; L97-L122 HydrophobicContact CD2-CD1 4.13Å; L97-T124 WeakPolarHBondContact CD2-O 3.45Å; L97-A126 HydrophobicContact CD2-CB 4.41Å
98	E	97.1	Very high	94.4	Very high	127 Å²	127	77.6 Å²	77.6	59%	0.593	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.2	147.5	172.3	-64.8	-176.5	160.8	0	0	111.2	Q123	E98-Q123 HydrophobicContact CB-CB 3.99Å; E98-Q123 WeakPolarHBondContact O-CB 3.31Å; E98-Q123 PolarHBondContact O-N 2.76Å
99	I	96.2	Very high	92.9	Very high	26 Å²	26	78 Å²	78	13%	0.133	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	121.9	175.1	-64	177.4	0	0	0	109.2	P78 V80 F102 V120	P78-I99 HydrophobicContact CB-CD1 4.04Å; P78-I99 HydrophobicContact CG-CB 4.47Å; P78-I99 HydrophobicContact CG-CD1 4.46Å; P78-I99 PolarHBondContact O-N 2.89Å; V80-I99 HydrophobicContact CG2-CD1 3.92Å; V80-I99 HydrophobicContact CG2-CG1 3.93Å; I99-F102 HydrophobicContact CB-CZ 4.36Å; I99-F102 HydrophobicContact CD1-CE1 3.68Å; I99-F102 HydrophobicContact CD1-CZ 3.56Å; I99-F102 HydrophobicContact CG2-CD1 4.29Å; I99-F102 HydrophobicContact CG2-CD2 4.28Å; I99-F102 HydrophobicContact CG2-CE1 3.96Å; I99-F102 HydrophobicContact CG2-CE2 3.93Å; I99-F102 HydrophobicContact CG2-CG 4.46Å; I99-F102 HydrophobicContact CG2-CZ 3.77Å; I99-V120 HydrophobicContact CB-CG1 4.2Å; I99-V120 HydrophobicContact CD1-CG1 3.64Å; I99-V120 HydrophobicContact CG1-CG1 3.63Å; I99-V120 HydrophobicContact CG2-CG1 3.62Å
100	K	94.9	Very high	91.1	Very high	138 Å²	138	74.6 Å²	74.6	60%	0.6	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.7	-44.4	175	-176	169.1	-176.9	172.4	0	112	K121 Q123	K100-K121 HydrophobicContact CB-CB 4.41Å; K100-K121 HydrophobicContact CB-CG 4.14Å; K100-K121 WeakPolarHBondContact CB-O 3.33Å; K100-K121 HydrophobicContact CD-CG 4.28Å; K100-K121 PolarHBondContact N-O 2.82Å; K100-Q123 HydrophobicContact CB-CB 4.48Å; K100-Q123 VanDerWaalsContact CB-OE1 3.28Å; K100-Q123 VanDerWaalsContact CG-OE1 3.29Å
101	K	94.3	Very high	89.1	Confident	126 Å²	126	70.2 Å²	70.2	55%	0.548	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	140.7	-174.3	-173.1	174.8	179.7	-177.2	0	111.9	I103 K121	K101-I103 HydrophobicContact CD-CD1 4.34Å; K101-I103 HydrophobicContact CD-CG1 4.09Å; K101-I103 HydrophobicContact CG-CG1 4.03Å; K101-K121 HydrophobicContact CB-CB 4.33Å; K101-K121 PolarHBondContact N-O 3.15Å; K101-K121 PolarHBondContact O-N 2.91Å
102	F	95.1	Very high	87	Confident	19 Å²	19	71.2 Å²	71.2	8%	0.083	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	133.6	164.5	-63.3	-73.7	0	0	0	110.2	Q69 F72 P78 I99 M118 V120	Q69-F102 HydrophobicContact CG-CB 4.37Å; Q69-F102 HydrophobicContact CG-CD2 4.16Å; Q69-F102 HydrophobicContact CG-CG 4.1Å; F72-F102 HydrophobicContact CE1-CE2 4.01Å; F72-F102 HydrophobicContact CZ-CD2 4.05Å; F72-F102 AromaticContact CZ-CE2 3.92Å; F72-F102 HydrophobicContact CZ-CE2 3.92Å; P78-F102 HydrophobicContact CB-CE2 4.49Å; P78-F102 HydrophobicContact CB-CZ 4.02Å; P78-F102 HydrophobicContact CG-CE2 3.89Å; P78-F102 HydrophobicContact CG-CZ 3.89Å; I99-F102 HydrophobicContact CB-CZ 4.36Å; I99-F102 HydrophobicContact CD1-CE1 3.68Å; I99-F102 HydrophobicContact CD1-CZ 3.56Å; I99-F102 HydrophobicContact CG2-CD1 4.29Å; I99-F102 HydrophobicContact CG2-CD2 4.28Å; I99-F102 HydrophobicContact CG2-CE1 3.96Å; I99-F102 HydrophobicContact CG2-CE2 3.93Å; I99-F102 HydrophobicContact CG2-CG 4.46Å; I99-F102 HydrophobicContact CG2-CZ 3.77Å; F102-M118 HydrophobicContact CB-SD 3.7Å; F102-M118 HydrophobicContact CD1-CE 3.52Å; F102-M118 HydrophobicContact CD1-SD 3.63Å; F102-M118 HydrophobicContact CE1-CE 4.03Å; F102-M118 HydrophobicContact CG-CE 4.46Å; F102-M118 HydrophobicContact CG-SD 4.06Å; F102-V120 HydrophobicContact CD1-CG2 3.95Å; F102-V120 HydrophobicContact CE1-CG1 4.34Å; F102-V120 HydrophobicContact CE1-CG2 4.09Å
103	I	95.9	Very high	85.4	Confident	31 Å²	31	70.5 Å²	70.5	16%	0.159	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	81.7	178.1	-47.8	-176.5	0	0	0	107.6	W61 K101 L119 W253	W61-I103 HydrophobicContact CH2-CD1 3.78Å; W61-I103 HydrophobicContact CZ3-CD1 3.68Å; K101-I103 HydrophobicContact CD-CD1 4.34Å; K101-I103 HydrophobicContact CD-CG1 4.09Å; K101-I103 HydrophobicContact CG-CG1 4.03Å; I103-L119 HydrophobicContact CB-CB 4.25Å; I103-L119 PolarHBondContact N-O 3.4Å; I103-L119 PolarHBondContact O-N 3.05Å; I103-W253 HydrophobicContact CG2-CZ2 4.25Å; I103-W253 WeakPolarHBondContact O-CH2 3.37Å; I103-W253 VanDerWaalsContact O-CZ2 3.27Å; I103-W253 WeakPolarHBondContact O-CZ2 3.48Å
104	P	94.9	Very high	84.2	Confident	48 Å²	48	71.6 Å²	71.6	31%	0.312	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	153.5	173.2	28.4	-34.3	0	0	0	110.4	A66 M118	A66-P104 HydrophobicContact CB-CB 4.04Å; P104-M118 HydrophobicContact CB-CB 4.42Å; P104-M118 HydrophobicContact CB-CG 4.42Å; P104-M118 HydrophobicContact CB-SD 4.46Å
105	F	94.1	Very high	83.7	Confident	25 Å²	25	70.1 Å²	70.1	11%	0.11	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-60.8	136.9	174.2	-169.3	-89	0	0	0	110.3	R107 F108 N115 I117 K249 Y250 W253	F105-R107 PolarHBondContact O-N 3.49Å; F105-F108 PolarHBondContact O-N 3.21Å; F105-N115 HydrophobicContact CB-CB 4.21Å; F105-N115 HydrophobicContact CD1-CB 3.5Å; F105-N115 HydrophobicContact CE1-CB 4.25Å; F105-N115 HydrophobicContact CG-CB 4.13Å; F105-I117 HydrophobicContact CB-CG2 3.61Å; F105-I117 WeakPolarHBondContact CB-O 3.31Å; F105-I117 HydrophobicContact CD2-CG2 4.28Å; F105-I117 HydrophobicContact CG-CG2 4.11Å; F105-I117 PolarHBondContact N-O 3.43Å; F105-K249 VanDerWaalsContact CE1-CE 3.48Å; F105-K249 HydrophobicContact CE2-CG 4.33Å; F105-K249 HydrophobicContact CZ-CD 4.23Å; F105-K249 HydrophobicContact CZ-CG 3.88Å; F105-Y250 HydrophobicContact CD1-CE1 4.12Å; F105-Y250 AromaticContact CD2-CD1 3.54Å; F105-Y250 HydrophobicContact CD2-CD1 3.54Å; F105-Y250 AromaticContact CD2-CE1 3.79Å; F105-Y250 HydrophobicContact CD2-CE1 3.79Å; F105-Y250 HydrophobicContact CE1-CE1 4.18Å; F105-Y250 AromaticContact CE2-CD1 3.56Å; F105-Y250 HydrophobicContact CE2-CD1 3.56Å; F105-Y250 AromaticContact CE2-CE1 3.85Å; F105-Y250 HydrophobicContact CE2-CE1 3.85Å; F105-Y250 HydrophobicContact CG-CD1 4.14Å; F105-Y250 AromaticContact CG-CE1 3.93Å; F105-Y250 HydrophobicContact CG-CE1 3.93Å; F105-Y250 HydrophobicContact CZ-CD1 4.18Å; F105-Y250 HydrophobicContact CZ-CE1 4.06Å; F105-W253 HydrophobicContact CB-CZ2 4.4Å; F105-W253 HydrophobicContact CD2-CB 4.1Å; F105-W253 AromaticContact CD2-CD1 3.97Å; F105-W253 AromaticContact CD2-CD2 3.51Å; F105-W253 HydrophobicContact CD2-CD2 3.51Å; F105-W253 AromaticContact CD2-CE2 3.88Å; F105-W253 AromaticContact CD2-CE3 3.86Å; F105-W253 HydrophobicContact CD2-CE3 3.86Å; F105-W253 AromaticContact CD2-CG 3.6Å; F105-W253 HydrophobicContact CD2-CG 3.6Å; F105-W253 HydrophobicContact CD2-CZ3 4.49Å; F105-W253 HydrophobicContact CE2-CB 3.67Å; F105-W253 HydrophobicContact CE2-CD2 4.04Å; F105-W253 AromaticContact CE2-CG 3.63Å; F105-W253 HydrophobicContact CE2-CG 3.63Å
106	P	88.1	Confident	83.4	Confident	75 Å²	75	68.8 Å²	68.8	49%	0.487	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	140.2	-179.8	-25.4	33.6	0	0	0	112.1	F108	P106-F108 VanDerWaalsContact C-N 3.33Å
107	R	78.5	Confident	83.3	Confident	223 Å²	223	64.2 Å²	64.2	84%	0.842	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	20.7	-179.2	-44.4	175.5	179.8	176.4	-1.6	115	F105 T109	F105-R107 PolarHBondContact O-N 3.49Å; R107-T109 PolarHBondContact O-N 2.99Å
108	F	74.8	Confident	83.2	Confident	54 Å²	54	63.8 Å²	63.8	24%	0.237	32%	0.32	C	S	.	.			trans	-67.3	121.7	157.1	178.7	-109.1	0	0	0	108.8	A66 H67 F105 P106 D116	A66-F108 HydrophobicContact CB-CB 4.45Å; A66-F108 HydrophobicContact CB-CD1 3.66Å; A66-F108 HydrophobicContact CB-CD2 4.01Å; A66-F108 HydrophobicContact CB-CE1 3.8Å; A66-F108 HydrophobicContact CB-CE2 4.15Å; A66-F108 HydrophobicContact CB-CG 3.76Å; A66-F108 HydrophobicContact CB-CZ 4.05Å; H67-F108 HydrophobicContact CB-CZ 4.07Å; F105-F108 PolarHBondContact O-N 3.21Å; P106-F108 VanDerWaalsContact C-N 3.33Å; F108-D116 HydrophobicContact CD2-CB 4.27Å; F108-D116 HydrophobicContact CE2-CB 3.82Å
109	T	63.6	Low	83.2	Confident	98 Å²	98	57.8 Å²	57.8	60%	0.601	29%	0.292	S	S	*	.			trans	-114.9	-32	-174	44.9	0	0	0	0	113.5	R107 Q113	R107-T109 PolarHBondContact O-N 2.99Å; T109-Q113 PolarHBondContact OG1-OE1 3.44Å
110	S	60.6	Low	83.3	Confident	58 Å²	58	56.5 Å²	56.5	41%	0.406	29%	0.286	S	S	.	.	S	Bend	trans	174.1	174.8	169.6	42	0	0	0	0	111.1	Q113	S110-Q113 WeakPolarHBondContact O-CA 3.3Å; S110-Q113 WeakPolarHBondContact O-CB 3.23Å; S110-Q113 PolarHBondContact O-N 2.86Å
111	D	54.4	Low	83.5	Confident	76 Å²	76	51.6 Å²	51.6	41%	0.406	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	136.2	175.4	178.4	29.1	0	0	0	111.1
112	P	53.3	Low	83.6	Confident	57 Å²	57	45.6 Å²	45.6	37%	0.37	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	cis	-90.3	92	-6.8	33.6	-30.4	0	0	0	111.4	P191	P112-P191 HydrophobicContact CB-CB 3.91Å; P112-P191 HydrophobicContact CB-CG 3.92Å; P112-P191 HydrophobicContact CG-CB 3.85Å; P112-P191 HydrophobicContact CG-CG 3.92Å
113	Q	64.4	Low	83.7	Confident	104 Å²	104	49.1 Å²	49.1	49%	0.486	26%	0.255	S	S	.	.	S	Bend	trans	-130	143.7	167.5	-59.3	179.9	-9.2	0	0	110.7	T109 S110	T109-Q113 PolarHBondContact OG1-OE1 3.44Å; S110-Q113 WeakPolarHBondContact O-CA 3.3Å; S110-Q113 WeakPolarHBondContact O-CB 3.23Å; S110-Q113 PolarHBondContact O-N 2.86Å
114	S	74.1	Confident	83.8	Confident	36 Å²	36	51.5 Å²	51.5	25%	0.252	27%	0.271	S	S	.	.	S	Bend	trans	-35.7	150.3	-177.5	-175.6	0	0	0	0	114.8
115	N	88.8	Confident	84	Confident	17 Å²	17	51.8 Å²	51.8	9%	0.091	28%	0.278	C	S	.	.			trans	74.6	30.5	177.7	-39.8	-63.8	0	0	0	115.8	F105 I117 K249 Y250	F105-N115 HydrophobicContact CB-CB 4.21Å; F105-N115 HydrophobicContact CD1-CB 3.5Å; F105-N115 HydrophobicContact CE1-CB 4.25Å; F105-N115 HydrophobicContact CG-CB 4.13Å; N115-I117 PolarHBondContact O-N 3.28Å; N115-K249 WeakPolarHBondContact OD1-CE 3.27Å; N115-K249 PolarHBondContact OD1-NZ 3.47Å; N115-Y250 WeakPolarHBondContact CA-OH 3.42Å; N115-Y250 HydrophobicContact CB-CE1 4.34Å; N115-Y250 PolarHBondContact OD1-OH 3.28Å
116	D	92	Very high	84.2	Confident	2 Å²	2	51 Å²	51	1%	0.011	28%	0.276	C	S	.	.			trans	-73.5	78.2	171	-174.6	25.8	0	0	0	111	A66 H67 F108 I227 S229 T244	A66-D116 WeakPolarHBondContact CA-OD1 3.4Å; A66-D116 WeakPolarHBondContact CB-OD1 3.24Å; A66-D116 PolarHBondContact N-OD1 2.78Å; H67-D116 IonicContact CE1-OD2 2.8Å; H67-D116 IonicContact CG-OD1 3.41Å; H67-D116 IonicContact CG-OD2 2.79Å; H67-D116 PolarHBondContact N-OD1 2.84Å; H67-D116 IonicContact ND1-OD1 2.88Å; H67-D116 PolarHBondContact ND1-OD1 2.69Å; H67-D116 IonicContact ND1-OD2 3.91Å; H67-D116 PolarHBondContact ND1-OD2 3.37Å; F108-D116 HydrophobicContact CD2-CB 4.27Å; F108-D116 HydrophobicContact CE2-CB 3.82Å; D116-I227 WeakPolarHBondContact O-CD1 3.27Å; D116-S229 VanDerWaalsContact CB-OG 3.24Å; D116-S229 WeakPolarHBondContact CB-OG 3.27Å; D116-S229 WeakPolarHBondContact OD2-CA 3.31Å; D116-S229 VanDerWaalsContact OD2-CB 3.31Å; D116-S229 WeakPolarHBondContact OD2-CB 3.49Å; D116-S229 PolarHBondContact OD2-OG 2.81Å; D116-T244 WeakPolarHBondContact O-CB 3.44Å; D116-T244 PolarHBondContact O-OG1 3.17Å
117	I	95.2	Very high	84.7	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.286	C	S	.	.			trans	-154.3	138.6	179.6	-175.3	166.8	0	0	0	109.9	L63 T64 F105 N115 I227 T244 L246 Y250 W253	L63-I117 HydrophobicContact CD1-CD1 3.98Å; L63-I117 HydrophobicContact CD1-CG1 3.83Å; L63-I117 HydrophobicContact CD2-CD1 4.41Å; L63-I117 HydrophobicContact CG-CD1 4.47Å; L63-I117 HydrophobicContact CG-CG1 4.44Å; T64-I117 WeakPolarHBondContact O-CA 3.46Å; F105-I117 HydrophobicContact CB-CG2 3.61Å; F105-I117 WeakPolarHBondContact CB-O 3.31Å; F105-I117 HydrophobicContact CD2-CG2 4.28Å; F105-I117 HydrophobicContact CG-CG2 4.11Å; F105-I117 PolarHBondContact N-O 3.43Å; N115-I117 PolarHBondContact O-N 3.28Å; I117-I227 HydrophobicContact CB-CD1 3.73Å; I117-I227 HydrophobicContact CD1-CD1 4.09Å; I117-I227 HydrophobicContact CG1-CD1 3.59Å; I117-T244 HydrophobicContact CB-CG2 4.05Å; I117-T244 HydrophobicContact CD1-CG2 4.44Å; I117-T244 HydrophobicContact CG2-CG2 4.25Å; I117-L246 HydrophobicContact CD1-CD2 3.53Å; I117-Y250 HydrophobicContact CD1-CD1 4.37Å; I117-Y250 HydrophobicContact CD1-CG 4.11Å; I117-Y250 HydrophobicContact CG2-CD1 3.55Å; I117-Y250 HydrophobicContact CG2-CE1 3.57Å; I117-Y250 HydrophobicContact CG2-CG 4.26Å; I117-W253 HydrophobicContact CD1-CZ3 4.45Å; I117-W253 HydrophobicContact CG1-CZ3 4.14Å
118	M	96.5	Very high	85.6	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	143.1	-174.8	173.9	171.5	71.6	0	0	111.7	T64 A66 Q69 F102 P104 V120	T64-M118 HydrophobicContact CG2-CB 4.2Å; T64-M118 HydrophobicContact CG2-CE 3.57Å; T64-M118 HydrophobicContact CG2-CG 4.45Å; T64-M118 PolarHBondContact N-O 2.96Å; T64-M118 PolarHBondContact O-N 2.98Å; A66-M118 HydrophobicContact CB-CB 4.1Å; Q69-M118 HydrophobicContact CB-CE 4.01Å; Q69-M118 HydrophobicContact CB-SD 3.96Å; F102-M118 HydrophobicContact CB-SD 3.7Å; F102-M118 HydrophobicContact CD1-CE 3.52Å; F102-M118 HydrophobicContact CD1-SD 3.63Å; F102-M118 HydrophobicContact CE1-CE 4.03Å; F102-M118 HydrophobicContact CG-CE 4.46Å; F102-M118 HydrophobicContact CG-SD 4.06Å; P104-M118 HydrophobicContact CB-CB 4.42Å; P104-M118 HydrophobicContact CB-CG 4.42Å; P104-M118 HydrophobicContact CB-SD 4.46Å; M118-V120 HydrophobicContact CE-CG2 4.05Å
119	L	98.2	Very high	86.8	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	136.9	166.4	-75.6	171.1	0	0	0	109.6	I57 W61 L63 I103 W253 N257 L258	I57-L119 HydrophobicContact CD1-CD2 3.59Å; W61-L119 HydrophobicContact CE3-CB 4.03Å; W61-L119 HydrophobicContact CE3-CD1 4.46Å; W61-L119 HydrophobicContact CE3-CD2 4.44Å; W61-L119 HydrophobicContact CZ3-CB 4.08Å; W61-L119 HydrophobicContact CZ3-CD1 4.42Å; L63-L119 HydrophobicContact CD1-CD2 3.77Å; L63-L119 HydrophobicContact CD1-CG 4.3Å; I103-L119 HydrophobicContact CB-CB 4.25Å; I103-L119 PolarHBondContact N-O 3.4Å; I103-L119 PolarHBondContact O-N 3.05Å; L119-W253 HydrophobicContact CB-CH2 4.05Å; L119-W253 HydrophobicContact CD1-CH2 3.88Å; L119-W253 HydrophobicContact CD1-CZ2 4.14Å; L119-W253 HydrophobicContact CD1-CZ3 4.07Å; L119-W253 HydrophobicContact CG-CH2 3.56Å; L119-W253 HydrophobicContact CG-CZ2 4.24Å; L119-W253 HydrophobicContact CG-CZ3 3.82Å; L119-N257 HydrophobicContact CD1-CB 3.48Å; L119-N257 VanDerWaalsContact CD1-CB 3.48Å; L119-L258 HydrophobicContact CD1-CD1 4.15Å; L119-L258 HydrophobicContact CD2-CD1 4.25Å
120	V	98.3	Very high	88.4	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	114.2	173.9	-179.3	0	0	0	0	107.5	W61 V62 T64 V80 I99 F102 M118 L122	W61-V120 WeakPolarHBondContact CA-O 3.42Å; V62-V120 HydrophobicContact CB-CB 4.17Å; V62-V120 PolarHBondContact N-O 2.65Å; V62-V120 PolarHBondContact O-N 2.87Å; T64-V120 HydrophobicContact CG2-CG2 3.68Å; V80-V120 HydrophobicContact CG2-CG1 4.17Å; I99-V120 HydrophobicContact CB-CG1 4.2Å; I99-V120 HydrophobicContact CD1-CG1 3.64Å; I99-V120 HydrophobicContact CG1-CG1 3.63Å; I99-V120 HydrophobicContact CG2-CG1 3.62Å; F102-V120 HydrophobicContact CD1-CG2 3.95Å; F102-V120 HydrophobicContact CE1-CG1 4.34Å; F102-V120 HydrophobicContact CE1-CG2 4.09Å; M118-V120 HydrophobicContact CE-CG2 4.05Å; V120-L122 HydrophobicContact CG1-CD2 4.43Å
121	K	97.8	Very high	90.2	Very high	35 Å²	35	51.1 Å²	51.1	15%	0.152	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	121.9	172.8	-177.2	72.1	-168.3	179.4	0	108.8	Q60 W61 K100 K101	Q60-K121 HydrophobicContact CB-CD 4.31Å; W61-K121 HydrophobicContact CD2-CD 3.76Å; W61-K121 VanDerWaalsContact CE2-CD 3.47Å; W61-K121 HydrophobicContact CE3-CB 4.01Å; W61-K121 HydrophobicContact CE3-CD 3.96Å; W61-K121 HydrophobicContact CH2-CB 4.14Å; W61-K121 HydrophobicContact CH2-CD 3.7Å; W61-K121 HydrophobicContact CH2-CG 4.36Å; W61-K121 HydrophobicContact CZ2-CD 3.47Å; W61-K121 VanDerWaalsContact CZ2-CD 3.47Å; W61-K121 HydrophobicContact CZ3-CB 3.72Å; W61-K121 HydrophobicContact CZ3-CD 3.92Å; W61-K121 HydrophobicContact CZ3-CG 4.37Å; K100-K121 HydrophobicContact CB-CB 4.41Å; K100-K121 HydrophobicContact CB-CG 4.14Å; K100-K121 WeakPolarHBondContact CB-O 3.33Å; K100-K121 HydrophobicContact CD-CG 4.28Å; K100-K121 PolarHBondContact N-O 2.82Å; K101-K121 HydrophobicContact CB-CB 4.33Å; K101-K121 PolarHBondContact N-O 3.15Å; K101-K121 PolarHBondContact O-N 2.91Å
122	L	98.1	Very high	92.4	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	144.5	173.4	-53.1	-179.5	0	0	0	110.4	L56 Q60 V62 V80 L97 V120 T124	L56-L122 HydrophobicContact CD1-CD1 4.22Å; Q60-L122 PolarHBondContact O-N 2.87Å; V62-L122 HydrophobicContact CG2-CD1 4.39Å; V62-L122 HydrophobicContact CG2-CD2 4.34Å; V80-L122 HydrophobicContact CB-CD2 3.79Å; V80-L122 HydrophobicContact CG1-CD2 4.28Å; V80-L122 HydrophobicContact CG2-CD2 3.68Å; L97-L122 HydrophobicContact CB-CD2 4.4Å; L97-L122 HydrophobicContact CD2-CD1 4.13Å; V120-L122 HydrophobicContact CG1-CD2 4.43Å; L122-T124 VanDerWaalsContact C-N 3.31Å; L122-T124 VanDerWaalsContact CB-O 3.31Å; L122-T124 WeakPolarHBondContact CB-O 3.36Å; L122-T124 PolarHBondContact O-N 3.23Å
123	Q	96.8	Very high	94.5	Very high	92 Å²	92	49.9 Å²	49.9	43%	0.43	25%	0.251	S	S	.	.	S	Bend	trans	-61.6	-40.5	177.4	-173.8	65.3	6.8	0	0	111.6	E98 K100	E98-Q123 HydrophobicContact CB-CB 3.99Å; E98-Q123 WeakPolarHBondContact O-CB 3.31Å; E98-Q123 PolarHBondContact O-N 2.76Å; K100-Q123 HydrophobicContact CB-CB 4.48Å; K100-Q123 VanDerWaalsContact CB-OE1 3.28Å; K100-Q123 VanDerWaalsContact CG-OE1 3.29Å
124	T	97.6	Very high	96.1	Very high	82 Å²	82	47.1 Å²	47.1	50%	0.503	24%	0.24	S	C	.	.	S	Bend	trans	-126.8	160.4	177.2	56	0	0	0	0	110.7	L97 L122	L97-T124 WeakPolarHBondContact CD2-O 3.45Å; L122-T124 VanDerWaalsContact C-N 3.31Å; L122-T124 VanDerWaalsContact CB-O 3.31Å; L122-T124 WeakPolarHBondContact CB-O 3.36Å; L122-T124 PolarHBondContact O-N 3.23Å
125	A	98.3	Very high	97.2	Very high	54 Å²	54	46.8 Å²	46.8	45%	0.446	24%	0.235	S	C	.	.			trans	-72.7	135.9	176.7	0	0	0	0	0	111.4	P59 Q60	P59-A125 HydrophobicContact CB-CB 4.21Å; P59-A125 CarbonylContact O-C 3.5Å; P59-A125 WeakPolarHBondContact O-CA 3.13Å; Q60-A125 VanDerWaalsContact CG-CA 3.44Å; Q60-A125 HydrophobicContact CG-CB 3.7Å
126	A	98.6	Very high	97.4	Very high	8 Å²	8	51.6 Å²	51.6	7%	0.066	26%	0.257	C	S	.	.			trans	-64.1	137.7	170.7	0	0	0	0	0	110.6	L56 P59 L82 L97 L128 V132	L56-A126 HydrophobicContact CD1-CB 4.41Å; L56-A126 HydrophobicContact CD2-CB 4.19Å; P59-A126 WeakPolarHBondContact O-CB 3.21Å; P59-A126 PolarHBondContact O-N 3.35Å; L82-A126 HydrophobicContact CD1-CB 3.44Å; L82-A126 VanDerWaalsContact CD1-CB 3.44Å; L97-A126 HydrophobicContact CD2-CB 4.41Å; A126-L128 PolarHBondContact O-N 3.25Å; A126-V132 HydrophobicContact CB-CG1 4.35Å
127	K	98.6	Very high	97.2	Very high	163 Å²	163	53.3 Å²	53.3	71%	0.709	27%	0.267	S	S	*	.			trans	-81.6	99.4	175.5	-61.6	178.4	-177.9	177.3	0	108.8	Q95 N129	Q95-K127 PolarHBondContact NE2-O 2.95Å; K127-N129 PolarHBondContact O-ND2 2.87Å
128	L	98.8	Very high	96.3	Very high	87 Å²	87	60.4 Å²	60.4	46%	0.455	29%	0.294	S	S	.	.			trans	-64.3	136.1	-179.9	-56.3	-174.3	0	0	0	111.2	L56 P59 A126 V132 L134	L56-L128 HydrophobicContact CD2-CD2 3.98Å; P59-L128 HydrophobicContact CG-CD1 4.29Å; A126-L128 PolarHBondContact O-N 3.25Å; L128-V132 CarbonylContact C-O 3.55Å; L128-V132 WeakPolarHBondContact CA-O 3.05Å; L128-V132 HydrophobicContact CD2-CG1 4.34Å; L128-L134 HydrophobicContact CD1-CD1 4.24Å; L128-L134 HydrophobicContact CD1-CD2 4.34Å; L128-L134 HydrophobicContact CD1-CG 4.06Å; L128-L134 HydrophobicContact CD2-CD2 3.78Å; L128-L134 HydrophobicContact CD2-CG 4.22Å
129	N	98.5	Very high	94.5	Very high	63 Å²	63	64.1 Å²	64.1	34%	0.337	32%	0.32	S	S	.	.	S	Bend	trans	-158.8	-166.6	179.1	64.2	53.6	0	0	0	110.9	Q95 K127 H131 V132 K133	Q95-N129 PolarHBondContact NE2-ND2 2.87Å; K127-N129 PolarHBondContact O-ND2 2.87Å; N129-H131 PolarHBondContact O-N 2.92Å; N129-H131 WeakPolarHBondContact OD1-CA 3.2Å; N129-H131 PolarHBondContact OD1-N 2.78Å; N129-V132 PolarHBondContact N-O 3.21Å; N129-V132 CarbonylContact O-C 3.57Å; N129-V132 PolarHBondContact O-N 3.24Å; N129-V132 PolarHBondContact OD1-N 2.84Å; N129-V132 VanDerWaalsContact OD1-N 3.09Å; N129-K133 WeakPolarHBondContact O-CE 3.37Å; N129-K133 VanDerWaalsContact O-CG 3.26Å; N129-K133 WeakPolarHBondContact O-CG 3.22Å
130	K	98.3	Very high	92.8	Very high	155 Å²	155	71.2 Å²	71.2	67%	0.674	35%	0.351	S	S	*	.	S	Bend	trans	-60.7	-27.6	179.4	53.9	166.3	171	160.1	0	114.4
131	H	98.6	Very high	91.1	Very high	42 Å²	42	74.5 Å²	74.5	19%	0.194	37%	0.368	C	S	.	.	S	Bend	trans	-105	-11.6	-177	-53.4	-52.1	0	0	0	113.7	H36 P39 G83 N129	H36-H131 HydrophobicContact CB-CB 4.19Å; H36-H131 VanDerWaalsContact CB-ND1 3.34Å; H36-H131 WeakPolarHBondContact CB-ND1 3.48Å; H36-H131 AromaticContact CD2-ND1 3.98Å; H36-H131 AromaticContact CG-ND1 3.69Å; P39-H131 VanDerWaalsContact CA-O 3.31Å; P39-H131 WeakPolarHBondContact CA-O 3.11Å; P39-H131 WeakPolarHBondContact CB-O 3.31Å; G83-H131 WeakPolarHBondContact CA-O 3.17Å; N129-H131 PolarHBondContact O-N 2.92Å; N129-H131 WeakPolarHBondContact OD1-CA 3.2Å; N129-H131 PolarHBondContact OD1-N 2.78Å
132	V	98.8	Very high	90.1	Very high	0 Å²	0	80.7 Å²	80.7	0%	0	39%	0.392	C	S	.	.	S	Bend	trans	-128.9	106.2	177.8	-178.9	0	0	0	0	109.1	P39 L56 L82 A126 L128 N129	P39-V132 CarbonylContact O-C 3.57Å; P39-V132 WeakPolarHBondContact O-CA 3.5Å; L56-V132 HydrophobicContact CD2-CG1 3.78Å; L82-V132 HydrophobicContact CB-CG1 4.1Å; L82-V132 HydrophobicContact CB-CG2 4.08Å; L82-V132 HydrophobicContact CD1-CG1 3.97Å; A126-V132 HydrophobicContact CB-CG1 4.35Å; L128-V132 CarbonylContact C-O 3.55Å; L128-V132 WeakPolarHBondContact CA-O 3.05Å; L128-V132 HydrophobicContact CD2-CG1 4.34Å; N129-V132 PolarHBondContact N-O 3.21Å; N129-V132 CarbonylContact O-C 3.57Å; N129-V132 PolarHBondContact O-N 3.24Å; N129-V132 PolarHBondContact OD1-N 2.84Å; N129-V132 VanDerWaalsContact OD1-N 3.09Å
133	K	98.6	Very high	89.6	Confident	107 Å²	107	82 Å²	82	47%	0.465	40%	0.398	S	S	.	.			trans	-136.2	157	-177.1	-63.7	-173.2	-178	179.3	0	111.4	P39 F40 N129	P39-K133 HydrophobicContact CB-CB 4.03Å; P39-K133 HydrophobicContact CB-CD 4.41Å; P39-K133 HydrophobicContact CB-CG 4.04Å; P39-K133 HydrophobicContact CG-CB 3.97Å; P39-K133 HydrophobicContact CG-CD 4Å; P39-K133 HydrophobicContact CG-CG 4.09Å; P39-K133 PolarHBondContact O-N 3.48Å; F40-K133 WeakPolarHBondContact CA-O 3.32Å; F40-K133 WeakPolarHBondContact CB-O 3.45Å; N129-K133 WeakPolarHBondContact O-CE 3.37Å; N129-K133 VanDerWaalsContact O-CG 3.26Å; N129-K133 WeakPolarHBondContact O-CG 3.22Å
134	L	98.3	Very high	89.4	Confident	47 Å²	47	85.4 Å²	85.4	25%	0.246	41%	0.407	C	S	.	.			trans	-78.5	146.1	175.2	-48.6	-178.6	0	0	0	110.9	L56 P59 L128	L56-L134 HydrophobicContact CD2-CD2 3.7Å; L56-L134 HydrophobicContact CG-CD2 3.68Å; L56-L134 CarbonylContact O-C 3.52Å; L56-L134 WeakPolarHBondContact O-CA 3.42Å; P59-L134 HydrophobicContact CG-CD1 4.45Å; L128-L134 HydrophobicContact CD1-CD1 4.24Å; L128-L134 HydrophobicContact CD1-CD2 4.34Å; L128-L134 HydrophobicContact CD1-CG 4.06Å; L128-L134 HydrophobicContact CD2-CD2 3.78Å; L128-L134 HydrophobicContact CD2-CG 4.22Å
135	L	96.9	Very high	89.2	Confident	28 Å²	28	84.6 Å²	84.6	15%	0.147	41%	0.405	C	S	.	.			trans	-114.6	117	164.4	-178.5	62.4	0	0	0	109.8	F40 V55 L56 I219 F224	F40-L135 HydrophobicContact CB-CB 3.56Å; F40-L135 HydrophobicContact CD1-CB 4.02Å; F40-L135 HydrophobicContact CD1-CD1 4.34Å; F40-L135 HydrophobicContact CD1-CD2 4.12Å; F40-L135 HydrophobicContact CD1-CG 4.4Å; F40-L135 HydrophobicContact CD2-CB 4.34Å; F40-L135 HydrophobicContact CD2-CD2 3.78Å; F40-L135 HydrophobicContact CE1-CD2 4.26Å; F40-L135 HydrophobicContact CE2-CD2 3.95Å; F40-L135 HydrophobicContact CG-CB 3.71Å; F40-L135 HydrophobicContact CG-CD2 3.88Å; F40-L135 HydrophobicContact CG-CG 4.31Å; F40-L135 HydrophobicContact CZ-CD2 4.18Å; V55-L135 HydrophobicContact CG1-CB 3.66Å; V55-L135 HydrophobicContact CG1-CD2 3.87Å; V55-L135 HydrophobicContact CG1-CG 4.21Å; L56-L135 PolarHBondContact O-N 2.98Å; L135-I219 HydrophobicContact CD2-CD1 3.87Å; L135-I219 HydrophobicContact CD2-CG1 4.47Å; L135-F224 HydrophobicContact CD1-CB 4.41Å; L135-F224 HydrophobicContact CD2-CB 3.79Å; L135-F224 HydrophobicContact CD2-CD1 3.93Å; L135-F224 HydrophobicContact CD2-CD2 4.38Å; L135-F224 HydrophobicContact CD2-CG 3.8Å; L135-F224 HydrophobicContact CG-CB 3.94Å; L135-F224 HydrophobicContact CG-CD1 4.01Å; L135-F224 HydrophobicContact CG-CG 4.19Å
136	H	92.4	Very high	89	Confident	119 Å²	119	84.6 Å²	84.6	55%	0.551	41%	0.411	S	S	*	.			trans	-75	132.7	-176.3	-60	115.4	0	0	0	112.3	R138	H136-R138 HydrophobicContact CB-CG 4.48Å; H136-R138 PolarHBondContact O-N 3.38Å
137	V	88.1	Confident	88.8	Confident	38 Å²	38	85.2 Å²	85.2	23%	0.23	41%	0.414	C	S	.	.			trans	-72.1	109.1	166.4	-176.9	0	0	0	0	108.3	I57 L63 F224 L246 Q251 I254	I57-V137 HydrophobicContact CG2-CG2 4.04Å; L63-V137 HydrophobicContact CD2-CG2 4.19Å; V137-F224 HydrophobicContact CG2-CD1 4.11Å; V137-F224 HydrophobicContact CG2-CE1 4.06Å; V137-L246 HydrophobicContact CG1-CB 4.11Å; V137-L246 HydrophobicContact CG1-CD1 3.91Å; V137-L246 HydrophobicContact CG2-CD1 4.23Å; V137-Q251 HydrophobicContact CG1-CG 3.84Å; V137-I254 HydrophobicContact CG1-CD1 4.39Å; V137-I254 HydrophobicContact CG2-CD1 4.17Å
138	R	77.1	Confident	88.6	Confident	148 Å²	148	84.9 Å²	84.9	56%	0.558	41%	0.412	S	S	*	.			trans	-99.8	146.4	-176.2	-73.1	-175.3	171.2	179.6	-2.9	112.2	H136 K140 V223 Q251	H136-R138 HydrophobicContact CB-CG 4.48Å; H136-R138 PolarHBondContact O-N 3.38Å; R138-K140 VanDerWaalsContact C-N 3.25Å; R138-K140 PolarHBondContact O-N 2.84Å; R138-K140 VanDerWaalsContact O-N 3.12Å; R138-V223 HydrophobicContact CB-CG1 4.22Å; R138-Q251 PolarHBondContact O-NE2 2.8Å
139	S	58.6	Low	88.4	Confident	79 Å²	79	80.8 Å²	80.8	55%	0.552	39%	0.391	S	S	*	.			trans	-79.3	11.7	-171.4	84.4	0	0	0	0	116.5	N141	S139-N141 VanDerWaalsContact C-N 3.26Å; S139-N141 PolarHBondContact O-N 3.01Å; S139-N141 PolarHBondContact O-ND2 2.89Å; S139-N141 PolarHBondContact O-OD1 2.83Å
140	K	62.3	Low	88.2	Confident	149 Å²	149	81.1 Å²	81.1	65%	0.648	39%	0.39	S	S	*	.			trans	-73.7	86.6	-179.9	-70.4	-167.6	179.8	-176.4	0	109.4	R138 Y142 H225	R138-K140 VanDerWaalsContact C-N 3.25Å; R138-K140 PolarHBondContact O-N 2.84Å; R138-K140 VanDerWaalsContact O-N 3.12Å; K140-Y142 PolarHBondContact O-N 2.81Å; K140-H225 PolarHBondContact O-CE1 2.85Å
141	N	62.1	Low	87.9	Confident	69 Å²	69	73.9 Å²	73.9	37%	0.369	36%	0.359	S	S	.	.			trans	-70.5	12.2	-171.8	-63	-49.2	0	0	0	114.8	S139 K248 Q251	S139-N141 VanDerWaalsContact C-N 3.26Å; S139-N141 PolarHBondContact O-N 3.01Å; S139-N141 PolarHBondContact O-ND2 2.89Å; S139-N141 PolarHBondContact O-OD1 2.83Å; N141-K248 VanDerWaalsContact ND2-CE 3.32Å; N141-K248 WeakPolarHBondContact ND2-CE 3.3Å; N141-K248 WeakPolarHBondContact ND2-CG 3.35Å; N141-Q251 PolarHBondContact OD1-NE2 2.81Å
142	Y	76.1	Confident	87.7	Confident	165 Å²	165	71.9 Å²	71.9	65%	0.647	35%	0.35	S	S	*	.			trans	-126.7	104.3	-175.3	-162.7	-120.2	0	0	0	111.9	K140 R144	K140-Y142 PolarHBondContact O-N 2.81Å; Y142-R144 HydrophobicContact CD1-CG 3.69Å; Y142-R144 HydrophobicContact CE1-CB 4.47Å; Y142-R144 HydrophobicContact CE1-CG 3.12Å
143	L	89.1	Confident	87.5	Confident	26 Å²	26	71.9 Å²	71.9	14%	0.136	35%	0.35	C	S	.	.			trans	-107.1	112	169.8	-176.9	56.4	0	0	0	108.2	T147 V175 V198 L218 C220 H225 L245	L143-T147 HydrophobicContact CD1-CG2 3.94Å; L143-V175 HydrophobicContact CD1-CG2 3.98Å; L143-V175 HydrophobicContact CD2-CG1 4.48Å; L143-V175 HydrophobicContact CD2-CG2 3.78Å; L143-V175 HydrophobicContact CG-CG1 4.27Å; L143-V175 HydrophobicContact CG-CG2 3.83Å; L143-V198 HydrophobicContact CD2-CG1 4.46Å; L143-V198 HydrophobicContact CD2-CG2 4.2Å; L143-L218 HydrophobicContact CD2-CD2 4.22Å; L143-C220 HydrophobicContact CD1-CB 3.85Å; L143-C220 VanDerWaalsContact CD1-SG 3.51Å; L143-H225 HydrophobicContact CD2-CB 4.1Å; L143-L245 HydrophobicContact CB-CD1 4.4Å; L143-L245 HydrophobicContact CD2-CD1 4.23Å
144	R	92.1	Very high	87.3	Confident	164 Å²	164	66.8 Å²	66.8	62%	0.619	33%	0.328	S	S	*	.			trans	-79.8	142.5	-179.2	-69.1	-178.9	-171.2	-143.3	-11.5	110.5	Y142 T147	Y142-R144 HydrophobicContact CD1-CG 3.69Å; Y142-R144 HydrophobicContact CE1-CB 4.47Å; Y142-R144 HydrophobicContact CE1-CG 3.12Å; R144-T147 WeakPolarHBondContact O-CB 3.39Å; R144-T147 PolarHBondContact O-N 3.03Å; R144-T147 PolarHBondContact O-OG1 3.47Å
145	S	93.9	Very high	86.7	Confident	66 Å²	66	64.7 Å²	64.7	46%	0.462	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	147.3	164	-53.4	0	0	0	0	111	T147 V175 L176 S177	S145-T147 PolarHBondContact O-N 2.77Å; S145-V175 CarbonylContact C-O 3.42Å; S145-V175 WeakPolarHBondContact CA-O 3.38Å; S145-L176 PolarHBondContact OG-O 2.03Å; S145-S177 WeakPolarHBondContact OG-CA 3.1Å; S145-S177 WeakPolarHBondContact OG-CB 3.2Å; S145-S177 PolarHBondContact OG-N 2.82Å
146	G	93.9	Very high	85.9	Confident	54 Å²	54	63.4 Å²	63.4	56%	0.557	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.2	-6.2	-171.8	0	0	0	0	0	114.3	K148 V175	G146-K148 PolarHBondContact O-N 3.22Å; G146-V175 PolarHBondContact N-O 3.49Å
147	T	94.5	Very high	85.2	Confident	21 Å²	21	59.6 Å²	59.6	13%	0.129	30%	0.296	C	S	.	.			trans	-69.1	130	175.5	-56.7	0	0	0	0	109.9	L143 R144 S145 V175 C220	L143-T147 HydrophobicContact CD1-CG2 3.94Å; R144-T147 WeakPolarHBondContact O-CB 3.39Å; R144-T147 PolarHBondContact O-N 3.03Å; R144-T147 PolarHBondContact O-OG1 3.47Å; S145-T147 PolarHBondContact O-N 2.77Å; T147-V175 WeakPolarHBondContact O-CG2 3.27Å; T147-V175 PolarHBondContact O-N 3.48Å; T147-C220 HydrophobicContact CG2-CB 3.95Å
148	K	94.1	Very high	84.5	Confident	155 Å²	155	60.5 Å²	60.5	67%	0.674	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	134.3	168.8	-65.4	-173	178.6	-174.8	0	110.2	G146 T172 V173	G146-K148 PolarHBondContact O-N 3.22Å; K148-T172 HydrophobicContact CB-CG2 4.28Å; K148-T172 HydrophobicContact CD-CG2 4.4Å; K148-V173 WeakPolarHBondContact CA-O 3.06Å
149	C	93.7	Very high	84.1	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.014	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	158.1	179.8	-55.1	0	0	0	0	109.9	T172 V173 V175 L218 I219 C220	C149-T172 CarbonylContact O-C 3.37Å; C149-T172 WeakPolarHBondContact O-CA 3.05Å; C149-V173 HydrophobicContact CB-CG2 4.16Å; C149-V173 PolarHBondContact N-O 2.93Å; C149-V173 PolarHBondContact O-N 2.87Å; C149-V175 VanDerWaalsContact SG-CG2 3.55Å; C149-L218 HydrophobicContact CB-CD1 3.51Å; C149-L218 HydrophobicContact CB-CG 3.97Å; C149-I219 CarbonylContact C-O 3.55Å; C149-I219 VanDerWaalsContact CA-O 3.27Å; C149-I219 WeakPolarHBondContact CA-O 3.34Å; C149-I219 WeakPolarHBondContact CB-O 3.43Å; C149-C220 HydrophobicContact CB-CB 3.99Å; C149-C220 WeakPolarHBondContact CB-SG 3.46Å; C149-C220 WeakPolarHBondContact SG-CB 3.42Å; C149-C220 CovalentContact SG-SG 2.03Å; C149-C220 PolarHBondContact SG-SG 3.27Å
150	E	94.1	Very high	84.7	Confident	70 Å²	70	58.5 Å²	58.5	33%	0.327	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	131.1	174.3	-66.6	170.6	180	0	0	108.3	R38 V171 I219	R38-E150 IonicContact NH2-OE2 3.66Å; E150-V171 WeakPolarHBondContact CA-O 3.4Å; E150-I219 PolarHBondContact N-O 3.39Å; E150-I219 PolarHBondContact O-N 2.81Å
151	V	93.5	Very high	85.1	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.012	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	135.2	165.4	-177.3	0	0	0	0	107	E170 V171 V173 P217 L218 V228 Y243	V151-E170 CarbonylContact O-C 3.51Å; V151-E170 WeakPolarHBondContact O-CA 3.44Å; V151-V171 HydrophobicContact CB-CG1 3.87Å; V151-V171 PolarHBondContact N-O 3.35Å; V151-V171 PolarHBondContact O-N 3.45Å; V151-V173 HydrophobicContact CG2-CG1 4.33Å; V151-V173 HydrophobicContact CG2-CG2 3.8Å; V151-P217 WeakPolarHBondContact CA-O 3.46Å; V151-L218 HydrophobicContact CG2-CD1 3.51Å; V151-V228 HydrophobicContact CG1-CG2 3.66Å; V151-Y243 HydrophobicContact CG1-CE1 4.48Å; V151-Y243 HydrophobicContact CG2-CE1 3.62Å; V151-Y243 WeakPolarHBondContact CG2-OH 3.32Å
152	T	94.1	Very high	85.5	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	132.8	-179	-50.2	0	0	0	0	109.8	R38 M41 L168 R169	R38-T152 HydrophobicContact CB-CG2 4.2Å; R38-T152 HydrophobicContact CG-CG2 3.77Å; M41-T152 WeakPolarHBondContact CE-O 3.32Å; M41-T152 HydrophobicContact CG-CG2 4.07Å; M41-T152 HydrophobicContact SD-CG2 4.1Å; T152-L168 HydrophobicContact CG2-CD1 3.9Å; T152-L168 HydrophobicContact CG2-CD2 3.96Å; T152-L168 HydrophobicContact CG2-CG 3.9Å; T152-R169 WeakPolarHBondContact CA-O 3.44Å; T152-R169 WeakPolarHBondContact CG2-O 3.06Å
153	G	94.7	Very high	85.8	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.01	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.7	-179.4	-178.5	0	0	0	0	0	113.5	L168 R169 D213	G153-L168 WeakPolarHBondContact O-CD1 3.35Å; G153-R169 PolarHBondContact N-O 3.44Å; G153-R169 VanDerWaalsContact N-O 3.08Å; G153-R169 PolarHBondContact O-N 3.12Å; G153-D213 VanDerWaalsContact CA-OD1 3.31Å; G153-D213 WeakPolarHBondContact CA-OD1 3.39Å
154	W	94.3	Very high	85.6	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.316	C	S	.	.			trans	-105.3	22.9	173.1	-69.2	-88.6	0	0	0	110.7	M41 H50 A84 H85 L87 P164 S165 L168	M41-W154 HydrophobicContact CB-CH2 3.94Å; M41-W154 HydrophobicContact CB-CZ3 4.15Å; M41-W154 HydrophobicContact CE-CE3 4.36Å; M41-W154 HydrophobicContact CE-CZ3 3.88Å; H50-W154 AromaticContact CE1-CE3 3.79Å; A84-W154 HydrophobicContact CB-CZ2 4.15Å; H85-W154 PolarHBondContact O-NE1 2.62Å; L87-W154 HydrophobicContact CD1-CB 3.95Å; L87-W154 HydrophobicContact CD1-CG 4Å; L87-W154 HydrophobicContact CD2-CD2 3.98Å; L87-W154 HydrophobicContact CD2-CG 3.95Å; L87-W154 HydrophobicContact CG-CB 4.42Å; L87-W154 HydrophobicContact CG-CD2 4.44Å; L87-W154 HydrophobicContact CG-CG 3.93Å; W154-P164 CarbonylContact O-C 3.59Å; W154-P164 WeakPolarHBondContact O-CA 3.45Å; W154-P164 WeakPolarHBondContact O-CB 3.27Å; W154-S165 PolarHBondContact O-N 3.42Å; W154-L168 HydrophobicContact CD2-CD1 3.58Å; W154-L168 HydrophobicContact CE3-CD1 3.68Å; W154-L168 HydrophobicContact CG-CD1 4.28Å; W154-L168 HydrophobicContact CH2-CD1 3.75Å; W154-L168 HydrophobicContact CZ2-CB 4.03Å; W154-L168 HydrophobicContact CZ2-CD1 3.64Å; W154-L168 HydrophobicContact CZ2-CD2 4.42Å; W154-L168 HydrophobicContact CZ2-CG 4.25Å; W154-L168 HydrophobicContact CZ3-CD1 3.76Å
155	G	85.8	Confident	85.6	Confident	3 Å²	3	55.4 Å²	55.4	3%	0.031	29%	0.292	C	S	.	.			trans	-56.1	158.4	179.7	0	0	0	0	0	113.2	S165 K211 D213	G155-S165 WeakPolarHBondContact O-CB 3.38Å; G155-S165 PolarHBondContact O-N 2.81Å; G155-K211 CarbonylContact C-O 3.26Å; G155-K211 WeakPolarHBondContact CA-O 3.42Å; G155-D213 VanDerWaalsContact CA-CG 3.48Å; G155-D213 VanDerWaalsContact CA-OD1 3.24Å; G155-D213 WeakPolarHBondContact CA-OD1 3.46Å; G155-D213 PolarHBondContact N-OD1 3.28Å
156	A	80.5	Confident	85.6	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.283	C	S	.	.			trans	-57.1	138.9	173.3	0	0	0	0	0	110.2	R163 C210 K211	A156-R163 VanDerWaalsContact CA-O 3.3Å; A156-R163 WeakPolarHBondContact CA-O 3.38Å; A156-R163 WeakPolarHBondContact CB-O 3.44Å; A156-C210 HydrophobicContact CB-CB 4.45Å; A156-C210 WeakPolarHBondContact O-CB 3.45Å; A156-K211 PolarHBondContact N-O 2.82Å
157	T	77.1	Confident	85.7	Confident	39 Å²	39	53.3 Å²	53.3	24%	0.239	26%	0.263	C	S	.	.	S	Bend	trans	-97.1	-9.2	176.6	50.5	0	0	0	0	112.3	I27 I28	I27-T157 WeakPolarHBondContact CG2-O 3.36Å; I28-T157 CarbonylContact C-O 3.53Å; I28-T157 CarbonylContact O-C 3.57Å; I28-T157 VanDerWaalsContact O-C 3.32Å; I28-T157 WeakPolarHBondContact O-CA 3.47Å; I28-T157 WeakPolarHBondContact O-CB 3.29Å
158	D	72.5	Confident	85.8	Confident	57 Å²	57	52.3 Å²	52.3	31%	0.305	26%	0.257	S	S	.	.			trans	-123.4	119.7	-179	-170	-40.1	0	0	0	108	D160 F161	D158-D160 PolarHBondContact O-N 2.87Å; D158-D160 WeakPolarHBondContact OD1-CA 3.47Å; D158-D160 WeakPolarHBondContact OD1-CB 3.19Å; D158-D160 PolarHBondContact OD1-N 2.81Å; D158-F161 HydrophobicContact CB-CB 3.98Å; D158-F161 CarbonylContact O-C 3.54Å; D158-F161 PolarHBondContact O-N 3.39Å; D158-F161 VanDerWaalsContact O-O 3.04Å; D158-F161 PolarHBondContact OD1-N 2.79Å; D158-F161 VanDerWaalsContact OD1-N 3.15Å; D158-F161 WeakPolarHBondContact OD2-CD2 3.27Å
159	P	69.6	Low	85.9	Confident	47 Å²	47	47.5 Å²	47.5	31%	0.305	24%	0.235	S	C	.	.	S	Bend	trans	-65.8	-26	179.5	29.2	-35.5	0	0	0	112.3	I28 L162	I28-P159 HydrophobicContact CD1-CB 4.47Å; I28-P159 HydrophobicContact CD1-CG 3.72Å; P159-L162 WeakPolarHBondContact O-CD2 3.26Å
160	D	70.3	Confident	85.8	Confident	139 Å²	139	48 Å²	48	74%	0.743	24%	0.237	S	C	*	.	S	Bend	trans	-83.7	-28.7	177.8	-58.8	-38.1	0	0	0	111	D158	D158-D160 PolarHBondContact O-N 2.87Å; D158-D160 WeakPolarHBondContact OD1-CA 3.47Å; D158-D160 WeakPolarHBondContact OD1-CB 3.19Å; D158-D160 PolarHBondContact OD1-N 2.81Å
161	F	70.6	Confident	85.6	Confident	147 Å²	147	45.1 Å²	45.1	65%	0.645	22%	0.224	S	C	*	.	S	Bend	trans	-114.7	85	176.5	-63.2	-86.5	0	0	0	111.8	D158 R163	D158-F161 HydrophobicContact CB-CB 3.98Å; D158-F161 CarbonylContact O-C 3.54Å; D158-F161 PolarHBondContact O-N 3.39Å; D158-F161 VanDerWaalsContact O-O 3.04Å; D158-F161 PolarHBondContact OD1-N 2.79Å; D158-F161 VanDerWaalsContact OD1-N 3.15Å; D158-F161 WeakPolarHBondContact OD2-CD2 3.27Å; F161-R163 PolarHBondContact O-N 2.9Å
162	L	71.5	Confident	85.5	Confident	84 Å²	84	47.9 Å²	47.9	44%	0.44	24%	0.241	S	C	.	.			trans	-70.3	33.2	-177.4	-61.2	178.4	0	0	0	115.4	P159 K211	P159-L162 WeakPolarHBondContact O-CD2 3.26Å; L162-K211 HydrophobicContact CB-CD 3.7Å; L162-K211 HydrophobicContact CD1-CD 4.23Å; L162-K211 HydrophobicContact CD2-CB 4.17Å; L162-K211 HydrophobicContact CG-CD 4.4Å
163	R	81.4	Confident	85.4	Confident	211 Å²	211	47.9 Å²	47.9	80%	0.796	24%	0.241	S	C	*	.	P	Polyproline II helix	trans	-85.9	132	170.4	-74.8	-172.4	173.2	180	-0.6	109.5	A156 F161	A156-R163 VanDerWaalsContact CA-O 3.3Å; A156-R163 WeakPolarHBondContact CA-O 3.38Å; A156-R163 WeakPolarHBondContact CB-O 3.44Å; F161-R163 PolarHBondContact O-N 2.9Å
164	P	86	Confident	85.3	Confident	50 Å²	50	50.2 Å²	50.2	33%	0.325	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-51.7	143.3	171.5	-28.4	36.6	0	0	0	112	L87 W154	L87-P164 HydrophobicContact CD1-CB 4.14Å; W154-P164 CarbonylContact O-C 3.59Å; W154-P164 WeakPolarHBondContact O-CA 3.45Å; W154-P164 WeakPolarHBondContact O-CB 3.27Å
165	S	92	Very high	85.3	Confident	16 Å²	16	50.4 Å²	50.4	11%	0.112	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-60.8	137.2	167.7	176.3	0	0	0	0	109.9	L87 W154 G155 T167 R169	L87-S165 WeakPolarHBondContact CD1-O 3.34Å; W154-S165 PolarHBondContact O-N 3.42Å; G155-S165 WeakPolarHBondContact O-CB 3.38Å; G155-S165 PolarHBondContact O-N 2.81Å; S165-T167 WeakPolarHBondContact CB-O 3.41Å; S165-T167 PolarHBondContact OG-N 2.03Å; S165-T167 PolarHBondContact OG-O 2.69Å; S165-R169 WeakPolarHBondContact OG-CD 3.19Å
166	D	94.4	Very high	85.7	Confident	54 Å²	54	51.2 Å²	51.2	29%	0.289	26%	0.26	S	S	.	.	S	Bend	trans	-66.1	-43.4	174.8	-179.2	65.2	0	0	0	111.2	S86 L87 S88	S86-D166 CarbonylContact C-O 3.58Å; S86-D166 VanDerWaalsContact CA-O 3.23Å; S86-D166 WeakPolarHBondContact CA-O 3.47Å; S86-D166 WeakPolarHBondContact CB-OD2 3.4Å; S86-D166 VanDerWaalsContact OG-CG 3.26Å; S86-D166 PolarHBondContact OG-OD1 2.94Å; S86-D166 PolarHBondContact OG-OD2 2.94Å; L87-D166 PolarHBondContact N-O 3.33Å; L87-D166 PolarHBondContact N-OD1 3.27Å; S88-D166 WeakPolarHBondContact CB-OD1 3.39Å; S88-D166 PolarHBondContact N-OD1 3.18Å; S88-D166 VanDerWaalsContact OG-CG 3.26Å; S88-D166 PolarHBondContact OG-OD1 2.76Å; S88-D166 PolarHBondContact OG-OD2 2.03Å
167	T	96.2	Very high	86.4	Confident	21 Å²	21	53.1 Å²	53.1	13%	0.129	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-94.3	149	179.8	55	0	0	0	0	111.6	E32 H85 S165 R169	E32-T167 VanDerWaalsContact CD-OG1 3.26Å; E32-T167 PolarHBondContact OE2-OG1 3.06Å; H85-T167 WeakPolarHBondContact O-CA 3.49Å; S165-T167 WeakPolarHBondContact CB-O 3.41Å; S165-T167 PolarHBondContact OG-N 2.03Å; S165-T167 PolarHBondContact OG-O 2.69Å; T167-R169 WeakPolarHBondContact O-CG 3.4Å
168	L	96.1	Very high	87.2	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.005	28%	0.282	C	S	.	.			trans	-66.1	134.9	177.8	-172.9	69	0	0	0	110.5	V33 R38 M41 H85 T152 G153 W154	V33-L168 HydrophobicContact CG2-CB 3.91Å; V33-L168 HydrophobicContact CG2-CD2 3.76Å; V33-L168 HydrophobicContact CG2-CG 3.82Å; V33-L168 WeakPolarHBondContact CG2-O 3.48Å; V33-L168 PolarHBondContact N-O 3.3Å; V33-L168 VanDerWaalsContact N-O 3.08Å; R38-L168 HydrophobicContact CB-CD2 3.79Å; R38-L168 HydrophobicContact CG-CD2 4.17Å; M41-L168 HydrophobicContact CB-CD2 4.35Å; M41-L168 HydrophobicContact CE-CD1 4.17Å; M41-L168 HydrophobicContact CG-CD1 4.26Å; M41-L168 HydrophobicContact CG-CD2 3.98Å; H85-L168 PolarHBondContact O-N 3.1Å; T152-L168 HydrophobicContact CG2-CD1 3.9Å; T152-L168 HydrophobicContact CG2-CD2 3.96Å; T152-L168 HydrophobicContact CG2-CG 3.9Å; G153-L168 WeakPolarHBondContact O-CD1 3.35Å; W154-L168 HydrophobicContact CD2-CD1 3.58Å; W154-L168 HydrophobicContact CE3-CD1 3.68Å; W154-L168 HydrophobicContact CG-CD1 4.28Å; W154-L168 HydrophobicContact CH2-CD1 3.75Å; W154-L168 HydrophobicContact CZ2-CB 4.03Å; W154-L168 HydrophobicContact CZ2-CD1 3.64Å; W154-L168 HydrophobicContact CZ2-CD2 4.42Å; W154-L168 HydrophobicContact CZ2-CG 4.25Å; W154-L168 HydrophobicContact CZ3-CD1 3.76Å
169	R	94.7	Very high	88.4	Confident	53 Å²	53	62.9 Å²	62.9	20%	0.2	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	162.6	-177.3	-48.4	-168.4	73.9	82.3	-5.3	111.9	G29 G30 K31 T152 G153 S165 T167	G29-R169 WeakPolarHBondContact O-CB 3.41Å; G29-R169 WeakPolarHBondContact O-CD 3.42Å; G29-R169 PolarHBondContact O-NE 2.66Å; G30-R169 VanDerWaalsContact O-CZ 3.31Å; G30-R169 PolarHBondContact O-NE 3.05Å; G30-R169 PolarHBondContact O-NH2 3.24Å; K31-R169 CarbonylContact O-C 3.59Å; K31-R169 VanDerWaalsContact O-CA 3.29Å; K31-R169 WeakPolarHBondContact O-CA 3.39Å; T152-R169 WeakPolarHBondContact CA-O 3.44Å; T152-R169 WeakPolarHBondContact CG2-O 3.06Å; G153-R169 PolarHBondContact N-O 3.44Å; G153-R169 VanDerWaalsContact N-O 3.08Å; G153-R169 PolarHBondContact O-N 3.12Å; S165-R169 WeakPolarHBondContact OG-CD 3.19Å; T167-R169 WeakPolarHBondContact O-CG 3.4Å
170	E	92.6	Very high	89.6	Confident	14 Å²	14	63.6 Å²	63.6	7%	0.065	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	141.4	168.9	73.8	-176.4	-166.7	0	0	112.5	G30 K31 V33 R38 V151	G30-E170 CarbonylContact C-O 3.52Å; G30-E170 VanDerWaalsContact CA-O 3.3Å; G30-E170 WeakPolarHBondContact CA-O 3.45Å; K31-E170 WeakPolarHBondContact CE-OE1 3.42Å; K31-E170 HydrophobicContact CG-CG 3.96Å; K31-E170 PolarHBondContact N-O 3.33Å; K31-E170 IonicContact NZ-OE1 3.93Å; K31-E170 PolarHBondContact NZ-OE1 2.67Å; K31-E170 PolarHBondContact O-N 3.09Å; V33-E170 HydrophobicContact CG1-CB 3.61Å; V33-E170 HydrophobicContact CG1-CG 3.56Å; V33-E170 WeakPolarHBondContact CG1-OE2 3.07Å; R38-E170 IonicContact CZ-OE2 3.95Å; R38-E170 IonicContact NE-OE2 3.57Å; R38-E170 PolarHBondContact NE-OE2 3.21Å; R38-E170 IonicContact NH2-OE1 3.66Å; R38-E170 IonicContact NH2-OE2 3.37Å; R38-E170 PolarHBondContact NH2-OE2 3.14Å; V151-E170 CarbonylContact O-C 3.51Å; V151-E170 WeakPolarHBondContact O-CA 3.44Å
171	V	89.9	Confident	90.6	Very high	9 Å²	9	57 Å²	57	6%	0.055	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	139.3	173.6	63	0	0	0	0	110.1	E150 V151 V173 K207	E150-V171 WeakPolarHBondContact CA-O 3.4Å; V151-V171 HydrophobicContact CB-CG1 3.87Å; V151-V171 PolarHBondContact N-O 3.35Å; V151-V171 PolarHBondContact O-N 3.45Å; V171-V173 HydrophobicContact CG1-CG1 4.25Å; V171-K207 HydrophobicContact CG2-CB 3.91Å; V171-K207 HydrophobicContact CG2-CG 4.43Å
172	T	91.7	Very high	91.8	Very high	59 Å²	59	51 Å²	51	36%	0.362	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	119.4	172.6	-60.3	0	0	0	0	110	K148 C149 K207	K148-T172 HydrophobicContact CB-CG2 4.28Å; K148-T172 HydrophobicContact CD-CG2 4.4Å; C149-T172 CarbonylContact O-C 3.37Å; C149-T172 WeakPolarHBondContact O-CA 3.05Å; T172-K207 WeakPolarHBondContact O-CD 3.15Å
173	V	91.4	Very high	93	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	156.9	176.7	-62.7	0	0	0	0	110.7	K148 C149 V151 V171 A200 L218	K148-V173 WeakPolarHBondContact CA-O 3.06Å; C149-V173 HydrophobicContact CB-CG2 4.16Å; C149-V173 PolarHBondContact N-O 2.93Å; C149-V173 PolarHBondContact O-N 2.87Å; V151-V173 HydrophobicContact CG2-CG1 4.33Å; V151-V173 HydrophobicContact CG2-CG2 3.8Å; V171-V173 HydrophobicContact CG1-CG1 4.25Å; V173-A200 HydrophobicContact CB-CB 4.1Å; V173-A200 HydrophobicContact CG2-CB 3.7Å; V173-L218 HydrophobicContact CG2-CD1 3.66Å
174	T	93.6	Very high	93.6	Very high	50 Å²	50	45.3 Å²	45.3	31%	0.307	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	135.7	174.2	-57.6	0	0	0	0	109.3	L176 A200 G201	T174-L176 WeakPolarHBondContact O-CD1 3.05Å; T174-L176 PolarHBondContact O-N 2.78Å; T174-A200 CarbonylContact O-C 3.56Å; T174-A200 WeakPolarHBondContact O-CA 3.1Å; T174-A200 WeakPolarHBondContact O-CB 3.4Å; T174-G201 PolarHBondContact N-O 3.11Å; T174-G201 VanDerWaalsContact N-O 3.12Å; T174-G201 PolarHBondContact O-N 3.36Å
175	V	94.4	Very high	93.9	Very high	4 Å²	4	45.8 Å²	45.8	2%	0.024	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	127.5	175.6	177	0	0	0	0	110.2	L143 S145 G146 T147 C149 V198 A200	L143-V175 HydrophobicContact CD1-CG2 3.98Å; L143-V175 HydrophobicContact CD2-CG1 4.48Å; L143-V175 HydrophobicContact CD2-CG2 3.78Å; L143-V175 HydrophobicContact CG-CG1 4.27Å; L143-V175 HydrophobicContact CG-CG2 3.83Å; S145-V175 CarbonylContact C-O 3.42Å; S145-V175 WeakPolarHBondContact CA-O 3.38Å; G146-V175 PolarHBondContact N-O 3.49Å; T147-V175 WeakPolarHBondContact O-CG2 3.27Å; T147-V175 PolarHBondContact O-N 3.48Å; C149-V175 VanDerWaalsContact SG-CG2 3.55Å; V175-V198 HydrophobicContact CG1-CG2 3.6Å; V175-A200 HydrophobicContact CG2-CB 4.46Å
176	L	93.9	Very high	93.9	Very high	20 Å²	20	46.4 Å²	46.4	11%	0.105	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-93.7	160.7	175.2	-79.7	70.4	0	0	0	110.9	S145 T174 L180 C181 Y186 C199 P240	S145-L176 PolarHBondContact OG-O 2.03Å; T174-L176 WeakPolarHBondContact O-CD1 3.05Å; T174-L176 PolarHBondContact O-N 2.78Å; L176-L180 HydrophobicContact CB-CD2 4.46Å; L176-L180 HydrophobicContact CD2-CD2 3.88Å; L176-L180 HydrophobicContact CD2-CG 4.45Å; L176-L180 HydrophobicContact CG-CD2 4.15Å; L176-C181 VanDerWaalsContact CB-SG 3.54Å; L176-Y186 HydrophobicContact CD2-CD1 4.23Å; L176-Y186 HydrophobicContact CD2-CE1 3.42Å; L176-Y186 VanDerWaalsContact CD2-CE1 3.42Å; L176-C199 PolarHBondContact N-O 2.89Å; L176-P240 HydrophobicContact CD2-CB 4.42Å; L176-P240 HydrophobicContact CD2-CG 4.06Å
177	S	95.2	Very high	93.7	Very high	40 Å²	40	44 Å²	44	28%	0.28	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-76.3	142.4	172.7	77.1	0	0	0	0	110.4	S145 K179 L180 C181	S145-S177 WeakPolarHBondContact OG-CA 3.1Å; S145-S177 WeakPolarHBondContact OG-CB 3.2Å; S145-S177 PolarHBondContact OG-N 2.82Å; S177-K179 PolarHBondContact O-N 3.48Å; S177-L180 WeakPolarHBondContact O-CB 3.4Å; S177-L180 PolarHBondContact O-N 3.34Å; S177-L180 VanDerWaalsContact OG-CB 3.29Å; S177-L180 WeakPolarHBondContact OG-CB 3.47Å; S177-L180 PolarHBondContact OG-N 3.46Å; S177-L180 VanDerWaalsContact OG-N 3.12Å; S177-C181 PolarHBondContact O-N 3.03Å
178	R	94.3	Very high	93.6	Very high	117 Å²	117	46.5 Å²	46.5	44%	0.442	24%	0.235	S	C	.	.	H	α-helix	trans	-56.6	-34.6	173.8	-70.7	-172.8	-68.8	-115.4	-1.2	112.2	L180 C181 N182 I193 T194	R178-L180 VanDerWaalsContact C-N 3.32Å; R178-L180 PolarHBondContact O-N 2.97Å; R178-C181 PolarHBondContact O-N 3.28Å; R178-N182 VanDerWaalsContact O-CB 3.27Å; R178-N182 WeakPolarHBondContact O-CB 2.98Å; R178-N182 PolarHBondContact O-N 2.94Å; R178-N182 PolarHBondContact O-ND2 3.27Å; R178-I193 HydrophobicContact CG-CG2 4.05Å; R178-T194 WeakPolarHBondContact CD-O 2.92Å
179	K	96.2	Very high	93.4	Very high	184 Å²	184	55 Å²	55	80%	0.8	27%	0.266	S	S	*	.	H	α-helix	trans	-59.3	-43.6	174.1	-178.6	-179.3	176.9	-178.6	0	111.4	S177 S183	S177-K179 PolarHBondContact O-N 3.48Å; K179-S183 PolarHBondContact O-N 3.12Å
180	L	94.7	Very high	93.1	Very high	62 Å²	62	58.3 Å²	58.3	33%	0.325	29%	0.288	S	S	.	.	H	α-helix	trans	-67.8	-48.6	178.6	-177.1	60.8	0	0	0	111.3	L176 S177 R178 N182 S183 Y186	L176-L180 HydrophobicContact CB-CD2 4.46Å; L176-L180 HydrophobicContact CD2-CD2 3.88Å; L176-L180 HydrophobicContact CD2-CG 4.45Å; L176-L180 HydrophobicContact CG-CD2 4.15Å; S177-L180 WeakPolarHBondContact O-CB 3.4Å; S177-L180 PolarHBondContact O-N 3.34Å; S177-L180 VanDerWaalsContact OG-CB 3.29Å; S177-L180 WeakPolarHBondContact OG-CB 3.47Å; S177-L180 PolarHBondContact OG-N 3.46Å; S177-L180 VanDerWaalsContact OG-N 3.12Å; R178-L180 VanDerWaalsContact C-N 3.32Å; R178-L180 PolarHBondContact O-N 2.97Å; L180-N182 VanDerWaalsContact C-N 3.29Å; L180-N182 PolarHBondContact O-N 3.28Å; L180-S183 WeakPolarHBondContact O-CB 3.44Å; L180-S183 PolarHBondContact O-N 3.12Å; L180-S183 PolarHBondContact O-OG 3.28Å; L180-Y186 HydrophobicContact CD1-CD2 3.88Å; L180-Y186 HydrophobicContact CD1-CE2 3.34Å; L180-Y186 HydrophobicContact CD2-CE2 4.25Å; L180-Y186 HydrophobicContact CG-CD2 4.07Å; L180-Y186 HydrophobicContact CG-CE1 4.24Å; L180-Y186 HydrophobicContact CG-CE2 3.6Å; L180-Y186 WeakPolarHBondContact O-CB 3.18Å; L180-Y186 WeakPolarHBondContact O-CD2 3.33Å
181	C	92.9	Very high	92.9	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-64.2	-33.8	-179.7	-64.4	0	0	0	0	112.9	L176 S177 R178 S183 Y186 Y187 I193 C199	L176-C181 VanDerWaalsContact CB-SG 3.54Å; S177-C181 PolarHBondContact O-N 3.03Å; R178-C181 PolarHBondContact O-N 3.28Å; C181-S183 VanDerWaalsContact C-N 3.28Å; C181-S183 PolarHBondContact O-N 2.97Å; C181-Y186 VanDerWaalsContact O-CB 3.26Å; C181-Y186 WeakPolarHBondContact O-CB 3.4Å; C181-Y187 HydrophobicContact CB-CD2 4.24Å; C181-Y187 WeakPolarHBondContact O-CB 3.24Å; C181-Y187 PolarHBondContact O-N 3.21Å; C181-I193 HydrophobicContact CB-CG1 3.83Å; C181-C199 HydrophobicContact CB-CB 3.92Å; C181-C199 WeakPolarHBondContact CB-SG 3.05Å; C181-C199 WeakPolarHBondContact SG-CB 3.15Å; C181-C199 CovalentContact SG-SG 2Å; C181-C199 PolarHBondContact SG-SG 2.9Å
182	N	94.8	Very high	93	Very high	21 Å²	21	63 Å²	63	11%	0.112	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	5.7	174	-71.2	-36.5	0	0	0	114.1	R178 L180 R189 I193	R178-N182 VanDerWaalsContact O-CB 3.27Å; R178-N182 WeakPolarHBondContact O-CB 2.98Å; R178-N182 PolarHBondContact O-N 2.94Å; R178-N182 PolarHBondContact O-ND2 3.27Å; L180-N182 VanDerWaalsContact C-N 3.29Å; L180-N182 PolarHBondContact O-N 3.28Å; N182-R189 HydrophobicContact CB-CG 4.26Å; N182-R189 WeakPolarHBondContact O-CG 3.2Å; N182-I193 PolarHBondContact ND2-O 3Å; N182-I193 PolarHBondContact OD1-N 3.48Å
183	S	96.1	Very high	93	Very high	31 Å²	31	60.3 Å²	60.3	22%	0.217	29%	0.292	C	S	.	.	S	Bend	trans	-75.8	159.7	176.7	75.8	0	0	0	0	111.5	K179 L180 C181 S185 Y186 N188	K179-S183 PolarHBondContact O-N 3.12Å; L180-S183 WeakPolarHBondContact O-CB 3.44Å; L180-S183 PolarHBondContact O-N 3.12Å; L180-S183 PolarHBondContact O-OG 3.28Å; C181-S183 VanDerWaalsContact C-N 3.28Å; C181-S183 PolarHBondContact O-N 2.97Å; S183-S185 PolarHBondContact O-N 3.02Å; S183-S185 VanDerWaalsContact O-N 3.12Å; S183-S185 PolarHBondContact OG-N 3.01Å; S183-S185 PolarHBondContact OG-OG 2.86Å; S183-Y186 PolarHBondContact O-N 2.82Å; S183-Y186 WeakPolarHBondContact OG-CD2 3.49Å; S183-N188 WeakPolarHBondContact O-CA 3.28Å; S183-N188 PolarHBondContact O-N 2.91Å
184	Q	95.1	Very high	93	Very high	145 Å²	145	61.9 Å²	61.9	68%	0.678	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-33.6	174.1	-172.2	65	49.5	0	0	112.7	Y186 N188	Q184-Y186 VanDerWaalsContact C-N 3.29Å; Q184-Y186 PolarHBondContact O-N 3.32Å; Q184-N188 VanDerWaalsContact NE2-CG 3.26Å; Q184-N188 PolarHBondContact NE2-ND2 3.17Å; Q184-N188 PolarHBondContact OE1-OD1 3.15Å
185	S	92.2	Very high	92.9	Very high	61 Å²	61	66.9 Å²	66.9	43%	0.427	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-6.8	-177.4	62.1	0	0	0	0	115	S183 K238	S183-S185 PolarHBondContact O-N 3.02Å; S183-S185 VanDerWaalsContact O-N 3.12Å; S183-S185 PolarHBondContact OG-N 3.01Å; S183-S185 PolarHBondContact OG-OG 2.86Å; S185-K238 WeakPolarHBondContact O-CB 3.46Å; S185-K238 WeakPolarHBondContact O-CD 3.24Å
186	Y	92.1	Very high	92.8	Very high	28 Å²	28	67.3 Å²	67.3	11%	0.11	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.5	-110.5	-178.2	-78	-109.3	0	0	0	110.4	L176 L180 C181 S183 Q184 N188 K238 K239 P240	L176-Y186 HydrophobicContact CD2-CD1 4.23Å; L176-Y186 HydrophobicContact CD2-CE1 3.42Å; L176-Y186 VanDerWaalsContact CD2-CE1 3.42Å; L180-Y186 HydrophobicContact CD1-CD2 3.88Å; L180-Y186 HydrophobicContact CD1-CE2 3.34Å; L180-Y186 HydrophobicContact CD2-CE2 4.25Å; L180-Y186 HydrophobicContact CG-CD2 4.07Å; L180-Y186 HydrophobicContact CG-CE1 4.24Å; L180-Y186 HydrophobicContact CG-CE2 3.6Å; L180-Y186 WeakPolarHBondContact O-CB 3.18Å; L180-Y186 WeakPolarHBondContact O-CD2 3.33Å; C181-Y186 VanDerWaalsContact O-CB 3.26Å; C181-Y186 WeakPolarHBondContact O-CB 3.4Å; S183-Y186 PolarHBondContact O-N 2.82Å; S183-Y186 WeakPolarHBondContact OG-CD2 3.49Å; Q184-Y186 VanDerWaalsContact C-N 3.29Å; Q184-Y186 PolarHBondContact O-N 3.32Å; Y186-N188 VanDerWaalsContact C-N 3.31Å; Y186-K238 WeakPolarHBondContact CA-O 3.23Å; Y186-K238 HydrophobicContact CD1-CB 4.2Å; Y186-K238 WeakPolarHBondContact CD1-O 3.33Å; Y186-K238 HydrophobicContact CD2-CB 4.49Å; Y186-K238 HydrophobicContact CE1-CB 4.25Å; Y186-K238 HydrophobicContact CG-CB 4.32Å; Y186-K239 PolarHBondContact O-NZ 3.2Å; Y186-P240 HydrophobicContact CD1-CG 4.11Å; Y186-P240 HydrophobicContact CE1-CG 4.32Å
187	Y	89.9	Confident	92.7	Very high	3 Å²	3	66.9 Å²	66.9	1%	0.012	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-13.6	178.8	-70.7	-65.9	0	0	0	113	C181 R189 D190 P191 I193 H232 K239 P240 I242	C181-Y187 HydrophobicContact CB-CD2 4.24Å; C181-Y187 WeakPolarHBondContact O-CB 3.24Å; C181-Y187 PolarHBondContact O-N 3.21Å; Y187-R189 PolarHBondContact O-N 2.97Å; Y187-R189 VanDerWaalsContact O-N 3.14Å; Y187-D190 CarbonylContact O-C 3.43Å; Y187-D190 PolarHBondContact O-N 2.81Å; Y187-P191 HydrophobicContact CD1-CG 4.27Å; Y187-I193 HydrophobicContact CD2-CD1 3.96Å; Y187-I193 HydrophobicContact CD2-CG1 4.07Å; Y187-I193 HydrophobicContact CE2-CD1 4.17Å; Y187-H232 AromaticContact CD1-CD2 3.86Å; Y187-H232 AromaticContact CD1-NE2 3.9Å; Y187-H232 AromaticContact CE1-CD2 3.48Å; Y187-H232 VanDerWaalsContact CE1-CD2 3.48Å; Y187-H232 WeakPolarHBondContact CE1-CD2 3.19Å; Y187-H232 AromaticContact CE1-NE2 3.94Å; Y187-K239 HydrophobicContact CD1-CD 4.21Å; Y187-K239 HydrophobicContact CE1-CD 4.1Å; Y187-P240 HydrophobicContact CE2-CG 4.2Å; Y187-P240 PolarHBondContact OH-O 2.91Å; Y187-I242 HydrophobicContact CE1-CD1 4.16Å; Y187-I242 HydrophobicContact CE2-CD1 4.03Å; Y187-I242 HydrophobicContact CE2-CG1 4.02Å; Y187-I242 WeakPolarHBondContact OH-CG1 3.49Å
188	N	94.3	Very high	92.6	Very high	75 Å²	75	65.5 Å²	65.5	40%	0.401	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	39.3	-174.7	-171	29.4	0	0	0	112.6	S183 Q184 Y186 D190	S183-N188 WeakPolarHBondContact O-CA 3.28Å; S183-N188 PolarHBondContact O-N 2.91Å; Q184-N188 VanDerWaalsContact NE2-CG 3.26Å; Q184-N188 PolarHBondContact NE2-ND2 3.17Å; Q184-N188 PolarHBondContact OE1-OD1 3.15Å; Y186-N188 VanDerWaalsContact C-N 3.31Å; N188-D190 PolarHBondContact O-N 2.92Å; N188-D190 VanDerWaalsContact O-N 3.16Å
189	R	91.7	Very high	92.5	Very high	178 Å²	178	59.9 Å²	59.9	67%	0.672	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	16.9	-176.4	-50.5	178.2	177.7	-179	-0.4	114.6	N182 Y187 P191 F192	N182-R189 HydrophobicContact CB-CG 4.26Å; N182-R189 WeakPolarHBondContact O-CG 3.2Å; Y187-R189 PolarHBondContact O-N 2.97Å; Y187-R189 VanDerWaalsContact O-N 3.14Å; R189-P191 CarbonylContact C-O 3.18Å; R189-P191 CarbonylContact O-C 3.52Å; R189-F192 HydrophobicContact CB-CD2 4.09Å; R189-F192 HydrophobicContact CG-CD2 4.19Å; R189-F192 WeakPolarHBondContact O-CA 3.4Å; R189-F192 PolarHBondContact O-N 2.8Å
190	D	88.6	Confident	92.2	Very high	124 Å²	124	51.1 Å²	51.1	66%	0.663	25%	0.25	S	C	*	.	S	Bend	trans	-133.3	96.1	173.2	-169.5	21.7	0	0	0	111	Y187 N188	Y187-D190 CarbonylContact O-C 3.43Å; Y187-D190 PolarHBondContact O-N 2.81Å; N188-D190 PolarHBondContact O-N 2.92Å; N188-D190 VanDerWaalsContact O-N 3.16Å
191	P	88.1	Confident	92	Very high	9 Å²	9	48.2 Å²	48.2	6%	0.058	24%	0.235	C	C	.	.	S	Bend	cis	-69.8	154.5	-4.1	28.3	-35.9	0	0	0	113.6	P112 Y187 R189 I193 I242	P112-P191 HydrophobicContact CB-CB 3.91Å; P112-P191 HydrophobicContact CB-CG 3.92Å; P112-P191 HydrophobicContact CG-CB 3.85Å; P112-P191 HydrophobicContact CG-CG 3.92Å; Y187-P191 HydrophobicContact CD1-CG 4.27Å; R189-P191 CarbonylContact C-O 3.18Å; R189-P191 CarbonylContact O-C 3.52Å; P191-I193 HydrophobicContact CG-CD1 4.4Å; P191-I193 PolarHBondContact O-N 2.96Å; P191-I242 HydrophobicContact CG-CD1 3.58Å
192	F	91.3	Very high	91.4	Very high	113 Å²	113	49.7 Å²	49.7	50%	0.496	24%	0.243	S	C	.	.			trans	-78.6	115	170.4	-179.7	-99.5	0	0	0	110.7	R189 T194	R189-F192 HydrophobicContact CB-CD2 4.09Å; R189-F192 HydrophobicContact CG-CD2 4.19Å; R189-F192 WeakPolarHBondContact O-CA 3.4Å; R189-F192 PolarHBondContact O-N 2.8Å; F192-T194 HydrophobicContact CD1-CG2 3.96Å; F192-T194 HydrophobicContact CE1-CG2 4.36Å; F192-T194 PolarHBondContact O-N 2.8Å; F192-T194 VanDerWaalsContact O-N 3.11Å
193	I	92.1	Very high	90.2	Very high	2 Å²	2	52 Å²	52	1%	0.01	26%	0.264	C	S	.	.			trans	-74.7	103.5	178.7	-50.5	-52.8	0	0	0	109.9	R178 C181 N182 Y187 P191 M197 I242	R178-I193 HydrophobicContact CG-CG2 4.05Å; C181-I193 HydrophobicContact CB-CG1 3.83Å; N182-I193 PolarHBondContact ND2-O 3Å; N182-I193 PolarHBondContact OD1-N 3.48Å; Y187-I193 HydrophobicContact CD2-CD1 3.96Å; Y187-I193 HydrophobicContact CD2-CG1 4.07Å; Y187-I193 HydrophobicContact CE2-CD1 4.17Å; P191-I193 HydrophobicContact CG-CD1 4.4Å; P191-I193 PolarHBondContact O-N 2.96Å; I193-M197 HydrophobicContact CD1-CE 4.26Å; I193-M197 HydrophobicContact CG2-CB 3.94Å; I193-I242 HydrophobicContact CD1-CD1 3.77Å; I193-I242 HydrophobicContact CD1-CG1 4.06Å; I193-I242 HydrophobicContact CD1-CG2 4.43Å
194	T	92.3	Very high	89.1	Confident	33 Å²	33	57.5 Å²	57.5	20%	0.202	28%	0.284	C	S	.	.			trans	-77.6	179.4	-176.9	75	0	0	0	0	113.2	R178 F192 D196 M197	R178-T194 WeakPolarHBondContact CD-O 2.92Å; F192-T194 HydrophobicContact CD1-CG2 3.96Å; F192-T194 HydrophobicContact CE1-CG2 4.36Å; F192-T194 PolarHBondContact O-N 2.8Å; F192-T194 VanDerWaalsContact O-N 3.11Å; T194-D196 PolarHBondContact O-N 3.44Å; T194-D196 PolarHBondContact OG1-N 3.33Å; T194-M197 HydrophobicContact CG2-SD 4.04Å; T194-M197 PolarHBondContact O-N 3.06Å
195	K	91.8	Very high	87.8	Confident	155 Å²	155	50.7 Å²	50.7	67%	0.674	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-18.9	172.2	71	-178.6	-178.6	-177.4	0	114.1	M197	K195-M197 VanDerWaalsContact C-N 3.29Å
196	D	91.3	Very high	86.7	Confident	13 Å²	13	52.7 Å²	52.7	7%	0.07	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-2.5	179.3	-64.5	-16.9	0	0	0	111.3	T194 L245 N247 K249 Y250	T194-D196 PolarHBondContact O-N 3.44Å; T194-D196 PolarHBondContact OG1-N 3.33Å; D196-L245 WeakPolarHBondContact O-CB 3.18Å; D196-L245 PolarHBondContact O-N 3.37Å; D196-N247 PolarHBondContact OD1-ND2 2.75Å; D196-K249 IonicContact OD2-NZ 2.62Å; D196-K249 PolarHBondContact OD2-NZ 2.97Å; D196-Y250 HydrophobicContact CB-CE2 3.95Å
197	M	92.6	Very high	85.7	Confident	10 Å²	10	54 Å²	54	5%	0.049	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	157.1	-177.4	-61.6	162.1	81.4	0	0	110.9	I193 T194 K195 I242 Y243	I193-M197 HydrophobicContact CD1-CE 4.26Å; I193-M197 HydrophobicContact CG2-CB 3.94Å; T194-M197 HydrophobicContact CG2-SD 4.04Å; T194-M197 PolarHBondContact O-N 3.06Å; K195-M197 VanDerWaalsContact C-N 3.29Å; M197-I242 HydrophobicContact CE-CG2 3.32Å; M197-Y243 CarbonylContact C-O 3.35Å; M197-Y243 VanDerWaalsContact CA-O 3.31Å; M197-Y243 WeakPolarHBondContact CA-O 3.29Å
198	V	92.3	Very high	84.9	Confident	11 Å²	11	54 Å²	54	7%	0.067	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	148.4	168.8	63.9	0	0	0	0	108.8	L143 V175 L218 A226 Y243 L245	L143-V198 HydrophobicContact CD2-CG1 4.46Å; L143-V198 HydrophobicContact CD2-CG2 4.2Å; V175-V198 HydrophobicContact CG1-CG2 3.6Å; V198-L218 HydrophobicContact CG1-CD2 4.1Å; V198-A226 HydrophobicContact CG1-CB 3.96Å; V198-Y243 HydrophobicContact CG1-CD2 4.35Å; V198-Y243 HydrophobicContact CG1-CG 4.35Å; V198-Y243 PolarHBondContact N-O 3.03Å; V198-Y243 PolarHBondContact O-N 2.7Å; V198-L245 HydrophobicContact CG1-CD1 4.28Å
199	C	91.6	Very high	83.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	137.9	172.4	48.9	0	0	0	0	108.6	L176 C181 P240 G241	L176-C199 PolarHBondContact N-O 2.89Å; C181-C199 HydrophobicContact CB-CB 3.92Å; C181-C199 WeakPolarHBondContact CB-SG 3.05Å; C181-C199 WeakPolarHBondContact SG-CB 3.15Å; C181-C199 CovalentContact SG-SG 2Å; C181-C199 PolarHBondContact SG-SG 2.9Å; C199-P240 HydrophobicContact CB-CG 4.16Å; C199-G241 VanDerWaalsContact CA-O 3.27Å; C199-G241 WeakPolarHBondContact CA-O 3.39Å
200	A	91.9	Very high	82.8	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	140.5	178.7	0	0	0	0	0	110.6	V173 T174 V175 G241 Y243	V173-A200 HydrophobicContact CB-CB 4.1Å; V173-A200 HydrophobicContact CG2-CB 3.7Å; T174-A200 CarbonylContact O-C 3.56Å; T174-A200 WeakPolarHBondContact O-CA 3.1Å; T174-A200 WeakPolarHBondContact O-CB 3.4Å; V175-A200 HydrophobicContact CG2-CB 4.46Å; A200-G241 PolarHBondContact N-O 3.23Å; A200-G241 PolarHBondContact O-N 3.29Å; A200-Y243 HydrophobicContact CB-CD2 4.22Å; A200-Y243 HydrophobicContact CB-CE2 3.6Å
201	G	89	Confident	81.9	Confident	1 Å²	1	43 Å²	43	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.4	-161.1	-179.3	0	0	0	0	0	109.6	T174 K207	T174-G201 PolarHBondContact N-O 3.11Å; T174-G201 VanDerWaalsContact N-O 3.12Å; T174-G201 PolarHBondContact O-N 3.36Å; G201-K207 WeakPolarHBondContact CA-O 3.25Å
202	D	81.3	Confident	81	Confident	31 Å²	31	42.7 Å²	42.7	17%	0.166	21%	0.21	C	C	.	.			trans	-109.7	161.7	165.2	73.5	-20.1	0	0	0	111.3	K204 G205 Q206 K207	D202-K204 PolarHBondContact O-N 3.32Å; D202-G205 PolarHBondContact O-N 3.04Å; D202-G205 WeakPolarHBondContact OD1-CA 3.49Å; D202-G205 PolarHBondContact OD1-N 3.1Å; D202-Q206 PolarHBondContact OD1-N 2.78Å; D202-Q206 WeakPolarHBondContact OD2-CB 3.24Å; D202-Q206 PolarHBondContact OD2-N 3.25Å; D202-K207 HydrophobicContact CB-CB 4.19Å; D202-K207 HydrophobicContact CB-CG 4.48Å; D202-K207 VanDerWaalsContact CG-N 3.34Å; D202-K207 PolarHBondContact N-O 3.13Å; D202-K207 PolarHBondContact OD1-N 3.39Å; D202-K207 PolarHBondContact OD2-N 3.46Å
203	A	69.6	Low	80.6	Confident	68 Å²	68	37.8 Å²	37.8	56%	0.562	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-21	-178	0	0	0	0	0	112.9
204	K	72.1	Confident	80.5	Confident	147 Å²	147	38.5 Å²	38.5	64%	0.639	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-9.5	-177.6	-66.7	-178	176.7	-177.1	0	113.5	D202 Q206 A237	D202-K204 PolarHBondContact O-N 3.32Å; K204-Q206 HydrophobicContact CB-CG 3.85Å; K204-Q206 PolarHBondContact O-N 3.05Å; K204-A237 WeakPolarHBondContact O-CB 3.45Å
205	G	68.6	Low	80.6	Confident	2 Å²	2	36.9 Å²	36.9	2%	0.021	19%	0.185	C	C	.	.	S	Bend	trans	75.2	6.4	-173.8	0	0	0	0	0	113.9	D202 K207 G235	D202-G205 PolarHBondContact O-N 3.04Å; D202-G205 WeakPolarHBondContact OD1-CA 3.49Å; D202-G205 PolarHBondContact OD1-N 3.1Å; G205-K207 VanDerWaalsContact C-N 3.34Å; G205-G235 CarbonylContact O-C 3.48Å; G205-G235 VanDerWaalsContact O-C 3.26Å; G205-G235 WeakPolarHBondContact O-CA 3.11Å
206	Q	69.1	Low	80.8	Confident	104 Å²	104	29.5 Å²	29.5	49%	0.486	15%	0.153	S	C	.	.			trans	-79.4	-17.8	-176.7	-57.6	-179.9	-50.3	0	0	112.7	D202 K204	D202-Q206 PolarHBondContact OD1-N 2.78Å; D202-Q206 WeakPolarHBondContact OD2-CB 3.24Å; D202-Q206 PolarHBondContact OD2-N 3.25Å; K204-Q206 HydrophobicContact CB-CG 3.85Å; K204-Q206 PolarHBondContact O-N 3.05Å
207	K	70.6	Confident	81.1	Confident	55 Å²	55	28.9 Å²	28.9	24%	0.239	15%	0.15	C	C	.	.	S	Bend	trans	-123.7	100.5	179.3	-58	-170.9	-164.1	-150	0	109.8	E26 V171 T172 G201 D202 G205	E26-K207 VanDerWaalsContact CD-CE 3.44Å; E26-K207 VanDerWaalsContact OE1-CE 3.29Å; E26-K207 WeakPolarHBondContact OE1-CE 3.46Å; E26-K207 IonicContact OE1-NZ 2.65Å; E26-K207 PolarHBondContact OE1-NZ 3.28Å; E26-K207 WeakPolarHBondContact OE2-CE 3.13Å; E26-K207 IonicContact OE2-NZ 3.95Å; E26-K207 PolarHBondContact OE2-NZ 2.72Å; V171-K207 HydrophobicContact CG2-CB 3.91Å; V171-K207 HydrophobicContact CG2-CG 4.43Å; T172-K207 WeakPolarHBondContact O-CD 3.15Å; G201-K207 WeakPolarHBondContact CA-O 3.25Å; D202-K207 HydrophobicContact CB-CB 4.19Å; D202-K207 HydrophobicContact CB-CG 4.48Å; D202-K207 VanDerWaalsContact CG-N 3.34Å; D202-K207 PolarHBondContact N-O 3.13Å; D202-K207 PolarHBondContact OD1-N 3.39Å; D202-K207 PolarHBondContact OD2-N 3.46Å; G205-K207 VanDerWaalsContact C-N 3.34Å
208	D	72.6	Confident	81.2	Confident	4 Å²	4	28.4 Å²	28.4	2%	0.021	15%	0.147	C	C	.	.			trans	-146.1	159.8	-174.9	-153.9	5	0	0	0	112.1	G241	D208-G241 VanDerWaalsContact OD1-CA 3.28Å; D208-G241 WeakPolarHBondContact OD1-CA 3.45Å; D208-G241 PolarHBondContact OD1-N 2.97Å
209	S	66.7	Low	81.3	Confident	9 Å²	9	28.6 Å²	28.6	6%	0.063	15%	0.148	C	C	.	.			trans	-77.7	141.3	161.8	53	0	0	0	0	109.4	D213 C234	S209-D213 WeakPolarHBondContact CA-OD2 3.17Å; S209-C234 WeakPolarHBondContact O-CB 3.29Å
210	C	75.7	Confident	81.4	Confident	11 Å²	11	28.7 Å²	28.7	7%	0.074	15%	0.148	C	C	.	.			trans	-124.8	-175.1	178.9	-158.2	0	0	0	0	112.6	A156 G212 D213 C234	A156-C210 HydrophobicContact CB-CB 4.45Å; A156-C210 WeakPolarHBondContact O-CB 3.45Å; C210-G212 PolarHBondContact O-N 2.94Å; C210-D213 PolarHBondContact N-OD2 2.91Å; C210-D213 WeakPolarHBondContact O-CB 3.28Å; C210-D213 PolarHBondContact O-N 3.44Å; C210-C234 HydrophobicContact CB-CB 3.42Å; C210-C234 VanDerWaalsContact CB-CB 3.42Å; C210-C234 WeakPolarHBondContact CB-SG 3.16Å; C210-C234 WeakPolarHBondContact SG-CB 3.19Å; C210-C234 CovalentContact SG-SG 2.03Å; C210-C234 PolarHBondContact SG-SG 2.64Å
211	K	69.1	Low	81.3	Confident	124 Å²	124	37.6 Å²	37.6	54%	0.539	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	122.7	179.3	-170.6	-172.6	-173.1	178.4	0	110.7	G155 A156 L162	G155-K211 CarbonylContact C-O 3.26Å; G155-K211 WeakPolarHBondContact CA-O 3.42Å; A156-K211 PolarHBondContact N-O 2.82Å; L162-K211 HydrophobicContact CB-CD 3.7Å; L162-K211 HydrophobicContact CD1-CD 4.23Å; L162-K211 HydrophobicContact CD2-CB 4.17Å; L162-K211 HydrophobicContact CG-CD 4.4Å
212	G	69.4	Low	81.4	Confident	3 Å²	3	40.4 Å²	40.4	3%	0.031	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	101.2	-14.6	-174.9	0	0	0	0	0	114.1	H50 C210 S214	H50-G212 PolarHBondContact NE2-O 2.62Å; C210-G212 PolarHBondContact O-N 2.94Å; G212-S214 VanDerWaalsContact C-N 3.34Å
213	D	84.1	Confident	81.9	Confident	10 Å²	10	39.6 Å²	39.6	5%	0.053	21%	0.212	C	C	.	.			trans	-81	-18.2	171.1	-68.6	-41.2	0	0	0	112.9	G153 G155 S209 C210 G215 G216 V228	G153-D213 VanDerWaalsContact CA-OD1 3.31Å; G153-D213 WeakPolarHBondContact CA-OD1 3.39Å; G155-D213 VanDerWaalsContact CA-CG 3.48Å; G155-D213 VanDerWaalsContact CA-OD1 3.24Å; G155-D213 WeakPolarHBondContact CA-OD1 3.46Å; G155-D213 PolarHBondContact N-OD1 3.28Å; S209-D213 WeakPolarHBondContact CA-OD2 3.17Å; C210-D213 PolarHBondContact N-OD2 2.91Å; C210-D213 WeakPolarHBondContact O-CB 3.28Å; C210-D213 PolarHBondContact O-N 3.44Å; D213-G215 PolarHBondContact O-N 3.29Å; D213-G216 WeakPolarHBondContact O-CA 3.49Å; D213-G216 PolarHBondContact O-N 3.15Å; D213-V228 HydrophobicContact CB-CG1 4.34Å; D213-V228 WeakPolarHBondContact O-CB 3.21Å; D213-V228 WeakPolarHBondContact O-CG2 3.49Å
214	S	90.3	Very high	83.2	Confident	17 Å²	17	36.5 Å²	36.5	12%	0.119	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.1	133.3	176.9	-76.1	0	0	0	0	112.8	C52 G53 H67 G212 G216	C52-S214 CarbonylContact C-O 3.38Å; C52-S214 WeakPolarHBondContact CA-O 3.41Å; C52-S214 VanDerWaalsContact CB-O 3.27Å; C52-S214 WeakPolarHBondContact CB-O 3.09Å; C52-S214 VanDerWaalsContact SG-CB 3.54Å; G53-S214 WeakPolarHBondContact CA-O 3.4Å; G53-S214 PolarHBondContact N-O 3.45Å; H67-S214 WeakPolarHBondContact CE1-CB 3.48Å; H67-S214 PolarHBondContact CE1-OG 3.46Å; H67-S214 VanDerWaalsContact CE1-OG 3.23Å; H67-S214 WeakPolarHBondContact NE2-CB 3.48Å; H67-S214 PolarHBondContact NE2-OG 2.75Å; G212-S214 VanDerWaalsContact C-N 3.34Å; S214-G216 PolarHBondContact O-N 2.92Å
215	G	94.1	Very high	84.3	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.9	-12.1	-175.2	0	0	0	0	0	115.5	G53 G54 T64 D213 V228	G53-G215 CarbonylContact O-C 3.57Å; G54-G215 WeakPolarHBondContact CA-O 3.31Å; T64-G215 WeakPolarHBondContact OG1-CA 3.4Å; D213-G215 PolarHBondContact O-N 3.29Å; G215-V228 PolarHBondContact N-O 3.25Å
216	G	95.4	Very high	85.5	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.159	C	C	.	.			trans	-66.5	164.3	173.8	0	0	0	0	0	113.3	D213 S214 I227 V228	D213-G216 WeakPolarHBondContact O-CA 3.49Å; D213-G216 PolarHBondContact O-N 3.15Å; S214-G216 PolarHBondContact O-N 2.92Å; G216-I227 CarbonylContact O-C 3.32Å; G216-I227 VanDerWaalsContact O-CA 3.29Å; G216-I227 WeakPolarHBondContact O-CA 3.46Å; G216-V228 WeakPolarHBondContact O-CG2 3.32Å; G216-V228 PolarHBondContact O-N 3.18Å
217	P	96.3	Very high	86.7	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	144.1	-176.8	30.4	-31.6	0	0	0	113.8	F40 M41 V55 V151 I219 F224	F40-P217 HydrophobicContact CD2-CG 4.46Å; F40-P217 HydrophobicContact CE2-CG 3.91Å; M41-P217 WeakPolarHBondContact SD-CD 3.41Å; M41-P217 HydrophobicContact SD-CG 3.68Å; V55-P217 HydrophobicContact CG2-CB 3.7Å; V55-P217 HydrophobicContact CG2-CG 3.87Å; V151-P217 WeakPolarHBondContact CA-O 3.46Å; P217-I219 HydrophobicContact CB-CD1 4.32Å; P217-I219 HydrophobicContact CB-CG1 3.99Å; P217-I219 HydrophobicContact CG-CD1 4.36Å; P217-I219 HydrophobicContact CG-CG1 4.47Å; P217-F224 HydrophobicContact CB-CD2 3.76Å; P217-F224 HydrophobicContact CB-CE2 3.54Å; P217-F224 HydrophobicContact CB-CZ 4.33Å
218	L	94.6	Very high	87.8	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	111.4	157.1	-176.5	74.8	0	0	0	108.8	L143 C149 V151 V173 V198 H225 A226 Y243	L143-L218 HydrophobicContact CD2-CD2 4.22Å; C149-L218 HydrophobicContact CB-CD1 3.51Å; C149-L218 HydrophobicContact CB-CG 3.97Å; V151-L218 HydrophobicContact CG2-CD1 3.51Å; V173-L218 HydrophobicContact CG2-CD1 3.66Å; V198-L218 HydrophobicContact CG1-CD2 4.1Å; L218-H225 PolarHBondContact O-N 3.26Å; L218-A226 HydrophobicContact CB-CB 3.98Å; L218-A226 WeakPolarHBondContact CB-O 3.42Å; L218-A226 HydrophobicContact CD2-CB 3.88Å; L218-A226 PolarHBondContact N-O 3.26Å; L218-A226 PolarHBondContact O-N 3.42Å; L218-Y243 HydrophobicContact CB-CD1 3.84Å; L218-Y243 HydrophobicContact CB-CE1 4.18Å; L218-Y243 HydrophobicContact CD1-CD1 4.22Å; L218-Y243 HydrophobicContact CD1-CE1 3.85Å; L218-Y243 HydrophobicContact CD2-CD1 4.17Å; L218-Y243 HydrophobicContact CD2-CD2 4.45Å; L218-Y243 HydrophobicContact CD2-CG 4.13Å; L218-Y243 HydrophobicContact CG-CD1 4.3Å; L218-Y243 HydrophobicContact CG-CE1 4.41Å
219	I	95.1	Very high	88.5	Confident	15 Å²	15	23 Å²	23	8%	0.077	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	122.3	-179.2	-57.9	-178.6	0	0	0	109.5	F40 L135 C149 E150 P217 V223	F40-I219 HydrophobicContact CE1-CD1 4.29Å; F40-I219 HydrophobicContact CE2-CD1 3.88Å; F40-I219 HydrophobicContact CZ-CD1 3.47Å; F40-I219 VanDerWaalsContact CZ-CD1 3.47Å; L135-I219 HydrophobicContact CD2-CD1 3.87Å; L135-I219 HydrophobicContact CD2-CG1 4.47Å; C149-I219 CarbonylContact C-O 3.55Å; C149-I219 VanDerWaalsContact CA-O 3.27Å; C149-I219 WeakPolarHBondContact CA-O 3.34Å; C149-I219 WeakPolarHBondContact CB-O 3.43Å; E150-I219 PolarHBondContact N-O 3.39Å; E150-I219 PolarHBondContact O-N 2.81Å; P217-I219 HydrophobicContact CB-CD1 4.32Å; P217-I219 HydrophobicContact CB-CG1 3.99Å; P217-I219 HydrophobicContact CG-CD1 4.36Å; P217-I219 HydrophobicContact CG-CG1 4.47Å; I219-V223 CarbonylContact C-O 3.57Å; I219-V223 VanDerWaalsContact CA-O 3.32Å; I219-V223 WeakPolarHBondContact CA-O 3.41Å
220	C	93.1	Very high	88.7	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.007	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	123	178.1	-43.4	0	0	0	0	108.9	L143 T147 C149 G222 V223	L143-C220 HydrophobicContact CD1-CB 3.85Å; L143-C220 VanDerWaalsContact CD1-SG 3.51Å; T147-C220 HydrophobicContact CG2-CB 3.95Å; C149-C220 HydrophobicContact CB-CB 3.99Å; C149-C220 WeakPolarHBondContact CB-SG 3.46Å; C149-C220 WeakPolarHBondContact SG-CB 3.42Å; C149-C220 CovalentContact SG-SG 2.03Å; C149-C220 PolarHBondContact SG-SG 3.27Å; C220-G222 PolarHBondContact O-N 3.42Å; C220-V223 PolarHBondContact N-O 2.96Å; C220-V223 WeakPolarHBondContact O-CB 3.29Å; C220-V223 PolarHBondContact O-N 2.87Å
221	K	90.6	Very high	87.9	Confident	187 Å²	187	24.3 Å²	24.3	81%	0.813	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.8	42	-178.7	-55.9	-177.8	177	-176.6	0	112.7	V223	K221-V223 VanDerWaalsContact C-N 3.27Å; K221-V223 PolarHBondContact O-N 3.49Å
222	G	90.5	Very high	87.5	Confident	60 Å²	60	22.8 Å²	22.8	62%	0.619	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.3	11.8	-178.9	0	0	0	0	0	115.4	C220	C220-G222 PolarHBondContact O-N 3.42Å
223	V	93.4	Very high	87.6	Confident	15 Å²	15	30.1 Å²	30.1	9%	0.091	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	128.9	177.6	-179.5	0	0	0	0	110.1	R138 I219 C220 K221 H225	R138-V223 HydrophobicContact CB-CG1 4.22Å; I219-V223 CarbonylContact C-O 3.57Å; I219-V223 VanDerWaalsContact CA-O 3.32Å; I219-V223 WeakPolarHBondContact CA-O 3.41Å; C220-V223 PolarHBondContact N-O 2.96Å; C220-V223 WeakPolarHBondContact O-CB 3.29Å; C220-V223 PolarHBondContact O-N 2.87Å; K221-V223 VanDerWaalsContact C-N 3.27Å; K221-V223 PolarHBondContact O-N 3.49Å; V223-H225 WeakPolarHBondContact CG1-NE2 3.12Å; V223-H225 PolarHBondContact O-CD2 3.27Å; V223-H225 PolarHBondContact O-N 2.8Å
224	F	95.1	Very high	87.3	Confident	2 Å²	2	30.1 Å²	30.1	1%	0.009	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	105.9	173.2	-177.7	-157.9	0	0	0	110.1	V55 I57 L63 L135 V137 P217 A226 I227 L246	V55-F224 HydrophobicContact CB-CE1 4.01Å; V55-F224 HydrophobicContact CB-CZ 3.98Å; V55-F224 HydrophobicContact CG1-CD1 4.3Å; V55-F224 HydrophobicContact CG1-CE1 3.77Å; V55-F224 HydrophobicContact CG1-CZ 4.17Å; V55-F224 HydrophobicContact CG2-CE1 4.07Å; V55-F224 HydrophobicContact CG2-CE2 4.11Å; V55-F224 HydrophobicContact CG2-CZ 3.59Å; I57-F224 HydrophobicContact CG2-CE1 4.22Å; L63-F224 HydrophobicContact CD2-CE1 3.96Å; L63-F224 HydrophobicContact CD2-CZ 3.99Å; L135-F224 HydrophobicContact CD1-CB 4.41Å; L135-F224 HydrophobicContact CD2-CB 3.79Å; L135-F224 HydrophobicContact CD2-CD1 3.93Å; L135-F224 HydrophobicContact CD2-CD2 4.38Å; L135-F224 HydrophobicContact CD2-CG 3.8Å; L135-F224 HydrophobicContact CG-CB 3.94Å; L135-F224 HydrophobicContact CG-CD1 4.01Å; L135-F224 HydrophobicContact CG-CG 4.19Å; V137-F224 HydrophobicContact CG2-CD1 4.11Å; V137-F224 HydrophobicContact CG2-CE1 4.06Å; P217-F224 HydrophobicContact CB-CD2 3.76Å; P217-F224 HydrophobicContact CB-CE2 3.54Å; P217-F224 HydrophobicContact CB-CZ 4.33Å; F224-A226 WeakPolarHBondContact CE2-O 3.42Å; F224-I227 HydrophobicContact CE2-CG2 3.85Å; F224-I227 HydrophobicContact CZ-CG2 3.62Å; F224-L246 HydrophobicContact CD1-CD1 3.81Å; F224-L246 HydrophobicContact CD2-CD1 3.94Å; F224-L246 HydrophobicContact CE1-CD1 3.65Å; F224-L246 HydrophobicContact CE2-CD1 3.77Å; F224-L246 HydrophobicContact CG-CD1 3.95Å; F224-L246 HydrophobicContact CZ-CD1 3.63Å
225	H	94.9	Very high	86.6	Confident	19 Å²	19	30.4 Å²	30.4	9%	0.088	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	-35.9	-169.7	-88.3	-75.4	0	0	0	114.1	K140 L143 L218 V223 L246	K140-H225 PolarHBondContact O-CE1 2.85Å; L143-H225 HydrophobicContact CD2-CB 4.1Å; L218-H225 PolarHBondContact O-N 3.26Å; V223-H225 WeakPolarHBondContact CG1-NE2 3.12Å; V223-H225 PolarHBondContact O-CD2 3.27Å; V223-H225 PolarHBondContact O-N 2.8Å; H225-L246 WeakPolarHBondContact O-CB 3.48Å; H225-L246 PolarHBondContact O-N 2Å
226	A	94.4	Very high	86	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	163.3	-174.3	0	0	0	0	0	110.2	V198 L218 F224 T244 L245	V198-A226 HydrophobicContact CG1-CB 3.96Å; L218-A226 HydrophobicContact CB-CB 3.98Å; L218-A226 WeakPolarHBondContact CB-O 3.42Å; L218-A226 HydrophobicContact CD2-CB 3.88Å; L218-A226 PolarHBondContact N-O 3.26Å; L218-A226 PolarHBondContact O-N 3.42Å; F224-A226 WeakPolarHBondContact CE2-O 3.42Å; A226-T244 CarbonylContact C-O 3.59Å; A226-T244 WeakPolarHBondContact CA-O 3.16Å; A226-T244 VanDerWaalsContact CB-O 3.24Å; A226-T244 WeakPolarHBondContact CB-O 3.45Å; A226-L245 HydrophobicContact CB-CD1 4.47Å
227	I	94.1	Very high	85.6	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	146.2	168.3	55.7	167.7	0	0	0	109.6	L63 T64 A65 D116 I117 G216 F224 S229 Y243 T244	L63-I227 HydrophobicContact CD2-CG2 4.21Å; L63-I227 HydrophobicContact CG-CG2 4.38Å; T64-I227 WeakPolarHBondContact O-CD1 3.01Å; A65-I227 HydrophobicContact CB-CD1 4.48Å; D116-I227 WeakPolarHBondContact O-CD1 3.27Å; I117-I227 HydrophobicContact CB-CD1 3.73Å; I117-I227 HydrophobicContact CD1-CD1 4.09Å; I117-I227 HydrophobicContact CG1-CD1 3.59Å; G216-I227 CarbonylContact O-C 3.32Å; G216-I227 VanDerWaalsContact O-CA 3.29Å; G216-I227 WeakPolarHBondContact O-CA 3.46Å; F224-I227 HydrophobicContact CE2-CG2 3.85Å; F224-I227 HydrophobicContact CZ-CG2 3.62Å; I227-S229 PolarHBondContact O-N 3.42Å; I227-S229 VanDerWaalsContact O-N 3.17Å; I227-Y243 CarbonylContact O-C 3.59Å; I227-Y243 WeakPolarHBondContact O-CA 3.02Å; I227-Y243 VanDerWaalsContact O-CB 3.25Å; I227-Y243 WeakPolarHBondContact O-CB 3.41Å; I227-T244 PolarHBondContact N-O 2.92Å; I227-T244 PolarHBondContact O-N 2.86Å
228	V	93.6	Very high	85.1	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.012	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	117.3	172.2	-177.6	0	0	0	0	107.5	V151 D213 G215 G216 Y243	V151-V228 HydrophobicContact CG1-CG2 3.66Å; D213-V228 HydrophobicContact CB-CG1 4.34Å; D213-V228 WeakPolarHBondContact O-CB 3.21Å; D213-V228 WeakPolarHBondContact O-CG2 3.49Å; G215-V228 PolarHBondContact N-O 3.25Å; G216-V228 WeakPolarHBondContact O-CG2 3.32Å; G216-V228 PolarHBondContact O-N 3.18Å; V228-Y243 HydrophobicContact CB-CD1 4.35Å; V228-Y243 HydrophobicContact CB-CE1 4.49Å; V228-Y243 HydrophobicContact CG2-CD1 3.94Å; V228-Y243 HydrophobicContact CG2-CE1 3.76Å
229	S	87.8	Confident	84.8	Confident	7 Å²	7	43.2 Å²	43.2	5%	0.049	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	-42.6	177.2	170	0	0	0	0	109.9	H67 D116 I227 I242	H67-S229 PolarHBondContact CE1-O 2.63Å; H67-S229 PolarHBondContact ND1-O 3.35Å; D116-S229 VanDerWaalsContact CB-OG 3.24Å; D116-S229 WeakPolarHBondContact CB-OG 3.27Å; D116-S229 WeakPolarHBondContact OD2-CA 3.31Å; D116-S229 VanDerWaalsContact OD2-CB 3.31Å; D116-S229 WeakPolarHBondContact OD2-CB 3.49Å; D116-S229 PolarHBondContact OD2-OG 2.81Å; I227-S229 PolarHBondContact O-N 3.42Å; I227-S229 VanDerWaalsContact O-N 3.17Å; S229-I242 PolarHBondContact N-O 3.12Å
230	G	70.6	Confident	84.5	Confident	15 Å²	15	42.7 Å²	42.7	16%	0.155	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.3	-154.6	-176.9	0	0	0	0	0	109.6	I242	G230-I242 PolarHBondContact N-O 3.22Å; G230-I242 VanDerWaalsContact N-O 3.15Å; G230-I242 WeakPolarHBondContact O-CA 3.37Å; G230-I242 VanDerWaalsContact O-CB 3.23Å; G230-I242 WeakPolarHBondContact O-CB 3.47Å; G230-I242 PolarHBondContact O-N 3.47Å; G230-I242 VanDerWaalsContact O-O 3.09Å
231	G	59.5	Low	84.4	Confident	33 Å²	33	42.7 Å²	42.7	34%	0.34	25%	0.245	S	C	.	.			trans	161.5	177.3	-173.6	0	0	0	0	0	108.5
232	H	61.1	Low	84.5	Confident	93 Å²	93	33.9 Å²	33.9	43%	0.431	21%	0.207	S	C	.	.	S	Bend	trans	-63.4	-176.4	162.6	-66	-55.3	0	0	0	110.1	Y187 C234	Y187-H232 AromaticContact CD1-CD2 3.86Å; Y187-H232 AromaticContact CD1-NE2 3.9Å; Y187-H232 AromaticContact CE1-CD2 3.48Å; Y187-H232 VanDerWaalsContact CE1-CD2 3.48Å; Y187-H232 WeakPolarHBondContact CE1-CD2 3.19Å; Y187-H232 AromaticContact CE1-NE2 3.94Å; H232-C234 PolarHBondContact O-N 2.81Å
233	E	71	Confident	84.6	Confident	157 Å²	157	31 Å²	31	73%	0.734	18%	0.178	S	C	*	.	S	Bend	trans	-38.2	131	168.9	-64.6	170.4	-179.4	0	0	111.7	V236	E233-V236 HydrophobicContact CB-CG2 3.81Å; E233-V236 WeakPolarHBondContact O-CG2 3.38Å
234	C	77.6	Confident	84.6	Confident	9 Å²	9	30.4 Å²	30.4	6%	0.061	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	157.5	176.5	76.2	0	0	0	0	109.7	S209 C210 H232 V236	S209-C234 WeakPolarHBondContact O-CB 3.29Å; C210-C234 HydrophobicContact CB-CB 3.42Å; C210-C234 VanDerWaalsContact CB-CB 3.42Å; C210-C234 WeakPolarHBondContact CB-SG 3.16Å; C210-C234 WeakPolarHBondContact SG-CB 3.19Å; C210-C234 CovalentContact SG-SG 2.03Å; C210-C234 PolarHBondContact SG-SG 2.64Å; H232-C234 PolarHBondContact O-N 2.81Å; C234-V236 VanDerWaalsContact C-N 3.27Å; C234-V236 PolarHBondContact O-N 2.8Å
235	G	75.8	Confident	84.5	Confident	24 Å²	24	31.3 Å²	31.3	25%	0.247	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.1	-1.5	178.6	0	0	0	0	0	114.5	G205	G205-G235 CarbonylContact O-C 3.48Å; G205-G235 VanDerWaalsContact O-C 3.26Å; G205-G235 WeakPolarHBondContact O-CA 3.11Å
236	V	81.8	Confident	84.5	Confident	52 Å²	52	30.8 Å²	30.8	32%	0.315	18%	0.177	S	C	.	.			trans	-94	122.2	-172.3	-179.1	0	0	0	0	111.2	E233 C234 K238 K239	E233-V236 HydrophobicContact CB-CG2 3.81Å; E233-V236 WeakPolarHBondContact O-CG2 3.38Å; C234-V236 VanDerWaalsContact C-N 3.27Å; C234-V236 PolarHBondContact O-N 2.8Å; V236-K238 PolarHBondContact O-N 2.88Å; V236-K239 HydrophobicContact CB-CB 4.03Å; V236-K239 HydrophobicContact CB-CG 4.23Å; V236-K239 HydrophobicContact CG1-CB 4.04Å; V236-K239 HydrophobicContact CG1-CG 3.68Å; V236-K239 PolarHBondContact O-N 2.84Å
237	A	85.6	Confident	84.4	Confident	55 Å²	55	31.9 Å²	31.9	46%	0.455	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	134.1	177.4	0	0	0	0	0	111.6	K204 K239	K204-A237 WeakPolarHBondContact O-CB 3.45Å; A237-K239 PolarHBondContact O-N 2.72Å
238	K	87	Confident	84.3	Confident	107 Å²	107	38.7 Å²	38.7	47%	0.465	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	13.3	-178.7	-46.1	177.7	-172.2	170.3	0	115.3	S185 Y186 V236 P240	S185-K238 WeakPolarHBondContact O-CB 3.46Å; S185-K238 WeakPolarHBondContact O-CD 3.24Å; Y186-K238 WeakPolarHBondContact CA-O 3.23Å; Y186-K238 HydrophobicContact CD1-CB 4.2Å; Y186-K238 WeakPolarHBondContact CD1-O 3.33Å; Y186-K238 HydrophobicContact CD2-CB 4.49Å; Y186-K238 HydrophobicContact CE1-CB 4.25Å; Y186-K238 HydrophobicContact CG-CB 4.32Å; V236-K238 PolarHBondContact O-N 2.88Å; K238-P240 VanDerWaalsContact O-CD 3.29Å; K238-P240 WeakPolarHBondContact O-CD 3.31Å
239	K	88.1	Confident	84.2	Confident	54 Å²	54	42.4 Å²	42.4	24%	0.235	23%	0.228	C	C	.	.			trans	-117.1	63.4	170.1	-60.1	-55.6	-158.7	171.7	0	110.8	Y186 Y187 V236 A237	Y186-K239 PolarHBondContact O-NZ 3.2Å; Y187-K239 HydrophobicContact CD1-CD 4.21Å; Y187-K239 HydrophobicContact CE1-CD 4.1Å; V236-K239 HydrophobicContact CB-CB 4.03Å; V236-K239 HydrophobicContact CB-CG 4.23Å; V236-K239 HydrophobicContact CG1-CB 4.04Å; V236-K239 HydrophobicContact CG1-CG 3.68Å; V236-K239 PolarHBondContact O-N 2.84Å; A237-K239 PolarHBondContact O-N 2.72Å
240	P	89.6	Confident	84.5	Confident	4 Å²	4	42.1 Å²	42.1	3%	0.026	23%	0.226	C	C	.	.			trans	-68.7	143.8	-173.3	32.3	-38.4	0	0	0	112.1	L176 Y186 Y187 C199 K238	L176-P240 HydrophobicContact CD2-CB 4.42Å; L176-P240 HydrophobicContact CD2-CG 4.06Å; Y186-P240 HydrophobicContact CD1-CG 4.11Å; Y186-P240 HydrophobicContact CE1-CG 4.32Å; Y187-P240 HydrophobicContact CE2-CG 4.2Å; Y187-P240 PolarHBondContact OH-O 2.91Å; C199-P240 HydrophobicContact CB-CG 4.16Å; K238-P240 VanDerWaalsContact O-CD 3.29Å; K238-P240 WeakPolarHBondContact O-CD 3.31Å
241	G	90.3	Very high	85.6	Confident	1 Å²	1	43 Å²	43	1%	0.01	23%	0.226	C	C	.	.			trans	-44.9	145.7	176.5	0	0	0	0	0	115.5	C199 A200 D208 Y243	C199-G241 VanDerWaalsContact CA-O 3.27Å; C199-G241 WeakPolarHBondContact CA-O 3.39Å; A200-G241 PolarHBondContact N-O 3.23Å; A200-G241 PolarHBondContact O-N 3.29Å; D208-G241 VanDerWaalsContact OD1-CA 3.28Å; D208-G241 WeakPolarHBondContact OD1-CA 3.45Å; D208-G241 PolarHBondContact OD1-N 2.97Å; G241-Y243 VanDerWaalsContact C-CE2 3.43Å; G241-Y243 WeakPolarHBondContact O-CD2 3.15Å; G241-Y243 WeakPolarHBondContact O-CE2 3.32Å
242	I	91.7	Very high	87.2	Confident	3 Å²	3	46 Å²	46	2%	0.015	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	136.5	-179.7	-57.7	175.1	0	0	0	109.3	Y187 P191 I193 M197 S229 G230	Y187-I242 HydrophobicContact CE1-CD1 4.16Å; Y187-I242 HydrophobicContact CE2-CD1 4.03Å; Y187-I242 HydrophobicContact CE2-CG1 4.02Å; Y187-I242 WeakPolarHBondContact OH-CG1 3.49Å; P191-I242 HydrophobicContact CG-CD1 3.58Å; I193-I242 HydrophobicContact CD1-CD1 3.77Å; I193-I242 HydrophobicContact CD1-CG1 4.06Å; I193-I242 HydrophobicContact CD1-CG2 4.43Å; M197-I242 HydrophobicContact CE-CG2 3.32Å; S229-I242 PolarHBondContact N-O 3.12Å; G230-I242 PolarHBondContact N-O 3.22Å; G230-I242 VanDerWaalsContact N-O 3.15Å; G230-I242 WeakPolarHBondContact O-CA 3.37Å; G230-I242 VanDerWaalsContact O-CB 3.23Å; G230-I242 WeakPolarHBondContact O-CB 3.47Å; G230-I242 PolarHBondContact O-N 3.47Å; G230-I242 VanDerWaalsContact O-O 3.09Å
243	Y	93.1	Very high	88.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	141.8	-175.9	-48.2	-105.6	0	0	0	110.3	V151 M197 V198 A200 L218 I227 V228 G241 L245	V151-Y243 HydrophobicContact CG1-CE1 4.48Å; V151-Y243 HydrophobicContact CG2-CE1 3.62Å; V151-Y243 WeakPolarHBondContact CG2-OH 3.32Å; M197-Y243 CarbonylContact C-O 3.35Å; M197-Y243 VanDerWaalsContact CA-O 3.31Å; M197-Y243 WeakPolarHBondContact CA-O 3.29Å; V198-Y243 HydrophobicContact CG1-CD2 4.35Å; V198-Y243 HydrophobicContact CG1-CG 4.35Å; V198-Y243 PolarHBondContact N-O 3.03Å; V198-Y243 PolarHBondContact O-N 2.7Å; A200-Y243 HydrophobicContact CB-CD2 4.22Å; A200-Y243 HydrophobicContact CB-CE2 3.6Å; L218-Y243 HydrophobicContact CB-CD1 3.84Å; L218-Y243 HydrophobicContact CB-CE1 4.18Å; L218-Y243 HydrophobicContact CD1-CD1 4.22Å; L218-Y243 HydrophobicContact CD1-CE1 3.85Å; L218-Y243 HydrophobicContact CD2-CD1 4.17Å; L218-Y243 HydrophobicContact CD2-CD2 4.45Å; L218-Y243 HydrophobicContact CD2-CG 4.13Å; L218-Y243 HydrophobicContact CG-CD1 4.3Å; L218-Y243 HydrophobicContact CG-CE1 4.41Å; I227-Y243 CarbonylContact O-C 3.59Å; I227-Y243 WeakPolarHBondContact O-CA 3.02Å; I227-Y243 VanDerWaalsContact O-CB 3.25Å; I227-Y243 WeakPolarHBondContact O-CB 3.41Å; V228-Y243 HydrophobicContact CB-CD1 4.35Å; V228-Y243 HydrophobicContact CB-CE1 4.49Å; V228-Y243 HydrophobicContact CG2-CD1 3.94Å; V228-Y243 HydrophobicContact CG2-CE1 3.76Å; G241-Y243 VanDerWaalsContact C-CE2 3.43Å; G241-Y243 WeakPolarHBondContact O-CD2 3.15Å; G241-Y243 WeakPolarHBondContact O-CE2 3.32Å; Y243-L245 PolarHBondContact O-N 3.02Å
244	T	94	Very high	90	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.012	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	111.4	171.2	-61.6	0	0	0	0	109	D116 I117 A226 I227 L246 Y250	D116-T244 WeakPolarHBondContact O-CB 3.44Å; D116-T244 PolarHBondContact O-OG1 3.17Å; I117-T244 HydrophobicContact CB-CG2 4.05Å; I117-T244 HydrophobicContact CD1-CG2 4.44Å; I117-T244 HydrophobicContact CG2-CG2 4.25Å; A226-T244 CarbonylContact C-O 3.59Å; A226-T244 WeakPolarHBondContact CA-O 3.16Å; A226-T244 VanDerWaalsContact CB-O 3.24Å; A226-T244 WeakPolarHBondContact CB-O 3.45Å; I227-T244 PolarHBondContact N-O 2.92Å; I227-T244 PolarHBondContact O-N 2.86Å; T244-L246 PolarHBondContact O-N 3.46Å; T244-Y250 HydrophobicContact CG2-CD2 4.05Å; T244-Y250 HydrophobicContact CG2-CE2 3.52Å
245	L	93.9	Very high	90.8	Very high	21 Å²	21	43.2 Å²	43.2	11%	0.11	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	123.6	-177.1	-174.6	73.2	0	0	0	110	L143 D196 V198 A226 Y243 N247 Y250	L143-L245 HydrophobicContact CB-CD1 4.4Å; L143-L245 HydrophobicContact CD2-CD1 4.23Å; D196-L245 WeakPolarHBondContact O-CB 3.18Å; D196-L245 PolarHBondContact O-N 3.37Å; V198-L245 HydrophobicContact CG1-CD1 4.28Å; A226-L245 HydrophobicContact CB-CD1 4.47Å; Y243-L245 PolarHBondContact O-N 3.02Å; L245-N247 PolarHBondContact O-N 2.69Å; L245-Y250 WeakPolarHBondContact O-CD2 3.38Å; L245-Y250 WeakPolarHBondContact O-CE2 3.49Å
246	L	94.1	Very high	91.7	Very high	8 Å²	8	45.7 Å²	45.7	4%	0.042	24%	0.235	C	C	.	.			trans	-72.8	66.1	178.8	-59	178.6	0	0	0	111.4	L63 I117 V137 F224 H225 T244 Q251	L63-L246 HydrophobicContact CD2-CD1 4.17Å; L63-L246 HydrophobicContact CD2-CD2 3.79Å; I117-L246 HydrophobicContact CD1-CD2 3.53Å; V137-L246 HydrophobicContact CG1-CB 4.11Å; V137-L246 HydrophobicContact CG1-CD1 3.91Å; V137-L246 HydrophobicContact CG2-CD1 4.23Å; F224-L246 HydrophobicContact CD1-CD1 3.81Å; F224-L246 HydrophobicContact CD2-CD1 3.94Å; F224-L246 HydrophobicContact CE1-CD1 3.65Å; F224-L246 HydrophobicContact CE2-CD1 3.77Å; F224-L246 HydrophobicContact CG-CD1 3.95Å; F224-L246 HydrophobicContact CZ-CD1 3.63Å; H225-L246 WeakPolarHBondContact O-CB 3.48Å; H225-L246 PolarHBondContact O-N 2Å; T244-L246 PolarHBondContact O-N 3.46Å; L246-Q251 PolarHBondContact O-NE2 2.79Å
247	N	92.3	Very high	92.3	Very high	23 Å²	23	45.2 Å²	45.2	12%	0.123	23%	0.23	C	C	.	.			trans	-80.8	-179.3	178.2	69.6	23.1	0	0	0	111.9	D196 L245 K249 Y250 Q251	D196-N247 PolarHBondContact OD1-ND2 2.75Å; L245-N247 PolarHBondContact O-N 2.69Å; N247-K249 PolarHBondContact O-N 2.94Å; N247-K249 VanDerWaalsContact O-N 3.15Å; N247-K249 VanDerWaalsContact OD1-CB 3.32Å; N247-K249 WeakPolarHBondContact OD1-CB 3.4Å; N247-K249 PolarHBondContact OD1-N 3.34Å; N247-Y250 PolarHBondContact O-N 3.46Å; N247-Y250 PolarHBondContact OD1-N 2.94Å; N247-Q251 VanDerWaalsContact O-CG 3.29Å; N247-Q251 WeakPolarHBondContact O-CG 3.33Å; N247-Q251 PolarHBondContact O-N 3Å
248	K	91.9	Very high	92.5	Very high	143 Å²	143	45.1 Å²	45.1	62%	0.622	22%	0.222	S	C	*	.	H	α-helix	trans	-53	-36.7	-179.6	-70.3	-168.9	176.5	-176.8	0	114.1	N141 Q251 T252	N141-K248 VanDerWaalsContact ND2-CE 3.32Å; N141-K248 WeakPolarHBondContact ND2-CE 3.3Å; N141-K248 WeakPolarHBondContact ND2-CG 3.35Å; K248-Q251 PolarHBondContact O-N 2.99Å; K248-T252 WeakPolarHBondContact O-CB 3.26Å; K248-T252 PolarHBondContact O-N 2.69Å; K248-T252 PolarHBondContact O-OG1 3.05Å
249	K	92.3	Very high	92.2	Very high	80 Å²	80	42.7 Å²	42.7	35%	0.348	22%	0.222	S	C	.	.	H	α-helix	trans	-61.4	-49.7	-179.6	164	-175.2	164.5	-170	0	110.5	F105 N115 D196 N247 W253	F105-K249 VanDerWaalsContact CE1-CE 3.48Å; F105-K249 HydrophobicContact CE2-CG 4.33Å; F105-K249 HydrophobicContact CZ-CD 4.23Å; F105-K249 HydrophobicContact CZ-CG 3.88Å; N115-K249 WeakPolarHBondContact OD1-CE 3.27Å; N115-K249 PolarHBondContact OD1-NZ 3.47Å; D196-K249 IonicContact OD2-NZ 2.62Å; D196-K249 PolarHBondContact OD2-NZ 2.97Å; N247-K249 PolarHBondContact O-N 2.94Å; N247-K249 VanDerWaalsContact O-N 3.15Å; N247-K249 VanDerWaalsContact OD1-CB 3.32Å; N247-K249 WeakPolarHBondContact OD1-CB 3.4Å; N247-K249 PolarHBondContact OD1-N 3.34Å; K249-W253 PolarHBondContact O-N 3.4Å
250	Y	93.9	Very high	91	Very high	1 Å²	1	45 Å²	45	0%	0.004	24%	0.243	C	C	.	.	H	α-helix	trans	-74	-35.7	178.5	-57	-56.8	0	0	0	112.6	F105 N115 I117 D196 T244 L245 N247 T252 W253 I254	F105-Y250 HydrophobicContact CD1-CE1 4.12Å; F105-Y250 AromaticContact CD2-CD1 3.54Å; F105-Y250 HydrophobicContact CD2-CD1 3.54Å; F105-Y250 AromaticContact CD2-CE1 3.79Å; F105-Y250 HydrophobicContact CD2-CE1 3.79Å; F105-Y250 HydrophobicContact CE1-CE1 4.18Å; F105-Y250 AromaticContact CE2-CD1 3.56Å; F105-Y250 HydrophobicContact CE2-CD1 3.56Å; F105-Y250 AromaticContact CE2-CE1 3.85Å; F105-Y250 HydrophobicContact CE2-CE1 3.85Å; F105-Y250 HydrophobicContact CG-CD1 4.14Å; F105-Y250 AromaticContact CG-CE1 3.93Å; F105-Y250 HydrophobicContact CG-CE1 3.93Å; F105-Y250 HydrophobicContact CZ-CD1 4.18Å; F105-Y250 HydrophobicContact CZ-CE1 4.06Å; N115-Y250 WeakPolarHBondContact CA-OH 3.42Å; N115-Y250 HydrophobicContact CB-CE1 4.34Å; N115-Y250 PolarHBondContact OD1-OH 3.28Å; I117-Y250 HydrophobicContact CD1-CD1 4.37Å; I117-Y250 HydrophobicContact CD1-CG 4.11Å; I117-Y250 HydrophobicContact CG2-CD1 3.55Å; I117-Y250 HydrophobicContact CG2-CE1 3.57Å; I117-Y250 HydrophobicContact CG2-CG 4.26Å; D196-Y250 HydrophobicContact CB-CE2 3.95Å; T244-Y250 HydrophobicContact CG2-CD2 4.05Å; T244-Y250 HydrophobicContact CG2-CE2 3.52Å; L245-Y250 WeakPolarHBondContact O-CD2 3.38Å; L245-Y250 WeakPolarHBondContact O-CE2 3.49Å; N247-Y250 PolarHBondContact O-N 3.46Å; N247-Y250 PolarHBondContact OD1-N 2.94Å; Y250-T252 VanDerWaalsContact C-N 3.35Å; Y250-T252 PolarHBondContact O-N 3.02Å; Y250-W253 PolarHBondContact O-N 3.26Å; Y250-I254 WeakPolarHBondContact O-CB 3.35Å; Y250-I254 VanDerWaalsContact O-CG1 3.24Å; Y250-I254 WeakPolarHBondContact O-CG1 3.2Å; Y250-I254 PolarHBondContact O-N 3.23Å
251	Q	93.4	Very high	89.3	Confident	33 Å²	33	50.4 Å²	50.4	15%	0.154	28%	0.277	C	S	.	.	H	α-helix	trans	-59.3	-44.3	174.7	-71.9	169.2	25.2	0	0	112.2	V137 R138 N141 L246 N247 K248 I254 K255	V137-Q251 HydrophobicContact CG1-CG 3.84Å; R138-Q251 PolarHBondContact O-NE2 2.8Å; N141-Q251 PolarHBondContact OD1-NE2 2.81Å; L246-Q251 PolarHBondContact O-NE2 2.79Å; N247-Q251 VanDerWaalsContact O-CG 3.29Å; N247-Q251 WeakPolarHBondContact O-CG 3.33Å; N247-Q251 PolarHBondContact O-N 3Å; K248-Q251 PolarHBondContact O-N 2.99Å; Q251-I254 PolarHBondContact O-N 3.11Å; Q251-K255 WeakPolarHBondContact O-CB 3.37Å; Q251-K255 PolarHBondContact O-N 2.78Å
252	T	93.2	Very high	87.3	Confident	97 Å²	97	59 Å²	59	60%	0.595	32%	0.317	S	S	*	.	H	α-helix	trans	-62.1	-44.6	176.3	-62.7	0	0	0	0	111.2	K248 Y250 K255 S256	K248-T252 WeakPolarHBondContact O-CB 3.26Å; K248-T252 PolarHBondContact O-N 2.69Å; K248-T252 PolarHBondContact O-OG1 3.05Å; Y250-T252 VanDerWaalsContact C-N 3.35Å; Y250-T252 PolarHBondContact O-N 3.02Å; T252-K255 PolarHBondContact O-N 3.01Å; T252-S256 PolarHBondContact O-N 3.42Å; T252-S256 PolarHBondContact O-OG 3.14Å
253	W	95	Very high	85	Confident	25 Å²	25	65 Å²	65	10%	0.095	35%	0.354	C	S	.	.	H	α-helix	trans	-65.9	-39.4	177.8	168.5	82.2	0	0	0	113.1	L63 I103 F105 I117 L119 K249 Y250 S256 N257	L63-W253 HydrophobicContact CD1-CZ3 4.4Å; I103-W253 HydrophobicContact CG2-CZ2 4.25Å; I103-W253 WeakPolarHBondContact O-CH2 3.37Å; I103-W253 VanDerWaalsContact O-CZ2 3.27Å; I103-W253 WeakPolarHBondContact O-CZ2 3.48Å; F105-W253 HydrophobicContact CB-CZ2 4.4Å; F105-W253 HydrophobicContact CD2-CB 4.1Å; F105-W253 AromaticContact CD2-CD1 3.97Å; F105-W253 AromaticContact CD2-CD2 3.51Å; F105-W253 HydrophobicContact CD2-CD2 3.51Å; F105-W253 AromaticContact CD2-CE2 3.88Å; F105-W253 AromaticContact CD2-CE3 3.86Å; F105-W253 HydrophobicContact CD2-CE3 3.86Å; F105-W253 AromaticContact CD2-CG 3.6Å; F105-W253 HydrophobicContact CD2-CG 3.6Å; F105-W253 HydrophobicContact CD2-CZ3 4.49Å; F105-W253 HydrophobicContact CE2-CB 3.67Å; F105-W253 HydrophobicContact CE2-CD2 4.04Å; F105-W253 AromaticContact CE2-CG 3.63Å; F105-W253 HydrophobicContact CE2-CG 3.63Å; I117-W253 HydrophobicContact CD1-CZ3 4.45Å; I117-W253 HydrophobicContact CG1-CZ3 4.14Å; L119-W253 HydrophobicContact CB-CH2 4.05Å; L119-W253 HydrophobicContact CD1-CH2 3.88Å; L119-W253 HydrophobicContact CD1-CZ2 4.14Å; L119-W253 HydrophobicContact CD1-CZ3 4.07Å; L119-W253 HydrophobicContact CG-CH2 3.56Å; L119-W253 HydrophobicContact CG-CZ2 4.24Å; L119-W253 HydrophobicContact CG-CZ3 3.82Å; K249-W253 PolarHBondContact O-N 3.4Å; Y250-W253 PolarHBondContact O-N 3.26Å; W253-S256 PolarHBondContact O-N 3.05Å; W253-S256 PolarHBondContact O-OG 3.44Å; W253-N257 PolarHBondContact NE1-ND2 3.1Å; W253-N257 PolarHBondContact O-N 3.45Å; W253-N257 PolarHBondContact O-ND2 2.89Å
254	I	95.7	Very high	82.4	Confident	10 Å²	10	75.8 Å²	75.8	5%	0.051	41%	0.411	C	S	.	.	H	α-helix	trans	-60	-51.4	173.2	-69.9	166.8	0	0	0	108.7	I57 L63 V137 Y250 Q251 S256 N257 L258	I57-I254 HydrophobicContact CD1-CG2 3.72Å; L63-I254 HydrophobicContact CD1-CD1 3.87Å; L63-I254 HydrophobicContact CD1-CG1 4.16Å; L63-I254 HydrophobicContact CD2-CD1 3.85Å; V137-I254 HydrophobicContact CG1-CD1 4.39Å; V137-I254 HydrophobicContact CG2-CD1 4.17Å; Y250-I254 WeakPolarHBondContact O-CB 3.35Å; Y250-I254 VanDerWaalsContact O-CG1 3.24Å; Y250-I254 WeakPolarHBondContact O-CG1 3.2Å; Y250-I254 PolarHBondContact O-N 3.23Å; Q251-I254 PolarHBondContact O-N 3.11Å; I254-S256 VanDerWaalsContact C-N 3.3Å; I254-S256 PolarHBondContact O-N 2.87Å; I254-N257 PolarHBondContact O-N 3.23Å; I254-N257 VanDerWaalsContact O-N 3.12Å; I254-L258 HydrophobicContact CG2-CD1 3.88Å; I254-L258 HydrophobicContact CG2-CD2 4.21Å; I254-L258 VanDerWaalsContact O-CD1 3.28Å; I254-L258 WeakPolarHBondContact O-CD1 3.48Å; I254-L258 PolarHBondContact O-N 3.46Å
255	K	94.3	Very high	81.9	Confident	164 Å²	164	79.5 Å²	79.5	71%	0.713	43%	0.431	S	S	*	.	H	α-helix	trans	-57.8	-40.2	-179.3	-171.6	179.7	179.2	-176	0	112.7	Q251 T252 N257 L258 A259	Q251-K255 WeakPolarHBondContact O-CB 3.37Å; Q251-K255 PolarHBondContact O-N 2.78Å; T252-K255 PolarHBondContact O-N 3.01Å; K255-N257 VanDerWaalsContact C-N 3.33Å; K255-N257 PolarHBondContact O-N 3.12Å; K255-L258 PolarHBondContact O-N 2.85Å; K255-A259 PolarHBondContact O-N 2.97Å
256	S	94.2	Very high	81.2	Confident	77 Å²	77	82.5 Å²	82.5	54%	0.538	45%	0.448	S	S	.	.	H	α-helix	trans	-67.8	-30.5	179.7	63.5	0	0	0	0	113.5	T252 W253 I254	T252-S256 PolarHBondContact O-N 3.42Å; T252-S256 PolarHBondContact O-OG 3.14Å; W253-S256 PolarHBondContact O-N 3.05Å; W253-S256 PolarHBondContact O-OG 3.44Å; I254-S256 VanDerWaalsContact C-N 3.3Å; I254-S256 PolarHBondContact O-N 2.87Å
257	N	94.1	Very high	80.5	Confident	42 Å²	42	86.7 Å²	86.7	23%	0.225	47%	0.471	C	S	.	.	H	α-helix	trans	-84.3	-28	178.3	-76.1	-85.7	0	0	0	113	W61 L119 W253 I254 K255 A259	W61-N257 HydrophobicContact CH2-CB 4.47Å; W61-N257 WeakPolarHBondContact CZ2-O 3.44Å; L119-N257 HydrophobicContact CD1-CB 3.48Å; L119-N257 VanDerWaalsContact CD1-CB 3.48Å; W253-N257 PolarHBondContact NE1-ND2 3.1Å; W253-N257 PolarHBondContact O-N 3.45Å; W253-N257 PolarHBondContact O-ND2 2.89Å; I254-N257 PolarHBondContact O-N 3.23Å; I254-N257 VanDerWaalsContact O-N 3.12Å; K255-N257 VanDerWaalsContact C-N 3.33Å; K255-N257 PolarHBondContact O-N 3.12Å; N257-A259 VanDerWaalsContact C-N 3.32Å
258	L	91.6	Very high	79.8	Confident	52 Å²	52	90.4 Å²	90.4	27%	0.272	49%	0.491	S	S	.	.	H	α-helix	trans	-76.6	-20.7	176.9	-91.5	63.9	0	0	0	112.7	I57 D58 W61 L119 I254 K255	I57-L258 HydrophobicContact CD1-CD1 4.21Å; I57-L258 HydrophobicContact CD1-CD2 4.33Å; D58-L258 HydrophobicContact CB-CD2 3.97Å; D58-L258 HydrophobicContact CB-CG 4.44Å; W61-L258 HydrophobicContact CB-CD1 4.33Å; W61-L258 HydrophobicContact CD2-CD1 4.11Å; W61-L258 HydrophobicContact CG-CD1 3.98Å; W61-L258 HydrophobicContact CG-CG 4.22Å; L119-L258 HydrophobicContact CD1-CD1 4.15Å; L119-L258 HydrophobicContact CD2-CD1 4.25Å; I254-L258 HydrophobicContact CG2-CD1 3.88Å; I254-L258 HydrophobicContact CG2-CD2 4.21Å; I254-L258 VanDerWaalsContact O-CD1 3.28Å; I254-L258 WeakPolarHBondContact O-CD1 3.48Å; I254-L258 PolarHBondContact O-N 3.46Å; K255-L258 PolarHBondContact O-N 2.85Å
259	A	80.3	Confident	79.1	Confident	56 Å²	56	87.1 Å²	87.1	46%	0.463	48%	0.483	S	S	.	.	S	Bend	trans	-60.2	134.8	173.7	0	0	0	0	0	109.9	K255 N257	K255-A259 PolarHBondContact O-N 2.97Å; N257-A259 VanDerWaalsContact C-N 3.32Å
260	P	61.4	Low	78.2	Confident	104 Å²	104	87.6 Å²	87.6	68%	0.675	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-57	142.8	172	14.3	-17.4	0	0	0	109	H262	P260-H262 PolarHBondContact O-N 3.16Å
261	P	54.5	Low	77.1	Confident	116 Å²	116	93.8 Å²	93.8	75%	0.753	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-52.4	135.5	165.6	23.7	-30.8	0	0	0	107.2	T263	P261-T263 PolarHBondContact O-N 2.82Å
262	H	47.6	Very low	75.8	Confident	181 Å²	181	98.5 Å²	98.5	84%	0.838	56%	0.556	S	S	*	*			trans	-41.3	115.6	179.3	-69.2	-72	0	0	0	108.9	P260 N264	P260-H262 PolarHBondContact O-N 3.16Å; H262-N264 PolarHBondContact O-N 2.87Å
263	T	44	Very low	74.4	Confident	131 Å²	131	98.6 Å²	98.6	80%	0.804	55%	0.553	S	S	*	*			trans	-63.4	105	174.9	44.2	0	0	0	0	106.5	P261	P261-T263 PolarHBondContact O-N 2.82Å
264	N	39.6	Very low	72.5	Confident	225 Å²	225	105.3 Å²	105.3	100%	1.203	59%	0.594	S	S	*	*			trans	-82	0	159.2	-72.8	-13.2	0	0	0	108.5	H262	H262-N264 PolarHBondContact O-N 2.87Å

Retrieved 264 of 264 residues in 73.2 ms (Link to these results)

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