A0A087XJA3_POEFO Loading...

Arginase

AlphaFold DB , UniProt , Accession A0A087XJA3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 346 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	S	39.7	Very low	41.7	Very low	172 Å²	172	144 Å²	144	100%	1.203	84%	0.836	S	S	*	*				0	86	0	177.2	0	0	0	0	108.7
2	V	35.9	Very low	41.4	Very low	150 Å²	150	143 Å²	143	91%	0.909	82%	0.817	S	S	*	*			trans	-135.6	96.9	169.8	-177.7	0	0	0	0	105.4
3	G	34	Very low	41.5	Very low	69 Å²	69	141.3 Å²	141.3	71%	0.711	80%	0.803	S	S	*	*			trans	-79.4	123.6	-177	0	0	0	0	0	111.3	K5	G3-K5 PolarHBondContact O-N 3.04Å
4	M	38.8	Very low	41.4	Very low	193 Å²	193	138.3 Å²	138.3	95%	0.951	80%	0.795	S	S	*	*			trans	-55.1	118.3	166	-77.1	166.3	56.3	0	0	110.1
5	K	40	Very low	41.5	Very low	210 Å²	210	139.7 Å²	139.7	91%	0.913	80%	0.798	S	S	*	*			trans	-99.7	114	168.9	-81.5	-174.6	176.2	-179.5	0	110	G3	G3-K5 PolarHBondContact O-N 3.04Å
6	G	39.5	Very low	41.3	Very low	70 Å²	70	138.6 Å²	138.6	72%	0.722	80%	0.795	S	S	*	*			trans	89.6	72.3	138.5	0	0	0	0	0	118	R8	G6-R8 PolarHBondContact O-N 2.66Å
7	A	44.1	Very low	41	Very low	106 Å²	106	137.4 Å²	137.4	88%	0.876	79%	0.79	S	S	*	*			trans	-71.5	105.8	151.8	0	0	0	0	0	108	T9	A7-T9 PolarHBondContact O-N 2.81Å
8	R	42.9	Very low	40.7	Very low	198 Å²	198	140.4 Å²	140.4	75%	0.747	79%	0.793	S	S	*	*			trans	-74.5	118.8	168.8	-72.6	-178.3	177.9	178.9	-1.1	107.7	G6	G6-R8 PolarHBondContact O-N 2.66Å
9	T	52.8	Low	40.5	Very low	87 Å²	87	144.8 Å²	144.8	53%	0.534	80%	0.795	S	S	.	*			trans	-59.5	138.2	171.1	37.1	0	0	0	0	110.3	A7 Q11 Q12	A7-T9 PolarHBondContact O-N 2.81Å; T9-Q11 PolarHBondContact O-N 2.91Å; T9-Q12 PolarHBondContact O-N 3.39Å
10	L	49.1	Very low	40.5	Very low	157 Å²	157	142.5 Å²	142.5	82%	0.822	79%	0.79	S	S	*	*	G	3₁₀ helix	trans	-49.6	-25.7	179.7	-84.4	156.3	0	0	0	114	Q12 L13	L10-Q12 PolarHBondContact O-N 3.3Å; L10-L13 PolarHBondContact O-N 3.28Å
11	Q	42.3	Very low	40.7	Very low	172 Å²	172	140.1 Å²	140.1	80%	0.804	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-61.1	-22.1	173.5	-83	176.9	-21.4	0	0	114.8	T9	T9-Q11 PolarHBondContact O-N 2.91Å
12	Q	38.2	Very low	40.9	Very low	132 Å²	132	136.6 Å²	136.6	62%	0.617	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-89.8	-5.1	-178.9	-78.4	-175.9	-15.6	0	0	114.3	T9 L10	T9-Q12 PolarHBondContact O-N 3.39Å; L10-Q12 PolarHBondContact O-N 3.3Å
13	L	41.9	Very low	41.2	Very low	121 Å²	121	137.4 Å²	137.4	63%	0.634	73%	0.733	S	S	*	*	S	Bend	trans	-93.1	-2.3	179.9	-77.8	163.1	0	0	0	113.9	L10 L15	L10-L13 PolarHBondContact O-N 3.28Å; L13-L15 VanDerWaalsContact C-N 3.34Å; L13-L15 PolarHBondContact O-N 3.42Å
14	S	41.1	Very low	41.8	Very low	99 Å²	99	136.5 Å²	136.5	69%	0.692	71%	0.71	S	S	*	*			trans	-88.7	13.6	-174.6	77	0	0	0	0	115.3
15	L	42.8	Very low	42.1	Very low	159 Å²	159	132.2 Å²	132.2	83%	0.832	70%	0.697	S	S	*	*			trans	-107.6	75.3	-177.6	-77	164.8	0	0	0	111.1	L13	L13-L15 VanDerWaalsContact C-N 3.34Å; L13-L15 PolarHBondContact O-N 3.42Å
16	T	38	Very low	42.5	Very low	122 Å²	122	127.8 Å²	127.8	75%	0.748	69%	0.69	S	S	*	*			trans	-136.3	110.5	169.2	-48.4	0	0	0	0	111
17	V	35.9	Very low	43.1	Very low	119 Å²	119	127 Å²	127	72%	0.721	67%	0.672	S	S	*	*			trans	44.7	81.3	155.6	-166.1	0	0	0	0	117	R19	V17-R19 HydrophobicContact CG1-CG 4.2Å; V17-R19 PolarHBondContact O-N 3.26Å
18	K	35.4	Very low	43.5	Very low	191 Å²	191	126.6 Å²	126.6	83%	0.83	66%	0.66	S	S	*	*			trans	-75.9	90.1	152.8	-74.7	-176.4	177.7	-179.6	0	108.8	S20	K18-S20 PolarHBondContact O-N 3.07Å
19	R	36.3	Very low	44	Very low	224 Å²	224	126.1 Å²	126.1	85%	0.845	67%	0.672	S	S	*	*			trans	-72.2	115.1	153.4	-89.9	-175.2	174.6	-177.3	-0.7	106.4	V17 L21	V17-R19 HydrophobicContact CG1-CG 4.2Å; V17-R19 PolarHBondContact O-N 3.26Å; R19-L21 PolarHBondContact O-N 3Å
20	S	41	Very low	44.6	Very low	98 Å²	98	128.9 Å²	128.9	69%	0.685	68%	0.678	S	S	*	*			trans	-58.4	92	-176.3	170	0	0	0	0	111.5	K18	K18-S20 PolarHBondContact O-N 3.07Å
21	L	45.9	Very low	46.3	Very low	93 Å²	93	124.1 Å²	124.1	49%	0.487	65%	0.65	S	S	.	*			trans	-69.7	129.4	140.7	-68.7	163.7	0	0	0	105.4	R19 H23	R19-L21 PolarHBondContact O-N 3Å; L21-H23 PolarHBondContact O-N 3.5Å
22	H	43.5	Very low	48.8	Very low	98 Å²	98	117.7 Å²	117.7	45%	0.454	62%	0.623	S	S	.	*			trans	-30	129.1	-172.7	-61.2	-81.6	0	0	0	113.4	H24 D242	H22-H24 VanDerWaalsContact C-N 3.27Å; H22-H24 PolarHBondContact O-CD2 3.35Å; H22-H24 PolarHBondContact O-N 3.4Å; H22-D242 IonicContact NE2-OD1 3.64Å
23	H	41.5	Very low	51.6	Low	167 Å²	167	111.4 Å²	111.4	77%	0.773	59%	0.594	S	S	*	*			trans	-59.6	89.8	174.6	-98.8	19.2	0	0	0	110	L21	L21-H23 PolarHBondContact O-N 3.5Å
24	H	47.8	Very low	54.3	Low	50 Å²	50	105.6 Å²	105.6	23%	0.231	56%	0.564	C	S	.	*	P	Polyproline II helix	trans	-83.5	134.1	166.1	-67.5	-81.2	0	0	0	107.9	H22 W245 T292	H22-H24 VanDerWaalsContact C-N 3.27Å; H22-H24 PolarHBondContact O-CD2 3.35Å; H22-H24 PolarHBondContact O-N 3.4Å; H24-W245 AromaticContact CE1-CH2 3.35Å; H24-W245 WeakPolarHBondContact CE1-CH2 3.38Å; H24-W245 AromaticContact CE1-CZ2 3.78Å; H24-W245 AromaticContact CE1-CZ3 3.96Å; H24-W245 AromaticContact NE2-CH2 3.43Å; H24-W245 WeakPolarHBondContact NE2-CH2 3.4Å; H24-W245 AromaticContact NE2-CZ3 3.91Å; H24-T292 PolarHBondContact ND1-O 3.15Å; H24-T292 VanDerWaalsContact ND1-O 3.17Å
25	P	43.3	Very low	57.1	Low	104 Å²	104	100.9 Å²	100.9	68%	0.675	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-56.4	146.1	167.9	24.6	-31.1	0	0	0	108.8
26	P	49.2	Very low	59.7	Low	117 Å²	117	93.4 Å²	93.4	76%	0.76	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-55.7	139.1	176.7	23.3	-31.8	0	0	0	109.3
27	P	53.1	Low	62.6	Low	54 Å²	54	87.6 Å²	87.6	35%	0.351	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-56	150.2	177.5	21.4	-30.4	0	0	0	110.3	Y290	P27-Y290 HydrophobicContact CG-CE1 4.5Å; P27-Y290 WeakPolarHBondContact CG-OH 3.31Å
28	P	52	Low	65.6	Low	96 Å²	96	81.9 Å²	81.9	62%	0.623	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-55.3	146.2	-174	20	-31	0	0	0	112.4	Q30	P28-Q30 PolarHBondContact O-N 3.02Å
29	L	53.4	Low	68.6	Low	188 Å²	188	74.5 Å²	74.5	98%	0.984	39%	0.393	S	S	*	.	S	Bend	trans	-54.9	-23.8	-173.8	-88.5	132.3	0	0	0	114.5
30	Q	64.4	Low	71.6	Confident	145 Å²	145	64.1 Å²	64.1	68%	0.678	35%	0.354	S	S	*	.	S	Bend	trans	-131.6	109.7	174.2	-162.1	171	24.3	0	0	110.4	P28 A71	P28-Q30 PolarHBondContact O-N 3.02Å; Q30-A71 HydrophobicContact CG-CB 4.3Å
31	R	84.9	Confident	74.3	Confident	58 Å²	58	59.9 Å²	59.9	22%	0.219	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	128.5	176.7	-73.7	161.7	-81.5	156	2.2	108.6	Q68 C70 A71 F329	R31-Q68 VanDerWaalsContact CZ-O 3.25Å; R31-Q68 PolarHBondContact NH1-O 3.39Å; R31-Q68 VanDerWaalsContact NH1-O 3.16Å; R31-Q68 PolarHBondContact NH2-O 3.1Å; R31-C70 CarbonylContact O-C 3.51Å; R31-C70 VanDerWaalsContact O-CA 3.29Å; R31-C70 WeakPolarHBondContact O-CA 3.23Å; R31-A71 PolarHBondContact O-N 3.25Å; R31-F329 PolarHBondContact NH1-O 3Å
32	S	94.3	Very high	76.8	Confident	36 Å²	36	58.7 Å²	58.7	25%	0.252	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	129.6	-178.6	-158.5	0	0	0	0	112.1	A71 H117 T118	S32-A71 WeakPolarHBondContact CA-O 3.4Å; S32-A71 PolarHBondContact OG-O 3.09Å; S32-H117 PolarHBondContact OG-CE1 2.84Å; S32-H117 VanDerWaalsContact OG-CE1 3.3Å; S32-H117 PolarHBondContact OG-ND1 3.49Å; S32-T118 PolarHBondContact O-N 2.97Å
33	V	98.1	Very high	79.4	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	125.5	-169.1	-172.2	0	0	0	0	109.3	I35 L65 C70 A71 V72 K73 V120 F329	V33-I35 HydrophobicContact CG1-CG1 4.12Å; V33-L65 HydrophobicContact CG1-CD1 4.46Å; V33-C70 HydrophobicContact CG2-CB 3.93Å; V33-A71 PolarHBondContact N-O 3.15Å; V33-V72 WeakPolarHBondContact O-CA 3.34Å; V33-K73 PolarHBondContact O-N 3.49Å; V33-V120 HydrophobicContact CG1-CB 4.31Å; V33-V120 HydrophobicContact CG1-CG2 3.54Å; V33-F329 HydrophobicContact CB-CE1 4.41Å; V33-F329 HydrophobicContact CG1-CE1 4.17Å; V33-F329 HydrophobicContact CG1-CE2 4.19Å; V33-F329 HydrophobicContact CG1-CZ 3.86Å; V33-F329 HydrophobicContact CG2-CD1 3.52Å; V33-F329 HydrophobicContact CG2-CE1 3.46Å; V33-F329 VanDerWaalsContact CG2-CE1 3.46Å; V33-F329 HydrophobicContact CG2-CE2 4.48Å; V33-F329 HydrophobicContact CG2-CG 4.08Å; V33-F329 HydrophobicContact CG2-CZ 3.99Å
34	G	98.7	Very high	82	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	112.4	174.6	0	0	0	0	0	109.8	K73 T118 V120	G34-K73 CarbonylContact C-O 3.57Å; G34-K73 WeakPolarHBondContact CA-O 3.23Å; G34-T118 PolarHBondContact N-O 3.03Å; G34-V120 PolarHBondContact O-N 3.37Å
35	I	98.9	Very high	84.3	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	128.5	-176.7	-65.3	169	0	0	0	109.6	V33 L62 L65 V72 K73 Y75 V120 L122	V33-I35 HydrophobicContact CG1-CG1 4.12Å; I35-L62 HydrophobicContact CD1-CD1 3.57Å; I35-L62 HydrophobicContact CD1-CG 3.76Å; I35-L65 HydrophobicContact CD1-CD1 3.88Å; I35-V72 HydrophobicContact CD1-CG1 3.79Å; I35-K73 PolarHBondContact N-O 3.05Å; I35-Y75 WeakPolarHBondContact O-CB 3.44Å; I35-Y75 PolarHBondContact O-N 2.84Å; I35-V120 CarbonylContact C-O 3.56Å; I35-V120 WeakPolarHBondContact CA-O 3.39Å; I35-V120 HydrophobicContact CG1-CB 4.2Å; I35-L122 HydrophobicContact CG2-CD1 3.67Å; I35-L122 HydrophobicContact CG2-CG 3.96Å
36	I	98.9	Very high	86.8	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	127.6	170.9	-55.5	166.5	0	0	0	107	L78 L105 A108 V109 V112 V120 I121 L122	I36-L78 HydrophobicContact CG2-CD1 3.86Å; I36-L78 HydrophobicContact CG2-CD2 4.41Å; I36-L78 HydrophobicContact CG2-CG 3.8Å; I36-L105 HydrophobicContact CG2-CD1 4.2Å; I36-A108 HydrophobicContact CD1-CB 3.97Å; I36-V109 HydrophobicContact CD1-CB 4.5Å; I36-V109 HydrophobicContact CD1-CG2 3.75Å; I36-V112 HydrophobicContact CD1-CB 4.46Å; I36-V112 HydrophobicContact CD1-CG2 3.6Å; I36-V112 HydrophobicContact CG1-CG2 3.74Å; I36-V120 PolarHBondContact N-O 3.04Å; I36-I121 WeakPolarHBondContact O-CA 3.32Å; I36-L122 PolarHBondContact O-N 3.02Å
37	G	98.9	Very high	89	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	131.9	164.9	0	0	0	0	0	110.7	P39 G76 N77 L78	G37-P39 VanDerWaalsContact C-CD 3.46Å; G37-P39 WeakPolarHBondContact O-CD 3.15Å; G37-G76 PolarHBondContact N-O 2.91Å; G37-N77 WeakPolarHBondContact CA-OD1 3.38Å; G37-N77 CarbonylContact O-C 3.56Å; G37-N77 WeakPolarHBondContact O-CA 3.39Å; G37-L78 PolarHBondContact O-N 3.26Å
38	A	98.8	Very high	91.1	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.23	C	C	.	.			trans	-121.9	73.1	179	0	0	0	0	0	110.1	F40 F80 L105 I121 L122 G123 G124 L128	A38-F40 PolarHBondContact O-N 3.5Å; A38-F80 HydrophobicContact CB-CE2 4.14Å; A38-F80 HydrophobicContact CB-CZ 4.05Å; A38-L105 HydrophobicContact CB-CD1 4.42Å; A38-I121 HydrophobicContact CB-CG2 4.01Å; A38-L122 PolarHBondContact N-O 3.2Å; A38-G123 CarbonylContact O-C 3.48Å; A38-G124 PolarHBondContact O-N 2.85Å; A38-L128 HydrophobicContact CB-CD1 3.61Å; A38-L128 HydrophobicContact CB-CD2 4.29Å; A38-L128 WeakPolarHBondContact O-CD1 3.48Å
39	P	98.6	Very high	93.3	Very high	35 Å²	35	38.5 Å²	38.5	23%	0.227	20%	0.2	C	C	.	.			trans	-71.6	85.4	-177.5	31.9	-37	0	0	0	111.4	G37 E50 P53 N77 L78	G37-P39 VanDerWaalsContact C-CD 3.46Å; G37-P39 WeakPolarHBondContact O-CD 3.15Å; P39-E50 HydrophobicContact CB-CB 4.02Å; P39-E50 WeakPolarHBondContact CB-O 3.4Å; P39-P53 HydrophobicContact CB-CG 4.13Å; P39-N77 HydrophobicContact CG-CB 4.12Å; P39-L78 WeakPolarHBondContact CG-O 3.2Å
40	F	98.6	Very high	95.5	Very high	7 Å²	7	32.3 Å²	32.3	3%	0.031	17%	0.166	C	C	.	.			trans	-137.1	136.8	-173.1	-174.9	-99.8	0	0	0	112	A38 K42 V49 F80 T97 V98 A101 G124 D125 L128	A38-F40 PolarHBondContact O-N 3.5Å; F40-K42 HydrophobicContact CE1-CB 4.21Å; F40-K42 HydrophobicContact CE2-CB 4.03Å; F40-K42 HydrophobicContact CE2-CG 4.4Å; F40-K42 HydrophobicContact CZ-CB 3.63Å; F40-K42 HydrophobicContact CZ-CG 4.47Å; F40-V49 WeakPolarHBondContact O-CG2 3.36Å; F40-F80 HydrophobicContact CB-CD2 3.84Å; F40-F80 HydrophobicContact CB-CE2 3.82Å; F40-F80 HydrophobicContact CD2-CB 4.09Å; F40-F80 AromaticContact CD2-CD2 3.97Å; F40-F80 HydrophobicContact CD2-CD2 3.97Å; F40-F80 HydrophobicContact CD2-CG 4.03Å; F40-F80 HydrophobicContact CG-CD2 4.36Å; F40-T97 HydrophobicContact CE2-CG2 3.78Å; F40-T97 HydrophobicContact CZ-CG2 4.09Å; F40-V98 HydrophobicContact CE1-CB 4.5Å; F40-V98 HydrophobicContact CE1-CG2 3.88Å; F40-V98 HydrophobicContact CZ-CB 4.2Å; F40-V98 HydrophobicContact CZ-CG2 3.67Å; F40-A101 HydrophobicContact CD2-CB 3.7Å; F40-A101 HydrophobicContact CE2-CB 3.46Å; F40-A101 VanDerWaalsContact CE2-CB 3.46Å; F40-A101 HydrophobicContact CG-CB 4.37Å; F40-A101 HydrophobicContact CZ-CB 3.95Å; F40-G124 CarbonylContact O-C 3.59Å; F40-G124 VanDerWaalsContact O-CA 3.26Å; F40-G124 WeakPolarHBondContact O-CA 3.44Å; F40-D125 WeakPolarHBondContact CD1-OD2 3.47Å; F40-D125 PolarHBondContact O-N 3.22Å; F40-L128 HydrophobicContact CB-CD1 4.12Å; F40-L128 HydrophobicContact CB-CD2 3.85Å; F40-L128 HydrophobicContact CB-CG 4.27Å; F40-L128 HydrophobicContact CD1-CD2 3.97Å; F40-L128 HydrophobicContact CD1-CG 4.25Å; F40-L128 HydrophobicContact CG-CD2 4.04Å
41	S	97.9	Very high	97.1	Very high	9 Å²	9	27.6 Å²	27.6	6%	0.063	15%	0.149	C	C	.	.			trans	-130.8	-2.6	-176.1	67	0	0	0	0	115.1	G43 Q44 D47 V49 E50 D125	S41-G43 VanDerWaalsContact C-N 3.27Å; S41-G43 PolarHBondContact O-N 2.92Å; S41-Q44 PolarHBondContact O-N 2.7Å; S41-Q44 PolarHBondContact O-NE2 2.88Å; S41-Q44 VanDerWaalsContact O-O 3.12Å; S41-D47 PolarHBondContact OG-OD1 2.86Å; S41-V49 VanDerWaalsContact CB-CG2 3.48Å; S41-E50 WeakPolarHBondContact CB-OE2 3.33Å; S41-D125 WeakPolarHBondContact CA-OD2 3.27Å
42	K	97.9	Very high	97.7	Very high	67 Å²	67	24.9 Å²	24.9	29%	0.291	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	0.2	-169.4	-56.2	-53.5	178.6	-159.9	0	114.2	F40 Q44 D47 S94 T97 D125	F40-K42 HydrophobicContact CE1-CB 4.21Å; F40-K42 HydrophobicContact CE2-CB 4.03Å; F40-K42 HydrophobicContact CE2-CG 4.4Å; F40-K42 HydrophobicContact CZ-CB 3.63Å; F40-K42 HydrophobicContact CZ-CG 4.47Å; K42-Q44 PolarHBondContact O-N 3.19Å; K42-D47 IonicContact NZ-OD1 3.71Å; K42-D47 PolarHBondContact NZ-OD1 3.17Å; K42-S94 VanDerWaalsContact O-CB 3.28Å; K42-S94 WeakPolarHBondContact O-CB 3.35Å; K42-S94 PolarHBondContact O-OG 2.88Å; K42-T97 HydrophobicContact CB-CG2 3.91Å; K42-T97 HydrophobicContact CG-CG2 3.99Å; K42-D125 PolarHBondContact N-OD2 2.75Å
43	G	97.8	Very high	97.9	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.01	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-13.3	166.3	0	0	0	0	0	112.9	S41 D125 N164 I165 H166	S41-G43 VanDerWaalsContact C-N 3.27Å; S41-G43 PolarHBondContact O-N 2.92Å; G43-D125 WeakPolarHBondContact CA-OD2 3.26Å; G43-D125 PolarHBondContact N-OD2 3.48Å; G43-N164 CarbonylContact O-C 2.93Å; G43-N164 VanDerWaalsContact O-C 3.25Å; G43-N164 WeakPolarHBondContact O-CA 3.25Å; G43-N164 WeakPolarHBondContact O-CB 3.38Å; G43-I165 PolarHBondContact O-N 2.94Å; G43-H166 PolarHBondContact O-N 2.86Å
44	Q	97.3	Very high	97.9	Very high	16 Å²	16	27.4 Å²	27.4	8%	0.075	15%	0.15	C	C	.	.	S	Bend	trans	-147.9	-175.3	-177.6	53.6	74.9	54.1	0	0	112.3	S41 K42 K46 D125 N164 H166	S41-Q44 PolarHBondContact O-N 2.7Å; S41-Q44 PolarHBondContact O-NE2 2.88Å; S41-Q44 VanDerWaalsContact O-O 3.12Å; K42-Q44 PolarHBondContact O-N 3.19Å; Q44-K46 VanDerWaalsContact CD-O 3.25Å; Q44-K46 PolarHBondContact NE2-O 2.75Å; Q44-K46 VanDerWaalsContact OE1-CA 3.26Å; Q44-K46 PolarHBondContact OE1-O 3.08Å; Q44-D125 HydrophobicContact CG-CB 3.63Å; Q44-N164 HydrophobicContact CB-CB 4.42Å; Q44-H166 HydrophobicContact CB-CB 4.23Å; Q44-H166 HydrophobicContact CG-CB 4.38Å
45	S	94.6	Very high	97.9	Very high	85 Å²	85	31.9 Å²	31.9	59%	0.594	17%	0.169	S	C	*	.	S	Bend	trans	-100.6	-10.3	-168.8	56.6	0	0	0	0	115.7
46	K	95.8	Very high	97.9	Very high	81 Å²	81	31.9 Å²	31.9	35%	0.352	17%	0.169	S	C	.	.			trans	-105.7	106.6	-176.1	-55.6	172.1	-178.2	177.1	0	109.9	Q44 G270	Q44-K46 VanDerWaalsContact CD-O 3.25Å; Q44-K46 PolarHBondContact NE2-O 2.75Å; Q44-K46 VanDerWaalsContact OE1-CA 3.26Å; Q44-K46 PolarHBondContact OE1-O 3.08Å; K46-G270 PolarHBondContact NZ-O 3.09Å
47	D	96.3	Very high	97.9	Very high	80 Å²	80	33.9 Å²	33.9	43%	0.428	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	168.6	171.1	-61.4	-50.9	0	0	0	111.6	S41 K42 N304	S41-D47 PolarHBondContact OG-OD1 2.86Å; K42-D47 IonicContact NZ-OD1 3.71Å; K42-D47 PolarHBondContact NZ-OD1 3.17Å; D47-N304 PolarHBondContact O-ND2 2.82Å
48	G	97.6	Very high	97.9	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	108.7	-23.4	177.1	0	0	0	0	0	115.1	E50 C51 N304 L306	G48-E50 WeakPolarHBondContact CA-OE2 3.44Å; G48-E50 VanDerWaalsContact N-CD 3.26Å; G48-E50 PolarHBondContact N-OE1 2.63Å; G48-E50 VanDerWaalsContact N-OE1 3.14Å; G48-E50 PolarHBondContact N-OE2 3.19Å; G48-E50 PolarHBondContact O-N 2.73Å; G48-C51 VanDerWaalsContact O-CB 3.25Å; G48-C51 WeakPolarHBondContact O-CB 3.48Å; G48-C51 PolarHBondContact O-N 3.33Å; G48-N304 VanDerWaalsContact CA-OD1 3.31Å; G48-N304 WeakPolarHBondContact CA-OD1 3.46Å; G48-L306 VanDerWaalsContact CA-CD1 3.49Å
49	V	98.3	Very high	97.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-61.4	-30.5	172.7	-71.9	0	0	0	0	111.7	F40 S41 C51 A52 G124 D125 E302 N304	F40-V49 WeakPolarHBondContact O-CG2 3.36Å; S41-V49 VanDerWaalsContact CB-CG2 3.48Å; V49-C51 PolarHBondContact O-N 3.4Å; V49-C51 VanDerWaalsContact O-N 3.07Å; V49-A52 VanDerWaalsContact O-CB 3.32Å; V49-A52 WeakPolarHBondContact O-CB 3.38Å; V49-A52 PolarHBondContact O-N 3.49Å; V49-G124 WeakPolarHBondContact O-CA 3.29Å; V49-D125 HydrophobicContact CG2-CB 4.22Å; V49-E302 WeakPolarHBondContact CG1-OE2 3.27Å; V49-N304 HydrophobicContact CG1-CB 3.68Å; V49-N304 PolarHBondContact N-ND2 2.89Å
50	E	98.3	Very high	97.9	Very high	57 Å²	57	38.4 Å²	38.4	27%	0.266	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-63.3	-14.3	175.1	70.5	-80.5	-174.1	0	0	113.6	P39 S41 G48 P53	P39-E50 HydrophobicContact CB-CB 4.02Å; P39-E50 WeakPolarHBondContact CB-O 3.4Å; S41-E50 WeakPolarHBondContact CB-OE2 3.33Å; G48-E50 WeakPolarHBondContact CA-OE2 3.44Å; G48-E50 VanDerWaalsContact N-CD 3.26Å; G48-E50 PolarHBondContact N-OE1 2.63Å; G48-E50 VanDerWaalsContact N-OE1 3.14Å; G48-E50 PolarHBondContact N-OE2 3.19Å; G48-E50 PolarHBondContact O-N 2.73Å; E50-P53 WeakPolarHBondContact O-CD 3.13Å
51	C	98.4	Very high	97.9	Very high	46 Å²	46	38.1 Å²	38.1	31%	0.311	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-80.6	-19.3	174.6	-64.4	0	0	0	0	113.3	G48 V49 P53 N54 K55 P305	G48-C51 VanDerWaalsContact O-CB 3.25Å; G48-C51 WeakPolarHBondContact O-CB 3.48Å; G48-C51 PolarHBondContact O-N 3.33Å; V49-C51 PolarHBondContact O-N 3.4Å; V49-C51 VanDerWaalsContact O-N 3.07Å; C51-P53 VanDerWaalsContact C-CD 3.49Å; C51-N54 PolarHBondContact O-N 2.81Å; C51-K55 PolarHBondContact O-N 2.72Å; C51-K55 VanDerWaalsContact O-N 3.11Å; C51-P305 HydrophobicContact CB-CG 4.14Å
52	A	98.3	Very high	97.9	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.008	22%	0.22	C	C	.	.	H	α-helix	trans	-57	-43.8	-174.5	0	0	0	0	0	114.8	V49 N54 K55 L56 G123 V303	V49-A52 VanDerWaalsContact O-CB 3.32Å; V49-A52 WeakPolarHBondContact O-CB 3.38Å; V49-A52 PolarHBondContact O-N 3.49Å; A52-N54 PolarHBondContact O-N 3.29Å; A52-K55 PolarHBondContact O-N 2.97Å; A52-K55 VanDerWaalsContact O-N 3.09Å; A52-L56 WeakPolarHBondContact O-CB 3.37Å; A52-L56 WeakPolarHBondContact O-CG 3.45Å; A52-L56 PolarHBondContact O-N 3.04Å; A52-G123 WeakPolarHBondContact CB-O 3.44Å; A52-V303 HydrophobicContact CB-CB 3.8Å; A52-V303 HydrophobicContact CB-CG1 4.05Å; A52-V303 WeakPolarHBondContact CB-O 3.22Å
53	P	98.8	Very high	97.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59.3	-36.8	-177.4	-24.6	35.1	0	0	0	112.6	P39 E50 C51 R57 N77 L122 G123	P39-P53 HydrophobicContact CB-CG 4.13Å; E50-P53 WeakPolarHBondContact O-CD 3.13Å; C51-P53 VanDerWaalsContact C-CD 3.49Å; P53-R57 VanDerWaalsContact O-CG 3.28Å; P53-R57 WeakPolarHBondContact O-CG 3.44Å; P53-R57 PolarHBondContact O-N 2.94Å; P53-R57 PolarHBondContact O-NH1 3.21Å; P53-R57 VanDerWaalsContact O-NH1 3.14Å; P53-N77 WeakPolarHBondContact CB-OD1 3.34Å; P53-L122 HydrophobicContact CB-CB 4.14Å; P53-L122 HydrophobicContact CG-CB 4.48Å; P53-L122 WeakPolarHBondContact CG-O 3.47Å; P53-G123 VanDerWaalsContact CD-O 3.29Å; P53-G123 WeakPolarHBondContact CD-O 3.21Å; P53-G123 WeakPolarHBondContact CG-O 3.43Å
54	N	98.6	Very high	97.9	Very high	90 Å²	90	43.6 Å²	43.6	48%	0.481	24%	0.242	S	C	.	.	H	α-helix	trans	-77.5	-38.4	177.7	-70.3	-21.4	0	0	0	111.8	C51 A52 R57 A58 N77	C51-N54 PolarHBondContact O-N 2.81Å; A52-N54 PolarHBondContact O-N 3.29Å; N54-R57 PolarHBondContact O-N 2.95Å; N54-A58 VanDerWaalsContact O-CB 3.29Å; N54-A58 WeakPolarHBondContact O-CB 3.44Å; N54-A58 PolarHBondContact O-N 2.92Å; N54-N77 PolarHBondContact OD1-ND2 3.32Å
55	K	98.4	Very high	97.9	Very high	93 Å²	93	42.9 Å²	42.9	40%	0.404	24%	0.239	S	C	.	.	H	α-helix	trans	-65.6	-41.9	177.9	-74.9	-74.7	-172.5	170.1	0	112.3	C51 A52 A58 A59 P305 V318	C51-K55 PolarHBondContact O-N 2.72Å; C51-K55 VanDerWaalsContact O-N 3.11Å; A52-K55 PolarHBondContact O-N 2.97Å; A52-K55 VanDerWaalsContact O-N 3.09Å; K55-A58 PolarHBondContact O-N 3.41Å; K55-A59 WeakPolarHBondContact O-CB 3.17Å; K55-A59 PolarHBondContact O-N 2.82Å; K55-P305 HydrophobicContact CB-CG 4.28Å; K55-P305 HydrophobicContact CG-CB 4.38Å; K55-P305 HydrophobicContact CG-CG 3.76Å; K55-V318 HydrophobicContact CB-CG2 4.35Å
56	L	98.8	Very high	97.9	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.1	-39.8	175.9	-67.5	168.8	0	0	0	111.7	A52 A59 L61 L122 M300 V318 A321 V322	A52-L56 WeakPolarHBondContact O-CB 3.37Å; A52-L56 WeakPolarHBondContact O-CG 3.45Å; A52-L56 PolarHBondContact O-N 3.04Å; L56-A59 PolarHBondContact O-N 2.75Å; L56-L61 VanDerWaalsContact O-CB 3.29Å; L56-L61 WeakPolarHBondContact O-CB 3.26Å; L56-L61 PolarHBondContact O-N 3.46Å; L56-L122 HydrophobicContact CB-CD1 4.3Å; L56-L122 HydrophobicContact CD1-CB 4.21Å; L56-L122 HydrophobicContact CD1-CD2 4.09Å; L56-M300 HydrophobicContact CD1-CG 4.36Å; L56-V318 HydrophobicContact CD2-CG1 4.2Å; L56-A321 HydrophobicContact CD2-CB 3.64Å; L56-V322 HydrophobicContact CD2-CG2 3.97Å
57	R	98.8	Very high	97.8	Very high	43 Å²	43	47.9 Å²	47.9	16%	0.162	25%	0.25	C	C	.	.	H	α-helix	trans	-62.8	-48.3	171.7	-75.8	-173.5	-178.5	90.4	-9.8	112.1	P53 N54 A59 G60 L62 D74 G76 N77 L122	P53-R57 VanDerWaalsContact O-CG 3.28Å; P53-R57 WeakPolarHBondContact O-CG 3.44Å; P53-R57 PolarHBondContact O-N 2.94Å; P53-R57 PolarHBondContact O-NH1 3.21Å; P53-R57 VanDerWaalsContact O-NH1 3.14Å; N54-R57 PolarHBondContact O-N 2.95Å; R57-A59 PolarHBondContact O-N 3.27Å; R57-G60 WeakPolarHBondContact O-CA 3.5Å; R57-G60 PolarHBondContact O-N 3.09Å; R57-L62 HydrophobicContact CG-CD1 3.84Å; R57-D74 IonicContact CZ-OD1 2.64Å; R57-D74 IonicContact CZ-OD2 3.87Å; R57-D74 IonicContact NE-OD1 3.66Å; R57-D74 IonicContact NE-OD2 3.15Å; R57-D74 PolarHBondContact NE-OD2 3.39Å; R57-D74 IonicContact NH2-OD1 3.96Å; R57-D74 PolarHBondContact NH2-OD1 3.42Å; R57-D74 IonicContact NH2-OD2 3.3Å; R57-G76 VanDerWaalsContact NH2-C 3.31Å; R57-G76 PolarHBondContact NH2-O 2.86Å; R57-N77 PolarHBondContact NH1-OD1 3.31Å; R57-L122 HydrophobicContact CG-CD1 4.36Å
58	A	98.5	Very high	97.5	Very high	89 Å²	89	45.7 Å²	45.7	74%	0.736	24%	0.237	S	C	*	.	H	α-helix	trans	-63.3	-27.1	179.5	0	0	0	0	0	112.8	N54 K55 G60	N54-A58 VanDerWaalsContact O-CB 3.29Å; N54-A58 WeakPolarHBondContact O-CB 3.44Å; N54-A58 PolarHBondContact O-N 2.92Å; K55-A58 PolarHBondContact O-N 3.41Å; A58-G60 PolarHBondContact O-N 3.05Å
59	A	98.4	Very high	97.2	Very high	25 Å²	25	47.5 Å²	47.5	21%	0.207	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	1.5	170.8	0	0	0	0	0	113.6	K55 L56 R57 R64 V318 V322	K55-A59 WeakPolarHBondContact O-CB 3.17Å; K55-A59 PolarHBondContact O-N 2.82Å; L56-A59 PolarHBondContact O-N 2.75Å; R57-A59 PolarHBondContact O-N 3.27Å; A59-R64 PolarHBondContact O-NE 2.87Å; A59-R64 PolarHBondContact O-NH2 3.29Å; A59-V318 HydrophobicContact CB-CG1 3.59Å; A59-V322 HydrophobicContact CB-CG2 4Å
60	G	98.4	Very high	97	Very high	17 Å²	17	47.9 Å²	47.9	18%	0.175	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	85	20.1	173.7	0	0	0	0	0	114.5	R57 A58 L62 D63 R64	R57-G60 WeakPolarHBondContact O-CA 3.5Å; R57-G60 PolarHBondContact O-N 3.09Å; A58-G60 PolarHBondContact O-N 3.05Å; G60-L62 VanDerWaalsContact C-N 3.3Å; G60-L62 PolarHBondContact O-N 3.34Å; G60-D63 PolarHBondContact O-N 3.44Å; G60-R64 VanDerWaalsContact O-CG 3.28Å; G60-R64 WeakPolarHBondContact O-CG 3.44Å; G60-R64 PolarHBondContact O-N 2.83Å
61	L	98.7	Very high	96.9	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-49.3	-49.3	179.8	173.8	62.7	0	0	0	112.5	L56 D63 R64 L65 L122 V322 L325	L56-L61 VanDerWaalsContact O-CB 3.29Å; L56-L61 WeakPolarHBondContact O-CB 3.26Å; L56-L61 PolarHBondContact O-N 3.46Å; L61-D63 PolarHBondContact O-N 2.73Å; L61-R64 PolarHBondContact O-N 3.49Å; L61-L65 HydrophobicContact CD1-CD1 3.87Å; L61-L65 HydrophobicContact CD1-CG 4.15Å; L61-L65 HydrophobicContact CG-CD1 3.95Å; L61-L65 WeakPolarHBondContact O-CG 3.5Å; L61-L65 PolarHBondContact O-N 2.94Å; L61-L122 HydrophobicContact CD2-CD1 3.92Å; L61-L122 HydrophobicContact CD2-CD2 3.72Å; L61-L122 HydrophobicContact CD2-CG 4.47Å; L61-V322 HydrophobicContact CB-CG2 4.31Å; L61-V322 HydrophobicContact CD1-CG1 4.28Å; L61-L325 HydrophobicContact CD1-CB 3.88Å; L61-L325 HydrophobicContact CD1-CD1 3.96Å; L61-L325 HydrophobicContact CD2-CD1 3.7Å
62	L	98.4	Very high	96.9	Very high	21 Å²	21	45.7 Å²	45.7	11%	0.11	25%	0.25	C	C	.	.	H	α-helix	trans	-64.1	-43.9	-175.3	-81.7	61.8	0	0	0	111.9	I35 R57 G60 L65 R66 V72 D74	I35-L62 HydrophobicContact CD1-CD1 3.57Å; I35-L62 HydrophobicContact CD1-CG 3.76Å; R57-L62 HydrophobicContact CG-CD1 3.84Å; G60-L62 VanDerWaalsContact C-N 3.3Å; G60-L62 PolarHBondContact O-N 3.34Å; L62-L65 PolarHBondContact O-N 3.24Å; L62-R66 WeakPolarHBondContact O-CG 3.39Å; L62-R66 PolarHBondContact O-N 2.9Å; L62-V72 HydrophobicContact CG-CG1 4.17Å; L62-D74 HydrophobicContact CD2-CB 3.92Å; L62-D74 WeakPolarHBondContact CD2-OD2 3.45Å
63	D	98	Very high	96.9	Very high	87 Å²	87	49.6 Å²	49.6	47%	0.465	27%	0.267	S	S	.	.	H	α-helix	trans	-69.5	-39.3	-178.2	-65.7	-27.5	0	0	0	111.2	G60 L61 R66 Q67	G60-D63 PolarHBondContact O-N 3.44Å; L61-D63 PolarHBondContact O-N 2.73Å; D63-R66 WeakPolarHBondContact O-CB 3.46Å; D63-R66 PolarHBondContact O-N 2.82Å; D63-R66 IonicContact OD1-NH1 2.82Å; D63-R66 PolarHBondContact OD1-NH1 3.06Å; D63-Q67 WeakPolarHBondContact O-CB 3.28Å; D63-Q67 VanDerWaalsContact O-CG 3.23Å; D63-Q67 WeakPolarHBondContact O-CG 3.28Å; D63-Q67 PolarHBondContact O-N 2.84Å
64	R	97.4	Very high	96.9	Very high	84 Å²	84	52.5 Å²	52.5	32%	0.317	28%	0.283	S	S	.	.	H	α-helix	trans	-64.3	-40.6	174.6	-65	177.7	-152.5	-156	10.6	111.7	A59 G60 L61 R66 Q67 Q68 L326	A59-R64 PolarHBondContact O-NE 2.87Å; A59-R64 PolarHBondContact O-NH2 3.29Å; G60-R64 VanDerWaalsContact O-CG 3.28Å; G60-R64 WeakPolarHBondContact O-CG 3.44Å; G60-R64 PolarHBondContact O-N 2.83Å; L61-R64 PolarHBondContact O-N 3.49Å; R64-R66 VanDerWaalsContact C-N 3.35Å; R64-R66 PolarHBondContact O-N 3.37Å; R64-Q67 PolarHBondContact O-N 2.86Å; R64-Q68 WeakPolarHBondContact O-CG 3.34Å; R64-Q68 PolarHBondContact O-N 2.82Å; R64-L326 HydrophobicContact CB-CD1 3.99Å; R64-L326 HydrophobicContact CB-CD2 3.57Å; R64-L326 HydrophobicContact CB-CG 4.43Å; R64-L326 HydrophobicContact CG-CD1 4.5Å
65	L	96.9	Very high	96.9	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-61.6	-41.6	173.5	-74.4	167.7	0	0	0	111.9	V33 I35 L61 L62 Q68 C70 V72 L326 F329	V33-L65 HydrophobicContact CG1-CD1 4.46Å; I35-L65 HydrophobicContact CD1-CD1 3.88Å; L61-L65 HydrophobicContact CD1-CD1 3.87Å; L61-L65 HydrophobicContact CD1-CG 4.15Å; L61-L65 HydrophobicContact CG-CD1 3.95Å; L61-L65 WeakPolarHBondContact O-CG 3.5Å; L61-L65 PolarHBondContact O-N 2.94Å; L62-L65 PolarHBondContact O-N 3.24Å; L65-Q68 WeakPolarHBondContact O-CB 3.43Å; L65-Q68 PolarHBondContact O-N 2.81Å; L65-C70 HydrophobicContact CB-CB 4.42Å; L65-C70 VanDerWaalsContact O-CB 3.23Å; L65-C70 WeakPolarHBondContact O-CB 3.5Å; L65-C70 PolarHBondContact O-N 3.27Å; L65-C70 VanDerWaalsContact O-N 3.08Å; L65-C70 PolarHBondContact O-SG 2.73Å; L65-V72 HydrophobicContact CB-CG2 3.62Å; L65-L326 HydrophobicContact CD2-CD2 3.95Å; L65-L326 HydrophobicContact CG-CD2 3.97Å; L65-F329 HydrophobicContact CD2-CB 3.81Å; L65-F329 HydrophobicContact CD2-CD2 3.49Å; L65-F329 VanDerWaalsContact CD2-CD2 3.49Å; L65-F329 HydrophobicContact CD2-CE2 4.4Å; L65-F329 HydrophobicContact CD2-CG 3.84Å
66	R	95.7	Very high	96.9	Very high	117 Å²	117	48.5 Å²	48.5	44%	0.442	27%	0.267	S	S	.	.	H	α-helix	trans	-63.7	-42.1	174.5	-70.6	173.3	-173.1	127.4	0.9	112	L62 D63 R64 Q68 G69 V72	L62-R66 WeakPolarHBondContact O-CG 3.39Å; L62-R66 PolarHBondContact O-N 2.9Å; D63-R66 WeakPolarHBondContact O-CB 3.46Å; D63-R66 PolarHBondContact O-N 2.82Å; D63-R66 IonicContact OD1-NH1 2.82Å; D63-R66 PolarHBondContact OD1-NH1 3.06Å; R64-R66 VanDerWaalsContact C-N 3.35Å; R64-R66 PolarHBondContact O-N 3.37Å; R66-Q68 PolarHBondContact O-N 2.83Å; R66-G69 WeakPolarHBondContact O-CA 3.49Å; R66-G69 PolarHBondContact O-N 3.01Å; R66-V72 HydrophobicContact CG-CB 4.09Å; R66-V72 HydrophobicContact CG-CG2 3.86Å
67	Q	92.6	Very high	96.9	Very high	155 Å²	155	51.3 Å²	51.3	72%	0.724	28%	0.282	S	S	*	.	H	α-helix	trans	-61.9	-29.5	176.1	-72.5	166.2	8.9	0	0	112.3	D63 R64 G69	D63-Q67 WeakPolarHBondContact O-CB 3.28Å; D63-Q67 VanDerWaalsContact O-CG 3.23Å; D63-Q67 WeakPolarHBondContact O-CG 3.28Å; D63-Q67 PolarHBondContact O-N 2.84Å; R64-Q67 PolarHBondContact O-N 2.86Å; Q67-G69 PolarHBondContact O-N 2.87Å
68	Q	90.6	Very high	96.9	Very high	34 Å²	34	50.7 Å²	50.7	16%	0.159	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-2.7	171.2	-66.1	176.5	-69.9	0	0	113.9	R31 R64 L65 R66 L326 R331	R31-Q68 VanDerWaalsContact CZ-O 3.25Å; R31-Q68 PolarHBondContact NH1-O 3.39Å; R31-Q68 VanDerWaalsContact NH1-O 3.16Å; R31-Q68 PolarHBondContact NH2-O 3.1Å; R64-Q68 WeakPolarHBondContact O-CG 3.34Å; R64-Q68 PolarHBondContact O-N 2.82Å; L65-Q68 WeakPolarHBondContact O-CB 3.43Å; L65-Q68 PolarHBondContact O-N 2.81Å; R66-Q68 PolarHBondContact O-N 2.83Å; Q68-L326 PolarHBondContact NE2-O 2.78Å; Q68-R331 VanDerWaalsContact NE2-CA 3.27Å
69	G	91.1	Very high	96.9	Very high	37 Å²	37	51 Å²	51	38%	0.381	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	17.7	-178	0	0	0	0	0	114.4	R66 Q67	R66-G69 WeakPolarHBondContact O-CA 3.49Å; R66-G69 PolarHBondContact O-N 3.01Å; Q67-G69 PolarHBondContact O-N 2.87Å
70	C	94.5	Very high	96.8	Very high	8 Å²	8	51.6 Å²	51.6	5%	0.054	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	135.3	175	-57.7	0	0	0	0	111.3	R31 V33 L65 V72	R31-C70 CarbonylContact O-C 3.51Å; R31-C70 VanDerWaalsContact O-CA 3.29Å; R31-C70 WeakPolarHBondContact O-CA 3.23Å; V33-C70 HydrophobicContact CG2-CB 3.93Å; L65-C70 HydrophobicContact CB-CB 4.42Å; L65-C70 VanDerWaalsContact O-CB 3.23Å; L65-C70 WeakPolarHBondContact O-CB 3.5Å; L65-C70 PolarHBondContact O-N 3.27Å; L65-C70 VanDerWaalsContact O-N 3.08Å; L65-C70 PolarHBondContact O-SG 2.73Å; C70-V72 HydrophobicContact CB-CG2 3.98Å; C70-V72 PolarHBondContact O-N 3.24Å; C70-V72 VanDerWaalsContact O-N 3.17Å
71	A	96.2	Very high	96.4	Very high	33 Å²	33	58.1 Å²	58.1	27%	0.273	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	96.2	163.5	0	0	0	0	0	109	Q30 R31 S32 V33	Q30-A71 HydrophobicContact CG-CB 4.3Å; R31-A71 PolarHBondContact O-N 3.25Å; S32-A71 WeakPolarHBondContact CA-O 3.4Å; S32-A71 PolarHBondContact OG-O 3.09Å; V33-A71 PolarHBondContact N-O 3.15Å
72	V	98.1	Very high	95.9	Very high	24 Å²	24	63.1 Å²	63.1	15%	0.145	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	125.1	-175.6	-179.4	0	0	0	0	111.1	V33 I35 L62 L65 R66 C70	V33-V72 WeakPolarHBondContact O-CA 3.34Å; I35-V72 HydrophobicContact CD1-CG1 3.79Å; L62-V72 HydrophobicContact CG-CG1 4.17Å; L65-V72 HydrophobicContact CB-CG2 3.62Å; R66-V72 HydrophobicContact CG-CB 4.09Å; R66-V72 HydrophobicContact CG-CG2 3.86Å; C70-V72 HydrophobicContact CB-CG2 3.98Å; C70-V72 PolarHBondContact O-N 3.24Å; C70-V72 VanDerWaalsContact O-N 3.17Å
73	K	98.6	Very high	95.5	Very high	84 Å²	84	64.4 Å²	64.4	37%	0.365	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	120.4	167.2	-176.1	174.2	171.2	-172	0	109.4	V33 G34 I35 Y75 D115	V33-K73 PolarHBondContact O-N 3.49Å; G34-K73 CarbonylContact C-O 3.57Å; G34-K73 WeakPolarHBondContact CA-O 3.23Å; I35-K73 PolarHBondContact N-O 3.05Å; K73-Y75 HydrophobicContact CB-CE2 4Å; K73-Y75 HydrophobicContact CD-CE1 4.42Å; K73-Y75 HydrophobicContact CD-CE2 3.61Å; K73-Y75 WeakPolarHBondContact CD-OH 3.37Å; K73-Y75 VanDerWaalsContact CE-OH 3.31Å; K73-Y75 WeakPolarHBondContact CE-OH 3.47Å; K73-Y75 HydrophobicContact CG-CD2 4.11Å; K73-Y75 HydrophobicContact CG-CE2 3.58Å; K73-Y75 PolarHBondContact NZ-OH 3.17Å; K73-D115 IonicContact NZ-OD2 2.66Å; K73-D115 PolarHBondContact NZ-OD2 2.92Å
74	D	98.7	Very high	95	Very high	61 Å²	61	64.3 Å²	64.3	33%	0.326	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	119.3	174.5	-169.1	-4	0	0	0	109.4	R57 L62 G76	R57-D74 IonicContact CZ-OD1 2.64Å; R57-D74 IonicContact CZ-OD2 3.87Å; R57-D74 IonicContact NE-OD1 3.66Å; R57-D74 IonicContact NE-OD2 3.15Å; R57-D74 PolarHBondContact NE-OD2 3.39Å; R57-D74 IonicContact NH2-OD1 3.96Å; R57-D74 PolarHBondContact NH2-OD1 3.42Å; R57-D74 IonicContact NH2-OD2 3.3Å; L62-D74 HydrophobicContact CD2-CB 3.92Å; L62-D74 WeakPolarHBondContact CD2-OD2 3.45Å; D74-G76 WeakPolarHBondContact OD1-CA 3.12Å; D74-G76 PolarHBondContact OD1-N 2.84Å
75	Y	98.8	Very high	94.4	Very high	72 Å²	72	67.8 Å²	67.8	28%	0.282	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	2.3	176.8	-70.5	-106	0	0	0	111.9	I35 K73 V112 D115 H117	I35-Y75 WeakPolarHBondContact O-CB 3.44Å; I35-Y75 PolarHBondContact O-N 2.84Å; K73-Y75 HydrophobicContact CB-CE2 4Å; K73-Y75 HydrophobicContact CD-CE1 4.42Å; K73-Y75 HydrophobicContact CD-CE2 3.61Å; K73-Y75 WeakPolarHBondContact CD-OH 3.37Å; K73-Y75 VanDerWaalsContact CE-OH 3.31Å; K73-Y75 WeakPolarHBondContact CE-OH 3.47Å; K73-Y75 HydrophobicContact CG-CD2 4.11Å; K73-Y75 HydrophobicContact CG-CE2 3.58Å; K73-Y75 PolarHBondContact NZ-OH 3.17Å; Y75-V112 HydrophobicContact CD1-CG2 4.04Å; Y75-V112 HydrophobicContact CD2-CG2 3.72Å; Y75-V112 HydrophobicContact CE1-CG2 3.93Å; Y75-V112 HydrophobicContact CE2-CB 4.45Å; Y75-V112 HydrophobicContact CE2-CG1 4.4Å; Y75-V112 HydrophobicContact CE2-CG2 3.63Å; Y75-V112 HydrophobicContact CG-CG2 3.94Å; Y75-D115 WeakPolarHBondContact OH-CB 3.36Å; Y75-D115 PolarHBondContact OH-OD2 3.05Å; Y75-H117 PolarHBondContact OH-CD2 3.37Å; Y75-H117 VanDerWaalsContact OH-CD2 3.22Å; Y75-H117 PolarHBondContact OH-NE2 3.43Å
76	G	98.7	Very high	94.2	Very high	27 Å²	27	68.8 Å²	68.8	28%	0.278	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	78.2	-165.3	179.5	0	0	0	0	0	112.7	G37 R57 D74	G37-G76 PolarHBondContact N-O 2.91Å; R57-G76 VanDerWaalsContact NH2-C 3.31Å; R57-G76 PolarHBondContact NH2-O 2.86Å; D74-G76 WeakPolarHBondContact OD1-CA 3.12Å; D74-G76 PolarHBondContact OD1-N 2.84Å
77	N	98.8	Very high	94.1	Very high	58 Å²	58	69 Å²	69	31%	0.31	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	135.3	173.2	-69.7	-21.6	0	0	0	109.9	G37 P39 P53 N54 R57	G37-N77 WeakPolarHBondContact CA-OD1 3.38Å; G37-N77 CarbonylContact O-C 3.56Å; G37-N77 WeakPolarHBondContact O-CA 3.39Å; P39-N77 HydrophobicContact CG-CB 4.12Å; P53-N77 WeakPolarHBondContact CB-OD1 3.34Å; N54-N77 PolarHBondContact OD1-ND2 3.32Å; R57-N77 PolarHBondContact NH1-OD1 3.31Å
78	L	98.6	Very high	94.1	Very high	30 Å²	30	65.2 Å²	65.2	16%	0.157	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-66.9	147.6	165.4	-62.4	179.6	0	0	0	110.1	I36 G37 P39 F80 L105 A108	I36-L78 HydrophobicContact CG2-CD1 3.86Å; I36-L78 HydrophobicContact CG2-CD2 4.41Å; I36-L78 HydrophobicContact CG2-CG 3.8Å; G37-L78 PolarHBondContact O-N 3.26Å; P39-L78 WeakPolarHBondContact CG-O 3.2Å; L78-F80 HydrophobicContact CB-CE1 3.93Å; L78-F80 HydrophobicContact CB-CE2 4.04Å; L78-F80 HydrophobicContact CB-CZ 3.61Å; L78-F80 HydrophobicContact CD1-CE1 4.02Å; L78-F80 HydrophobicContact CD1-CZ 3.8Å; L78-F80 HydrophobicContact CG-CZ 4.34Å; L78-L105 HydrophobicContact CD1-CB 4.17Å; L78-L105 HydrophobicContact CD1-CD1 3.81Å; L78-A108 HydrophobicContact CD1-CB 3.94Å; L78-A108 HydrophobicContact CD2-CB 3.9Å; L78-A108 HydrophobicContact CG-CB 4.47Å
79	T	97.8	Very high	94.3	Very high	96 Å²	96	64.9 Å²	64.9	59%	0.589	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-98.6	128.9	168.5	-48.8	0	0	0	0	108.3	R104	T79-R104 VanDerWaalsContact O-CD 3.28Å; T79-R104 WeakPolarHBondContact O-CD 3.28Å; T79-R104 PolarHBondContact O-NE 3.26Å; T79-R104 PolarHBondContact O-NH1 3.32Å
80	F	96.1	Very high	94.2	Very high	38 Å²	38	66.8 Å²	66.8	17%	0.167	37%	0.371	C	S	.	.			trans	-111.8	129.3	176.1	-58	-64.1	0	0	0	109.4	A38 F40 L78 A101 R104 L128	A38-F80 HydrophobicContact CB-CE2 4.14Å; A38-F80 HydrophobicContact CB-CZ 4.05Å; F40-F80 HydrophobicContact CB-CD2 3.84Å; F40-F80 HydrophobicContact CB-CE2 3.82Å; F40-F80 HydrophobicContact CD2-CB 4.09Å; F40-F80 AromaticContact CD2-CD2 3.97Å; F40-F80 HydrophobicContact CD2-CD2 3.97Å; F40-F80 HydrophobicContact CD2-CG 4.03Å; F40-F80 HydrophobicContact CG-CD2 4.36Å; L78-F80 HydrophobicContact CB-CE1 3.93Å; L78-F80 HydrophobicContact CB-CE2 4.04Å; L78-F80 HydrophobicContact CB-CZ 3.61Å; L78-F80 HydrophobicContact CD1-CE1 4.02Å; L78-F80 HydrophobicContact CD1-CZ 3.8Å; L78-F80 HydrophobicContact CG-CZ 4.34Å; F80-A101 HydrophobicContact CB-CB 4.38Å; F80-A101 HydrophobicContact CD1-CB 3.5Å; F80-A101 VanDerWaalsContact CD1-CB 3.5Å; F80-A101 HydrophobicContact CE1-CB 3.88Å; F80-A101 WeakPolarHBondContact CE1-O 3.36Å; F80-A101 HydrophobicContact CG-CB 4Å; F80-R104 HydrophobicContact CE1-CB 4.43Å; F80-L128 HydrophobicContact CZ-CD2 4.4Å
81	E	90.6	Very high	93.8	Very high	154 Å²	154	69 Å²	69	72%	0.72	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-83.6	136	173.9	-68.5	174.5	-164.6	0	0	108.7
82	N	88.6	Confident	93.8	Very high	105 Å²	105	67.5 Å²	67.5	56%	0.561	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-92.5	128.5	172.4	-171.4	27.4	0	0	0	109.1	A84 T97	N82-A84 PolarHBondContact O-N 3.06Å; N82-T97 PolarHBondContact OD1-OG1 3.48Å
83	V	89.3	Confident	93.7	Very high	48 Å²	48	70.5 Å²	70.5	29%	0.291	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-73.3	120.1	170.6	-179.4	0	0	0	0	108.1	L85 D86 R96 T97	V83-L85 PolarHBondContact O-N 3.47Å; V83-D86 HydrophobicContact CB-CB 4.24Å; V83-D86 HydrophobicContact CG1-CB 4.37Å; V83-R96 HydrophobicContact CB-CB 4.24Å; V83-R96 HydrophobicContact CG1-CB 4.28Å; V83-R96 HydrophobicContact CG2-CB 3.89Å; V83-T97 WeakPolarHBondContact CB-OG1 3.25Å; V83-T97 PolarHBondContact N-OG1 2.9Å
84	A	86.6	Confident	93.6	Very high	85 Å²	85	67.9 Å²	67.9	70%	0.702	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	133.9	176.2	0	0	0	0	0	110.2	N82	N82-A84 PolarHBondContact O-N 3.06Å
85	L	84.9	Confident	93.5	Very high	156 Å²	156	65 Å²	65	82%	0.817	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	52	179.6	-56.7	171.8	0	0	0	112.7	V83 E87	V83-L85 PolarHBondContact O-N 3.47Å; L85-E87 VanDerWaalsContact C-N 3.27Å; L85-E87 PolarHBondContact O-N 3.49Å
86	D	92.8	Very high	93.5	Very high	22 Å²	22	65.1 Å²	65.1	12%	0.118	37%	0.371	C	S	.	.			trans	-75.3	78.5	177.1	-165.4	7.4	0	0	0	111.6	V83 S94 V95 R96 T97	V83-D86 HydrophobicContact CB-CB 4.24Å; V83-D86 HydrophobicContact CG1-CB 4.37Å; D86-S94 WeakPolarHBondContact OD2-CA 3.36Å; D86-V95 PolarHBondContact OD2-N 2.84Å; D86-R96 WeakPolarHBondContact OD1-CB 3.41Å; D86-R96 VanDerWaalsContact OD1-CD 3.3Å; D86-R96 WeakPolarHBondContact OD1-CD 3.43Å; D86-R96 VanDerWaalsContact OD1-CG 3.24Å; D86-R96 WeakPolarHBondContact OD1-CG 3.35Å; D86-R96 IonicContact OD1-CZ 3.76Å; D86-R96 PolarHBondContact OD1-N 3.16Å; D86-R96 IonicContact OD1-NE 2.83Å; D86-R96 IonicContact OD1-NH1 3.11Å; D86-R96 PolarHBondContact OD1-NH1 3.11Å; D86-R96 WeakPolarHBondContact OD2-CA 3.36Å; D86-R96 WeakPolarHBondContact OD2-CB 3.36Å; D86-R96 PolarHBondContact OD2-N 2.83Å; D86-T97 PolarHBondContact OD2-N 3.47Å; D86-T97 PolarHBondContact OD2-OG1 3.33Å
87	E	93.3	Very high	93.4	Very high	123 Å²	123	63.9 Å²	63.9	58%	0.575	36%	0.358	S	S	*	.			trans	-58.3	140.8	-179.5	-67.9	-57.9	144	0	0	112	L85 R96	L85-E87 VanDerWaalsContact C-N 3.27Å; L85-E87 PolarHBondContact O-N 3.49Å; E87-R96 PolarHBondContact O-NH1 3.46Å
88	P	93.9	Very high	93.4	Very high	75 Å²	75	61.1 Å²	61.1	49%	0.487	34%	0.343	S	S	.	.			trans	-54.4	142.2	-179.8	-26.6	34.5	0	0	0	113.6	S92 K93	P88-S92 CarbonylContact C-O 3.25Å; P88-S92 WeakPolarHBondContact CA-O 3.46Å; P88-S92 WeakPolarHBondContact CB-O 3.2Å; P88-K93 HydrophobicContact CG-CG 4.47Å
89	V	93.8	Very high	93.4	Very high	26 Å²	26	59.7 Å²	59.7	16%	0.158	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-123.1	121.7	177.6	-177.2	0	0	0	0	108.6	G91 S92 V95 L184 P185	V89-G91 PolarHBondContact O-N 3.25Å; V89-S92 PolarHBondContact N-O 3.12Å; V89-S92 PolarHBondContact O-N 3.43Å; V89-V95 HydrophobicContact CB-CB 4.43Å; V89-V95 HydrophobicContact CB-CG2 4.06Å; V89-V95 HydrophobicContact CG2-CB 4.47Å; V89-L184 HydrophobicContact CB-CD2 4.41Å; V89-L184 HydrophobicContact CG1-CD2 3.89Å; V89-P185 HydrophobicContact CG2-CG 4.07Å
90	N	88.5	Confident	93.4	Very high	78 Å²	78	57 Å²	57	42%	0.417	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	42.3	-177.3	-57.9	-42.1	0	0	0	112.7	S92 L158 P182	N90-S92 PolarHBondContact O-N 3.05Å; N90-L158 HydrophobicContact CB-CD2 4.21Å; N90-P182 HydrophobicContact CB-CG 4.24Å; N90-P182 WeakPolarHBondContact ND2-CB 3.07Å; N90-P182 WeakPolarHBondContact ND2-CG 3.49Å
91	G	88.1	Confident	93.5	Very high	55 Å²	55	55.3 Å²	55.3	57%	0.567	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	-16.2	-178.7	0	0	0	0	0	115.2	V89 G163	V89-G91 PolarHBondContact O-N 3.25Å; G91-G163 WeakPolarHBondContact O-CA 3.28Å
92	S	94.9	Very high	93.9	Very high	0 Å²	0	48 Å²	48	0%	0	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-84.9	138.2	178.3	-64.5	0	0	0	0	112.2	P88 V89 N90 V95 G163 Q168	P88-S92 CarbonylContact C-O 3.25Å; P88-S92 WeakPolarHBondContact CA-O 3.46Å; P88-S92 WeakPolarHBondContact CB-O 3.2Å; V89-S92 PolarHBondContact N-O 3.12Å; V89-S92 PolarHBondContact O-N 3.43Å; N90-S92 PolarHBondContact O-N 3.05Å; S92-V95 VanDerWaalsContact O-CG2 3.32Å; S92-V95 WeakPolarHBondContact O-CG2 3.37Å; S92-G163 CarbonylContact C-O 3.37Å; S92-G163 WeakPolarHBondContact CA-O 3.36Å; S92-Q168 PolarHBondContact OG-NE2 2.84Å; S92-Q168 VanDerWaalsContact OG-NE2 3.14Å; S92-Q168 PolarHBondContact OG-OE1 3.27Å
93	K	96.1	Very high	94.4	Very high	88 Å²	88	46.9 Å²	46.9	38%	0.383	27%	0.271	S	S	.	.	S	Bend	trans	-93.3	152.6	-177.1	-59.6	170.5	-171.3	156.8	0	111	P88 V95 T162 G163 N164 I165	P88-K93 HydrophobicContact CG-CG 4.47Å; K93-V95 PolarHBondContact O-N 3.16Å; K93-V95 VanDerWaalsContact O-N 3.08Å; K93-T162 WeakPolarHBondContact CE-O 3.36Å; K93-T162 PolarHBondContact NZ-O 3.4Å; K93-G163 PolarHBondContact N-O 2.87Å; K93-N164 PolarHBondContact NZ-OD1 2.95Å; K93-N164 VanDerWaalsContact NZ-OD1 3.15Å; K93-I165 WeakPolarHBondContact O-CD1 3.48Å
94	S	96.5	Very high	94.8	Very high	29 Å²	29	50 Å²	50	20%	0.203	28%	0.277	C	S	.	.	S	Bend	trans	54.1	30.5	172.5	-48.7	0	0	0	0	114.5	K42 D86 R96 T97 V98	K42-S94 VanDerWaalsContact O-CB 3.28Å; K42-S94 WeakPolarHBondContact O-CB 3.35Å; K42-S94 PolarHBondContact O-OG 2.88Å; D86-S94 WeakPolarHBondContact OD2-CA 3.36Å; S94-R96 VanDerWaalsContact C-N 3.34Å; S94-R96 PolarHBondContact O-N 2.96Å; S94-T97 PolarHBondContact O-N 2.99Å; S94-V98 WeakPolarHBondContact O-CB 2.94Å; S94-V98 VanDerWaalsContact O-CG2 3.23Å; S94-V98 WeakPolarHBondContact O-CG2 3.41Å; S94-V98 PolarHBondContact O-N 2.91Å
95	V	97	Very high	95.4	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.4	-42.7	-170.3	177.6	0	0	0	0	111.7	D86 V89 S92 K93 G99 I165 L184 P185 F187	D86-V95 PolarHBondContact OD2-N 2.84Å; V89-V95 HydrophobicContact CB-CB 4.43Å; V89-V95 HydrophobicContact CB-CG2 4.06Å; V89-V95 HydrophobicContact CG2-CB 4.47Å; S92-V95 VanDerWaalsContact O-CG2 3.32Å; S92-V95 WeakPolarHBondContact O-CG2 3.37Å; K93-V95 PolarHBondContact O-N 3.16Å; K93-V95 VanDerWaalsContact O-N 3.08Å; V95-G99 PolarHBondContact O-N 2.8Å; V95-I165 HydrophobicContact CB-CD1 4.45Å; V95-I165 HydrophobicContact CG2-CD1 3.99Å; V95-L184 HydrophobicContact CG1-CB 3.97Å; V95-L184 HydrophobicContact CG1-CD2 4.08Å; V95-L184 HydrophobicContact CG1-CG 4.42Å; V95-P185 HydrophobicContact CG1-CG 4.07Å; V95-F187 HydrophobicContact CG1-CD2 3.96Å; V95-F187 HydrophobicContact CG1-CE2 3.7Å; V95-F187 VanDerWaalsContact O-CE2 3.25Å; V95-F187 WeakPolarHBondContact O-CE2 3.2Å
96	R	97.6	Very high	96.1	Very high	75 Å²	75	38.5 Å²	38.5	28%	0.283	21%	0.205	S	C	.	.	H	α-helix	trans	-69.9	-41.8	-177.9	-58.9	169.9	-176	76.6	-2	110.8	V83 D86 E87 S94 S100 P185 N186	V83-R96 HydrophobicContact CB-CB 4.24Å; V83-R96 HydrophobicContact CG1-CB 4.28Å; V83-R96 HydrophobicContact CG2-CB 3.89Å; D86-R96 WeakPolarHBondContact OD1-CB 3.41Å; D86-R96 VanDerWaalsContact OD1-CD 3.3Å; D86-R96 WeakPolarHBondContact OD1-CD 3.43Å; D86-R96 VanDerWaalsContact OD1-CG 3.24Å; D86-R96 WeakPolarHBondContact OD1-CG 3.35Å; D86-R96 IonicContact OD1-CZ 3.76Å; D86-R96 PolarHBondContact OD1-N 3.16Å; D86-R96 IonicContact OD1-NE 2.83Å; D86-R96 IonicContact OD1-NH1 3.11Å; D86-R96 PolarHBondContact OD1-NH1 3.11Å; D86-R96 WeakPolarHBondContact OD2-CA 3.36Å; D86-R96 WeakPolarHBondContact OD2-CB 3.36Å; D86-R96 PolarHBondContact OD2-N 2.83Å; E87-R96 PolarHBondContact O-NH1 3.46Å; S94-R96 VanDerWaalsContact C-N 3.34Å; S94-R96 PolarHBondContact O-N 2.96Å; R96-S100 WeakPolarHBondContact O-CB 3.46Å; R96-S100 PolarHBondContact O-N 3.26Å; R96-S100 PolarHBondContact O-OG 3.44Å; R96-P185 HydrophobicContact CG-CB 3.89Å; R96-P185 HydrophobicContact CG-CG 3.69Å; R96-N186 PolarHBondContact O-ND2 3.3Å
97	T	97.9	Very high	96.4	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-63	-48.1	176.7	-67.4	0	0	0	0	111.1	F40 K42 N82 V83 D86 S94 S100 A101	F40-T97 HydrophobicContact CE2-CG2 3.78Å; F40-T97 HydrophobicContact CZ-CG2 4.09Å; K42-T97 HydrophobicContact CB-CG2 3.91Å; K42-T97 HydrophobicContact CG-CG2 3.99Å; N82-T97 PolarHBondContact OD1-OG1 3.48Å; V83-T97 WeakPolarHBondContact CB-OG1 3.25Å; V83-T97 PolarHBondContact N-OG1 2.9Å; D86-T97 PolarHBondContact OD2-N 3.47Å; D86-T97 PolarHBondContact OD2-OG1 3.33Å; S94-T97 PolarHBondContact O-N 2.99Å; T97-S100 PolarHBondContact O-N 3.19Å; T97-A101 WeakPolarHBondContact O-CB 3.36Å; T97-A101 PolarHBondContact O-N 3.42Å
98	V	98.1	Very high	96.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.2	-43.7	178.2	176.9	0	0	0	0	111.6	F40 S94 S100 A101 N102 I165 F187	F40-V98 HydrophobicContact CE1-CB 4.5Å; F40-V98 HydrophobicContact CE1-CG2 3.88Å; F40-V98 HydrophobicContact CZ-CB 4.2Å; F40-V98 HydrophobicContact CZ-CG2 3.67Å; S94-V98 WeakPolarHBondContact O-CB 2.94Å; S94-V98 VanDerWaalsContact O-CG2 3.23Å; S94-V98 WeakPolarHBondContact O-CG2 3.41Å; S94-V98 PolarHBondContact O-N 2.91Å; V98-S100 PolarHBondContact O-N 3.17Å; V98-A101 PolarHBondContact O-N 2.82Å; V98-N102 WeakPolarHBondContact CG1-ND2 3.5Å; V98-N102 WeakPolarHBondContact O-CB 3.36Å; V98-N102 PolarHBondContact O-N 3.06Å; V98-N102 PolarHBondContact O-ND2 2.89Å; V98-I165 HydrophobicContact CB-CD1 3.96Å; V98-I165 HydrophobicContact CG1-CB 4.28Å; V98-I165 HydrophobicContact CG1-CD1 4.1Å; V98-I165 HydrophobicContact CG1-CG2 3.86Å; V98-I165 HydrophobicContact CG2-CB 4.48Å; V98-I165 HydrophobicContact CG2-CD1 4Å; V98-F187 HydrophobicContact CG1-CZ 4.16Å
99	G	98.1	Very high	96.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.4	-43.2	178.2	0	0	0	0	0	112.8	V95 Q103 N186 F187 W189	V95-G99 PolarHBondContact O-N 2.8Å; G99-Q103 PolarHBondContact O-N 3.4Å; G99-N186 CarbonylContact C-O 3.59Å; G99-N186 WeakPolarHBondContact CA-O 3.46Å; G99-F187 VanDerWaalsContact CA-CE2 3.5Å; G99-W189 PolarHBondContact O-NE1 3.09Å
100	S	98.2	Very high	97.1	Very high	38 Å²	38	35 Å²	35	27%	0.266	18%	0.182	S	C	.	.	H	α-helix	trans	-68.7	-41.4	178.9	-48.2	0	0	0	0	112.2	R96 T97 V98 Q103 R104 N186	R96-S100 WeakPolarHBondContact O-CB 3.46Å; R96-S100 PolarHBondContact O-N 3.26Å; R96-S100 PolarHBondContact O-OG 3.44Å; T97-S100 PolarHBondContact O-N 3.19Å; V98-S100 PolarHBondContact O-N 3.17Å; S100-Q103 PolarHBondContact O-N 2.87Å; S100-R104 PolarHBondContact O-N 2.63Å; S100-R104 VanDerWaalsContact O-N 3.15Å; S100-N186 PolarHBondContact OG-ND2 3.08Å
101	A	98.6	Very high	97.6	Very high	3 Å²	3	33 Å²	33	3%	0.025	18%	0.175	C	C	.	.	H	α-helix	trans	-61.9	-45.2	177.2	0	0	0	0	0	111.5	F40 F80 T97 V98 Q103 R104 L105	F40-A101 HydrophobicContact CD2-CB 3.7Å; F40-A101 HydrophobicContact CE2-CB 3.46Å; F40-A101 VanDerWaalsContact CE2-CB 3.46Å; F40-A101 HydrophobicContact CG-CB 4.37Å; F40-A101 HydrophobicContact CZ-CB 3.95Å; F80-A101 HydrophobicContact CB-CB 4.38Å; F80-A101 HydrophobicContact CD1-CB 3.5Å; F80-A101 VanDerWaalsContact CD1-CB 3.5Å; F80-A101 HydrophobicContact CE1-CB 3.88Å; F80-A101 WeakPolarHBondContact CE1-O 3.36Å; F80-A101 HydrophobicContact CG-CB 4Å; T97-A101 WeakPolarHBondContact O-CB 3.36Å; T97-A101 PolarHBondContact O-N 3.42Å; V98-A101 PolarHBondContact O-N 2.82Å; A101-Q103 PolarHBondContact O-N 2.94Å; A101-R104 PolarHBondContact O-N 3.17Å; A101-L105 PolarHBondContact O-N 3.16Å
102	N	98.8	Very high	98.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-68.3	-33.2	178.5	-84	-70.7	0	0	0	113.2	V98 R104 L105 S106 S127 L128 I130 G131 W189	V98-N102 WeakPolarHBondContact CG1-ND2 3.5Å; V98-N102 WeakPolarHBondContact O-CB 3.36Å; V98-N102 PolarHBondContact O-N 3.06Å; V98-N102 PolarHBondContact O-ND2 2.89Å; N102-R104 VanDerWaalsContact C-N 3.33Å; N102-R104 PolarHBondContact O-N 3.3Å; N102-L105 PolarHBondContact O-N 3.17Å; N102-S106 WeakPolarHBondContact O-CB 3.28Å; N102-S106 PolarHBondContact O-N 3.39Å; N102-S127 PolarHBondContact ND2-O 3.49Å; N102-S127 PolarHBondContact OD1-O 3.37Å; N102-S127 VanDerWaalsContact OD1-O 3.07Å; N102-L128 VanDerWaalsContact OD1-CA 3.25Å; N102-L128 WeakPolarHBondContact OD1-CA 3.38Å; N102-L128 PolarHBondContact OD1-O 3.41Å; N102-L128 VanDerWaalsContact OD1-O 3.12Å; N102-I130 HydrophobicContact CB-CB 4.27Å; N102-I130 HydrophobicContact CB-CG2 4.35Å; N102-G131 VanDerWaalsContact O-CA 3.28Å; N102-G131 WeakPolarHBondContact O-CA 3.47Å; N102-G131 WeakPolarHBondContact OD1-CA 3.07Å; N102-G131 PolarHBondContact OD1-N 3.14Å; N102-W189 VanDerWaalsContact C-CZ2 3.45Å; N102-W189 HydrophobicContact CB-CH2 3.93Å; N102-W189 HydrophobicContact CB-CZ2 3.72Å; N102-W189 WeakPolarHBondContact O-CH2 3.39Å
103	Q	98.7	Very high	98.2	Very high	83 Å²	83	31.8 Å²	31.8	39%	0.388	15%	0.154	S	C	.	.	H	α-helix	trans	-59.9	-47.7	171.8	-166.6	175.7	9.5	0	0	110.5	G99 S100 A101 S106 E107 W189	G99-Q103 PolarHBondContact O-N 3.4Å; S100-Q103 PolarHBondContact O-N 2.87Å; A101-Q103 PolarHBondContact O-N 2.94Å; Q103-S106 WeakPolarHBondContact O-CB 3.5Å; Q103-S106 PolarHBondContact O-N 3.09Å; Q103-E107 PolarHBondContact O-N 3.3Å; Q103-E107 VanDerWaalsContact O-N 3.12Å; Q103-W189 VanDerWaalsContact CA-CZ2 3.49Å; Q103-W189 HydrophobicContact CB-CD2 3.88Å; Q103-W189 HydrophobicContact CB-CG 4.1Å; Q103-W189 HydrophobicContact CB-CZ2 3.96Å; Q103-W189 HydrophobicContact CG-CB 4.28Å; Q103-W189 HydrophobicContact CG-CD2 3.75Å; Q103-W189 HydrophobicContact CG-CE3 4.36Å; Q103-W189 HydrophobicContact CG-CG 3.66Å
104	R	98.6	Very high	98.3	Very high	113 Å²	113	37.5 Å²	37.5	43%	0.426	17%	0.174	S	C	.	.	H	α-helix	trans	-64	-42.6	179.5	-169.3	173.6	-169.3	153.8	7.6	111.9	T79 F80 S100 A101 N102 S106 E107 A108	T79-R104 VanDerWaalsContact O-CD 3.28Å; T79-R104 WeakPolarHBondContact O-CD 3.28Å; T79-R104 PolarHBondContact O-NE 3.26Å; T79-R104 PolarHBondContact O-NH1 3.32Å; F80-R104 HydrophobicContact CE1-CB 4.43Å; S100-R104 PolarHBondContact O-N 2.63Å; S100-R104 VanDerWaalsContact O-N 3.15Å; A101-R104 PolarHBondContact O-N 3.17Å; N102-R104 VanDerWaalsContact C-N 3.33Å; N102-R104 PolarHBondContact O-N 3.3Å; R104-S106 VanDerWaalsContact C-N 3.32Å; R104-E107 PolarHBondContact O-N 3.35Å; R104-A108 PolarHBondContact O-N 2.81Å
105	L	98.9	Very high	98.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.1	-40.1	175.4	179.3	58.4	0	0	0	111.5	I36 A38 L78 A101 N102 E107 A108 V109 I121 L128	I36-L105 HydrophobicContact CG2-CD1 4.2Å; A38-L105 HydrophobicContact CB-CD1 4.42Å; L78-L105 HydrophobicContact CD1-CB 4.17Å; L78-L105 HydrophobicContact CD1-CD1 3.81Å; A101-L105 PolarHBondContact O-N 3.16Å; N102-L105 PolarHBondContact O-N 3.17Å; L105-E107 PolarHBondContact O-N 2.63Å; L105-A108 PolarHBondContact O-N 2.99Å; L105-V109 HydrophobicContact CD1-CG2 4.03Å; L105-V109 HydrophobicContact CG-CG2 4.4Å; L105-V109 WeakPolarHBondContact O-CG2 3.33Å; L105-V109 PolarHBondContact O-N 3.04Å; L105-I121 HydrophobicContact CD1-CG1 4.23Å; L105-I121 HydrophobicContact CD1-CG2 4.18Å; L105-I121 HydrophobicContact CD2-CG2 4.31Å; L105-L128 HydrophobicContact CD2-CB 3.77Å; L105-L128 HydrophobicContact CD2-CD2 3.9Å; L105-L128 HydrophobicContact CD2-CG 4.36Å; L105-L128 VanDerWaalsContact CD2-O 3.26Å; L105-L128 WeakPolarHBondContact CD2-O 3.34Å
106	S	98.9	Very high	98.3	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.9	-43.6	176.7	-171.3	0	0	0	0	112.6	N102 Q103 R104 K110 G131 H134 G135	N102-S106 WeakPolarHBondContact O-CB 3.28Å; N102-S106 PolarHBondContact O-N 3.39Å; Q103-S106 WeakPolarHBondContact O-CB 3.5Å; Q103-S106 PolarHBondContact O-N 3.09Å; R104-S106 VanDerWaalsContact C-N 3.32Å; S106-K110 WeakPolarHBondContact O-CE 3.26Å; S106-K110 WeakPolarHBondContact O-CG 3.28Å; S106-K110 PolarHBondContact O-N 2.82Å; S106-G131 WeakPolarHBondContact CA-O 3.29Å; S106-G131 WeakPolarHBondContact CB-O 3.44Å; S106-H134 PolarHBondContact OG-ND1 3.29Å; S106-G135 WeakPolarHBondContact O-CA 3.42Å; S106-G135 WeakPolarHBondContact OG-CA 3.46Å; S106-G135 PolarHBondContact OG-N 2.71Å
107	E	98.8	Very high	98.3	Very high	101 Å²	101	39.7 Å²	39.7	47%	0.472	20%	0.202	S	C	.	.	H	α-helix	trans	-63.8	-41.3	173.8	-63.3	-53.5	144.9	0	0	112.6	Q103 R104 L105 K110 A111	Q103-E107 PolarHBondContact O-N 3.3Å; Q103-E107 VanDerWaalsContact O-N 3.12Å; R104-E107 PolarHBondContact O-N 3.35Å; L105-E107 PolarHBondContact O-N 2.63Å; E107-K110 VanDerWaalsContact CD-CE 3.46Å; E107-K110 PolarHBondContact O-N 3.4Å; E107-K110 WeakPolarHBondContact OE1-CE 3.22Å; E107-K110 IonicContact OE1-NZ 2.63Å; E107-K110 PolarHBondContact OE1-NZ 3.14Å; E107-K110 WeakPolarHBondContact OE2-CE 3.39Å; E107-K110 IonicContact OE2-NZ 2.73Å; E107-K110 PolarHBondContact OE2-NZ 3.48Å; E107-A111 PolarHBondContact O-N 3.37Å
108	A	98.9	Very high	98.4	Very high	17 Å²	17	41 Å²	41	14%	0.14	21%	0.211	C	C	.	.	H	α-helix	trans	-63.8	-44.5	178.1	0	0	0	0	0	111.9	I36 L78 R104 L105 K110 A111 V112	I36-A108 HydrophobicContact CD1-CB 3.97Å; L78-A108 HydrophobicContact CD1-CB 3.94Å; L78-A108 HydrophobicContact CD2-CB 3.9Å; L78-A108 HydrophobicContact CG-CB 4.47Å; R104-A108 PolarHBondContact O-N 2.81Å; L105-A108 PolarHBondContact O-N 2.99Å; A108-K110 PolarHBondContact O-N 2.82Å; A108-A111 WeakPolarHBondContact O-CB 3.33Å; A108-A111 PolarHBondContact O-N 3.28Å; A108-V112 WeakPolarHBondContact O-CG2 3.48Å; A108-V112 PolarHBondContact O-N 2.89Å
109	V	98.9	Very high	98.4	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-63.6	-42.5	176.5	172.7	0	0	0	0	110.9	I36 L105 A111 V112 K113 A119 I121 H136	I36-V109 HydrophobicContact CD1-CB 4.5Å; I36-V109 HydrophobicContact CD1-CG2 3.75Å; L105-V109 HydrophobicContact CD1-CG2 4.03Å; L105-V109 HydrophobicContact CG-CG2 4.4Å; L105-V109 WeakPolarHBondContact O-CG2 3.33Å; L105-V109 PolarHBondContact O-N 3.04Å; V109-A111 VanDerWaalsContact C-N 3.28Å; V109-A111 PolarHBondContact O-N 3.28Å; V109-V112 PolarHBondContact O-N 3.43Å; V109-K113 HydrophobicContact CG1-CG 4.24Å; V109-K113 WeakPolarHBondContact O-CG 3.41Å; V109-K113 PolarHBondContact O-N 2.83Å; V109-A119 HydrophobicContact CG1-CB 4.33Å; V109-I121 HydrophobicContact CG2-CD1 3.9Å; V109-I121 HydrophobicContact CG2-CG1 3.96Å; V109-H136 HydrophobicContact CG1-CB 4.11Å
110	K	98.8	Very high	98.4	Very high	55 Å²	55	41.1 Å²	41.1	24%	0.239	21%	0.211	C	C	.	.	H	α-helix	trans	-56	-42.9	173.4	-79.5	-175.2	-77.7	170.6	0	112.2	S106 E107 A108 K113 R114 G135 A138 A139	S106-K110 WeakPolarHBondContact O-CE 3.26Å; S106-K110 WeakPolarHBondContact O-CG 3.28Å; S106-K110 PolarHBondContact O-N 2.82Å; E107-K110 VanDerWaalsContact CD-CE 3.46Å; E107-K110 PolarHBondContact O-N 3.4Å; E107-K110 WeakPolarHBondContact OE1-CE 3.22Å; E107-K110 IonicContact OE1-NZ 2.63Å; E107-K110 PolarHBondContact OE1-NZ 3.14Å; E107-K110 WeakPolarHBondContact OE2-CE 3.39Å; E107-K110 IonicContact OE2-NZ 2.73Å; E107-K110 PolarHBondContact OE2-NZ 3.48Å; A108-K110 PolarHBondContact O-N 2.82Å; K110-K113 PolarHBondContact O-N 2.71Å; K110-R114 WeakPolarHBondContact O-CB 3.26Å; K110-R114 PolarHBondContact O-N 3.04Å; K110-G135 VanDerWaalsContact CG-O 3.22Å; K110-G135 WeakPolarHBondContact CG-O 3.37Å; K110-A138 HydrophobicContact CD-CB 3.89Å; K110-A138 HydrophobicContact CG-CB 4.26Å; K110-A139 HydrophobicContact CG-CB 4.21Å
111	A	98.7	Very high	98.5	Very high	34 Å²	34	39.3 Å²	39.3	28%	0.281	20%	0.199	S	C	.	.	H	α-helix	trans	-62.2	-46.3	177.2	0	0	0	0	0	111.9	E107 A108 V109 K113 R114 D115	E107-A111 PolarHBondContact O-N 3.37Å; A108-A111 WeakPolarHBondContact O-CB 3.33Å; A108-A111 PolarHBondContact O-N 3.28Å; V109-A111 VanDerWaalsContact C-N 3.28Å; V109-A111 PolarHBondContact O-N 3.28Å; A111-K113 VanDerWaalsContact C-N 3.33Å; A111-K113 PolarHBondContact O-N 3.27Å; A111-R114 PolarHBondContact O-N 2.86Å; A111-D115 PolarHBondContact O-N 2.97Å; A111-D115 VanDerWaalsContact O-N 3.07Å
112	V	98.8	Very high	98.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60	-43.1	176.9	174.6	0	0	0	0	112	I36 Y75 A108 V109 D115 G116 H117 A119	I36-V112 HydrophobicContact CD1-CB 4.46Å; I36-V112 HydrophobicContact CD1-CG2 3.6Å; I36-V112 HydrophobicContact CG1-CG2 3.74Å; Y75-V112 HydrophobicContact CD1-CG2 4.04Å; Y75-V112 HydrophobicContact CD2-CG2 3.72Å; Y75-V112 HydrophobicContact CE1-CG2 3.93Å; Y75-V112 HydrophobicContact CE2-CB 4.45Å; Y75-V112 HydrophobicContact CE2-CG1 4.4Å; Y75-V112 HydrophobicContact CE2-CG2 3.63Å; Y75-V112 HydrophobicContact CG-CG2 3.94Å; A108-V112 WeakPolarHBondContact O-CG2 3.48Å; A108-V112 PolarHBondContact O-N 2.89Å; V109-V112 PolarHBondContact O-N 3.43Å; V112-D115 PolarHBondContact O-N 3.5Å; V112-G116 PolarHBondContact O-N 3.44Å; V112-H117 HydrophobicContact CG1-CB 3.8Å; V112-H117 PolarHBondContact O-N 3.01Å; V112-A119 HydrophobicContact CB-CB 4.38Å; V112-A119 HydrophobicContact CG1-CB 3.81Å
113	K	98.4	Very high	97.9	Very high	30 Å²	30	39.2 Å²	39.2	13%	0.13	20%	0.198	C	C	.	.	H	α-helix	trans	-67.7	-38.7	178.3	-66.3	-49.9	-57.4	175	0	112.2	V109 K110 A111 D115 G116 H117 A119 A139 V140 S296	V109-K113 HydrophobicContact CG1-CG 4.24Å; V109-K113 WeakPolarHBondContact O-CG 3.41Å; V109-K113 PolarHBondContact O-N 2.83Å; K110-K113 PolarHBondContact O-N 2.71Å; A111-K113 VanDerWaalsContact C-N 3.33Å; A111-K113 PolarHBondContact O-N 3.27Å; K113-D115 VanDerWaalsContact C-N 3.25Å; K113-D115 PolarHBondContact O-N 2.69Å; K113-G116 PolarHBondContact O-N 3.47Å; K113-H117 WeakPolarHBondContact CD-O 3.27Å; K113-H117 WeakPolarHBondContact CE-O 3.32Å; K113-H117 PolarHBondContact NZ-O 3.42Å; K113-A119 HydrophobicContact CD-CB 4.07Å; K113-A139 HydrophobicContact CB-CB 3.53Å; K113-A139 HydrophobicContact CG-CB 4.03Å; K113-V140 HydrophobicContact CB-CG1 4.35Å; K113-V140 HydrophobicContact CG-CG1 4.42Å; K113-S296 WeakPolarHBondContact CE-OG 3.38Å; K113-S296 PolarHBondContact NZ-O 3.45Å; K113-S296 PolarHBondContact NZ-OG 3.45Å
114	R	97	Very high	97.8	Very high	209 Å²	209	35.3 Å²	35.3	79%	0.789	18%	0.179	S	C	*	.	H	α-helix	trans	-62.7	-34.2	175.3	-171.2	-178.3	69.2	172.3	0.5	112.1	K110 A111 G116	K110-R114 WeakPolarHBondContact O-CB 3.26Å; K110-R114 PolarHBondContact O-N 3.04Å; A111-R114 PolarHBondContact O-N 2.86Å; R114-G116 PolarHBondContact O-N 3.01Å
115	D	97.4	Very high	97.8	Very high	66 Å²	66	29.9 Å²	29.9	35%	0.353	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	1.6	175.4	-71.6	11.8	0	0	0	112.7	K73 Y75 A111 V112 K113	K73-D115 IonicContact NZ-OD2 2.66Å; K73-D115 PolarHBondContact NZ-OD2 2.92Å; Y75-D115 WeakPolarHBondContact OH-CB 3.36Å; Y75-D115 PolarHBondContact OH-OD2 3.05Å; A111-D115 PolarHBondContact O-N 2.97Å; A111-D115 VanDerWaalsContact O-N 3.07Å; V112-D115 PolarHBondContact O-N 3.5Å; K113-D115 VanDerWaalsContact C-N 3.25Å; K113-D115 PolarHBondContact O-N 2.69Å
116	G	96.5	Very high	97.8	Very high	61 Å²	61	29.9 Å²	29.9	63%	0.629	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.9	13.6	172.3	0	0	0	0	0	114.9	V112 K113 R114	V112-G116 PolarHBondContact O-N 3.44Å; K113-G116 PolarHBondContact O-N 3.47Å; R114-G116 PolarHBondContact O-N 3.01Å
117	H	98.1	Very high	97.8	Very high	22 Å²	22	29.9 Å²	29.9	10%	0.102	16%	0.159	C	C	.	.	P	Polyproline II helix	trans	-92.9	154.1	-178	-52.3	-62	0	0	0	113	S32 Y75 V112 K113	S32-H117 PolarHBondContact OG-CE1 2.84Å; S32-H117 VanDerWaalsContact OG-CE1 3.3Å; S32-H117 PolarHBondContact OG-ND1 3.49Å; Y75-H117 PolarHBondContact OH-CD2 3.37Å; Y75-H117 VanDerWaalsContact OH-CD2 3.22Å; Y75-H117 PolarHBondContact OH-NE2 3.43Å; V112-H117 HydrophobicContact CG1-CB 3.8Å; V112-H117 PolarHBondContact O-N 3.01Å; K113-H117 WeakPolarHBondContact CD-O 3.27Å; K113-H117 WeakPolarHBondContact CE-O 3.32Å; K113-H117 PolarHBondContact NZ-O 3.42Å
118	T	98.5	Very high	97.8	Very high	30 Å²	30	25.1 Å²	25.1	18%	0.184	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	124.3	155	-65.2	0	0	0	0	108.1	S32 G34 L295 S296 F329	S32-T118 PolarHBondContact O-N 2.97Å; G34-T118 PolarHBondContact N-O 3.03Å; T118-L295 PolarHBondContact OG1-O 2.9Å; T118-S296 WeakPolarHBondContact CA-O 3.35Å; T118-F329 HydrophobicContact CG2-CE1 3.64Å; T118-F329 HydrophobicContact CG2-CZ 3.77Å
119	A	98.8	Very high	97.8	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	133.9	-177.5	0	0	0	0	0	110.5	V109 V112 K113 I121 S296 A297 V298	V109-A119 HydrophobicContact CG1-CB 4.33Å; V112-A119 HydrophobicContact CB-CB 4.38Å; V112-A119 HydrophobicContact CG1-CB 3.81Å; K113-A119 HydrophobicContact CD-CB 4.07Å; A119-I121 HydrophobicContact CB-CD1 4.03Å; A119-S296 PolarHBondContact N-O 3.24Å; A119-S296 VanDerWaalsContact N-O 3.16Å; A119-A297 HydrophobicContact CB-CB 4.23Å; A119-A297 CarbonylContact O-C 3.54Å; A119-A297 WeakPolarHBondContact O-CA 3.14Å; A119-V298 PolarHBondContact O-N 3.19Å
120	V	98.9	Very high	97.8	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.006	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	114	173	176.2	0	0	0	0	108.2	V33 G34 I35 I36 L122 V298 L325 F329	V33-V120 HydrophobicContact CG1-CB 4.31Å; V33-V120 HydrophobicContact CG1-CG2 3.54Å; G34-V120 PolarHBondContact O-N 3.37Å; I35-V120 CarbonylContact C-O 3.56Å; I35-V120 WeakPolarHBondContact CA-O 3.39Å; I35-V120 HydrophobicContact CG1-CB 4.2Å; I36-V120 PolarHBondContact N-O 3.04Å; V120-L122 HydrophobicContact CG1-CD2 3.74Å; V120-V298 CarbonylContact C-O 3.17Å; V120-V298 WeakPolarHBondContact CA-O 3.49Å; V120-L325 HydrophobicContact CG1-CD2 3.83Å; V120-F329 HydrophobicContact CG2-CE2 3.48Å; V120-F329 VanDerWaalsContact CG2-CE2 3.48Å; V120-F329 HydrophobicContact CG2-CZ 3.34Å
121	I	98.9	Very high	97.8	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.005	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	113.4	178	-59.3	66.4	0	0	0	106.7	I36 A38 L105 V109 A119 G123 V298 D299 M300	I36-I121 WeakPolarHBondContact O-CA 3.32Å; A38-I121 HydrophobicContact CB-CG2 4.01Å; L105-I121 HydrophobicContact CD1-CG1 4.23Å; L105-I121 HydrophobicContact CD1-CG2 4.18Å; L105-I121 HydrophobicContact CD2-CG2 4.31Å; V109-I121 HydrophobicContact CG2-CD1 3.9Å; V109-I121 HydrophobicContact CG2-CG1 3.96Å; A119-I121 HydrophobicContact CB-CD1 4.03Å; I121-G123 PolarHBondContact O-N 3.37Å; I121-V298 PolarHBondContact N-O 3.39Å; I121-D299 VanDerWaalsContact CB-OD1 3.32Å; I121-D299 WeakPolarHBondContact CB-OD1 3.08Å; I121-D299 VanDerWaalsContact CD1-OD1 3.27Å; I121-D299 WeakPolarHBondContact CD1-OD1 3.49Å; I121-D299 WeakPolarHBondContact CG1-OD1 3.28Å; I121-M300 PolarHBondContact O-N 3.03Å
122	L	98.9	Very high	97.8	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	105.4	169.5	-50.6	-178.2	0	0	0	106.1	I35 I36 A38 P53 L56 R57 L61 V120 L325	I35-L122 HydrophobicContact CG2-CD1 3.67Å; I35-L122 HydrophobicContact CG2-CG 3.96Å; I36-L122 PolarHBondContact O-N 3.02Å; A38-L122 PolarHBondContact N-O 3.2Å; P53-L122 HydrophobicContact CB-CB 4.14Å; P53-L122 HydrophobicContact CG-CB 4.48Å; P53-L122 WeakPolarHBondContact CG-O 3.47Å; L56-L122 HydrophobicContact CB-CD1 4.3Å; L56-L122 HydrophobicContact CD1-CB 4.21Å; L56-L122 HydrophobicContact CD1-CD2 4.09Å; R57-L122 HydrophobicContact CG-CD1 4.36Å; L61-L122 HydrophobicContact CD2-CD1 3.92Å; L61-L122 HydrophobicContact CD2-CD2 3.72Å; L61-L122 HydrophobicContact CD2-CG 4.47Å; V120-L122 HydrophobicContact CG1-CD2 3.74Å; L122-L325 HydrophobicContact CD2-CD1 3.73Å
123	G	87.6	Confident	97.8	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.01	11%	0.105	C	C	.	.			trans	-70.2	168.4	-171.5	0	0	0	0	0	113.9	A38 A52 P53 I121 M300	A38-G123 CarbonylContact O-C 3.48Å; A52-G123 WeakPolarHBondContact CB-O 3.44Å; P53-G123 VanDerWaalsContact CD-O 3.29Å; P53-G123 WeakPolarHBondContact CD-O 3.21Å; P53-G123 WeakPolarHBondContact CG-O 3.43Å; I121-G123 PolarHBondContact O-N 3.37Å; G123-M300 WeakPolarHBondContact CA-O 3.37Å; G123-M300 PolarHBondContact N-O 3.28Å
124	G	95.6	Very high	97.8	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.105	C	C	.	.	S	Bend		-99.9	-120.1	128.1	0	0	0	0	0	108.4	A38 F40 V49 V301 E302	A38-G124 PolarHBondContact O-N 2.85Å; F40-G124 CarbonylContact O-C 3.59Å; F40-G124 VanDerWaalsContact O-CA 3.26Å; F40-G124 WeakPolarHBondContact O-CA 3.44Å; V49-G124 WeakPolarHBondContact O-CA 3.29Å; G124-V301 WeakPolarHBondContact O-CB 3.36Å; G124-E302 PolarHBondContact O-N 3.09Å
125	D	98.8	Very high	97.9	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	7%	0.067	C	C	.	.	S	Bend	trans	-69.7	161.1	-174.3	70.9	65	0	0	0	115.3	F40 S41 K42 G43 Q44 V49 S127 L128 H166 E302	F40-D125 WeakPolarHBondContact CD1-OD2 3.47Å; F40-D125 PolarHBondContact O-N 3.22Å; S41-D125 WeakPolarHBondContact CA-OD2 3.27Å; K42-D125 PolarHBondContact N-OD2 2.75Å; G43-D125 WeakPolarHBondContact CA-OD2 3.26Å; G43-D125 PolarHBondContact N-OD2 3.48Å; Q44-D125 HydrophobicContact CG-CB 3.63Å; V49-D125 HydrophobicContact CG2-CB 4.22Å; D125-S127 PolarHBondContact O-N 3.12Å; D125-S127 VanDerWaalsContact O-N 3.16Å; D125-S127 WeakPolarHBondContact OD1-CB 3.39Å; D125-S127 PolarHBondContact OD1-N 3.17Å; D125-S127 PolarHBondContact OD1-OG 3.48Å; D125-L128 WeakPolarHBondContact O-CB 3.39Å; D125-L128 WeakPolarHBondContact O-CD1 3.49Å; D125-L128 WeakPolarHBondContact O-CG 3.43Å; D125-L128 PolarHBondContact O-N 3.07Å; D125-H166 HydrophobicContact CB-CB 4.16Å; D125-E302 VanDerWaalsContact CA-OE1 3.26Å; D125-E302 WeakPolarHBondContact CA-OE1 3.27Å; D125-E302 VanDerWaalsContact CB-OE1 3.31Å; D125-E302 WeakPolarHBondContact CB-OE1 3.39Å
126	H	98.9	Very high	98	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	5%	0.05	C	C	.	.	G	3₁₀ helix	trans	-70.6	-8.7	-172.7	-144	157	0	0	0	114.4	L128 A129 W147 D149 D153 H166 S255 D257 V301 E302	H126-L128 PolarHBondContact O-N 3.21Å; H126-A129 WeakPolarHBondContact O-CB 3.47Å; H126-A129 PolarHBondContact O-N 3.4Å; H126-A129 VanDerWaalsContact O-N 3.08Å; H126-W147 AromaticContact CD2-CH2 3.64Å; H126-W147 AromaticContact CD2-CZ2 3.57Å; H126-W147 AromaticContact CE1-CE2 3.38Å; H126-W147 AromaticContact CE1-CH2 3.9Å; H126-W147 AromaticContact CE1-CZ2 3.15Å; H126-W147 WeakPolarHBondContact CE1-CZ2 3.24Å; H126-W147 AromaticContact CE1-NE1 3.54Å; H126-W147 AromaticContact CG-CZ2 3.84Å; H126-W147 AromaticContact ND1-CZ2 3.59Å; H126-W147 AromaticContact NE2-CE2 3.64Å; H126-W147 AromaticContact NE2-CH2 3.39Å; H126-W147 WeakPolarHBondContact NE2-CH2 3.3Å; H126-W147 AromaticContact NE2-CZ2 3.15Å; H126-W147 WeakPolarHBondContact NE2-CZ2 3.41Å; H126-D149 IonicContact CE1-OD2 2.97Å; H126-D149 PolarHBondContact CE1-OD2 3.27Å; H126-D149 IonicContact ND1-OD2 3.06Å; H126-D149 PolarHBondContact ND1-OD2 3.23Å; H126-D149 VanDerWaalsContact ND1-OD2 3.1Å; H126-D153 IonicContact CE1-OD2 3.1Å; H126-D153 IonicContact CG-OD2 2.97Å; H126-D153 IonicContact ND1-OD2 3.25Å; H126-D153 PolarHBondContact ND1-OD2 2.71Å; H126-D153 VanDerWaalsContact ND1-OD2 3.09Å; H126-H166 HydrophobicContact CB-CB 4.44Å; H126-S255 PolarHBondContact NE2-OG 2.88Å; H126-D257 IonicContact CE1-OD2 3.09Å; H126-D257 IonicContact CG-OD2 3.15Å; H126-D257 IonicContact ND1-OD2 3.46Å; H126-D257 PolarHBondContact ND1-OD2 3.41Å; H126-V301 HydrophobicContact CB-CG2 4.08Å; H126-E302 HydrophobicContact CB-CG 4.26Å; H126-E302 PolarHBondContact N-OE1 2.98Å
127	S	98.8	Very high	98.1	Very high	0 Å²	0	4.5 Å²	4.5	0%	0	2%	0.024	C	C	.	.	G	3₁₀ helix	trans	-63.1	-18.8	174.1	75.6	0	0	0	0	112.8	N102 D125 A129 I130	N102-S127 PolarHBondContact ND2-O 3.49Å; N102-S127 PolarHBondContact OD1-O 3.37Å; N102-S127 VanDerWaalsContact OD1-O 3.07Å; D125-S127 PolarHBondContact O-N 3.12Å; D125-S127 VanDerWaalsContact O-N 3.16Å; D125-S127 WeakPolarHBondContact OD1-CB 3.39Å; D125-S127 PolarHBondContact OD1-N 3.17Å; D125-S127 PolarHBondContact OD1-OG 3.48Å; S127-A129 PolarHBondContact O-N 2.84Å; S127-I130 WeakPolarHBondContact O-CG1 3.3Å; S127-I130 PolarHBondContact O-N 2.84Å
128	L	98.9	Very high	98.1	Very high	1 Å²	1	6.2 Å²	6.2	1%	0.005	4%	0.042	C	C	.	.	G	3₁₀ helix	trans	-63.9	-20.3	175.5	-67.2	171.9	0	0	0	113.6	A38 F40 F80 N102 L105 D125 H126 I130 G131 S132	A38-L128 HydrophobicContact CB-CD1 3.61Å; A38-L128 HydrophobicContact CB-CD2 4.29Å; A38-L128 WeakPolarHBondContact O-CD1 3.48Å; F40-L128 HydrophobicContact CB-CD1 4.12Å; F40-L128 HydrophobicContact CB-CD2 3.85Å; F40-L128 HydrophobicContact CB-CG 4.27Å; F40-L128 HydrophobicContact CD1-CD2 3.97Å; F40-L128 HydrophobicContact CD1-CG 4.25Å; F40-L128 HydrophobicContact CG-CD2 4.04Å; F80-L128 HydrophobicContact CZ-CD2 4.4Å; N102-L128 VanDerWaalsContact OD1-CA 3.25Å; N102-L128 WeakPolarHBondContact OD1-CA 3.38Å; N102-L128 PolarHBondContact OD1-O 3.41Å; N102-L128 VanDerWaalsContact OD1-O 3.12Å; L105-L128 HydrophobicContact CD2-CB 3.77Å; L105-L128 HydrophobicContact CD2-CD2 3.9Å; L105-L128 HydrophobicContact CD2-CG 4.36Å; L105-L128 VanDerWaalsContact CD2-O 3.26Å; L105-L128 WeakPolarHBondContact CD2-O 3.34Å; D125-L128 WeakPolarHBondContact O-CB 3.39Å; D125-L128 WeakPolarHBondContact O-CD1 3.49Å; D125-L128 WeakPolarHBondContact O-CG 3.43Å; D125-L128 PolarHBondContact O-N 3.07Å; H126-L128 PolarHBondContact O-N 3.21Å; L128-I130 PolarHBondContact O-N 3.29Å; L128-I130 VanDerWaalsContact O-N 3.17Å; L128-G131 PolarHBondContact O-N 3.03Å; L128-G131 VanDerWaalsContact O-N 3.09Å; L128-S132 PolarHBondContact O-N 3.48Å; L128-S132 PolarHBondContact O-OG 3.23Å
129	A	98.9	Very high	98.1	Very high	0 Å²	0	7 Å²	7	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-58.8	-27.1	176.2	0	0	0	0	0	112.5	H126 S127 G131 S132 I133 W147 P169	H126-A129 WeakPolarHBondContact O-CB 3.47Å; H126-A129 PolarHBondContact O-N 3.4Å; H126-A129 VanDerWaalsContact O-N 3.08Å; S127-A129 PolarHBondContact O-N 2.84Å; A129-G131 PolarHBondContact O-N 3.27Å; A129-S132 VanDerWaalsContact CA-OG 3.27Å; A129-S132 WeakPolarHBondContact CA-OG 3.46Å; A129-S132 PolarHBondContact O-OG 2.97Å; A129-I133 HydrophobicContact CB-CD1 4.25Å; A129-I133 VanDerWaalsContact O-CB 3.27Å; A129-I133 WeakPolarHBondContact O-CB 3.45Å; A129-I133 WeakPolarHBondContact O-CG1 3.3Å; A129-I133 PolarHBondContact O-N 2.94Å; A129-W147 HydrophobicContact CB-CH2 3.51Å; A129-W147 HydrophobicContact CB-CZ3 3.76Å; A129-P169 HydrophobicContact CB-CB 4.1Å; A129-P169 HydrophobicContact CB-CG 4.47Å
130	I	98.9	Very high	98	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-58.4	-50.2	175.3	-57.2	170.5	0	0	0	109.9	N102 S127 L128 H134 I165 P169 Y172 F187 W189 M190	N102-I130 HydrophobicContact CB-CB 4.27Å; N102-I130 HydrophobicContact CB-CG2 4.35Å; S127-I130 WeakPolarHBondContact O-CG1 3.3Å; S127-I130 PolarHBondContact O-N 2.84Å; L128-I130 PolarHBondContact O-N 3.29Å; L128-I130 VanDerWaalsContact O-N 3.17Å; I130-H134 WeakPolarHBondContact O-CB 3.29Å; I130-H134 PolarHBondContact O-N 3.34Å; I130-I165 HydrophobicContact CD1-CG2 4.13Å; I130-P169 HydrophobicContact CD1-CB 4.33Å; I130-P169 HydrophobicContact CG1-CB 3.66Å; I130-Y172 HydrophobicContact CD1-CD2 3.71Å; I130-Y172 HydrophobicContact CD1-CE2 4.12Å; I130-Y172 HydrophobicContact CD1-CG 3.95Å; I130-Y172 HydrophobicContact CG1-CD2 4.3Å; I130-Y172 HydrophobicContact CG1-CG 4.43Å; I130-F187 HydrophobicContact CD1-CE1 4.04Å; I130-F187 HydrophobicContact CD1-CZ 4.46Å; I130-F187 HydrophobicContact CG2-CE1 4.36Å; I130-W189 HydrophobicContact CG2-CH2 4.34Å; I130-M190 HydrophobicContact CG2-CG 4.26Å
131	G	98.9	Very high	98	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-73.9	-43.1	-178.6	0	0	0	0	0	112.3	N102 S106 L128 A129 G135	N102-G131 VanDerWaalsContact O-CA 3.28Å; N102-G131 WeakPolarHBondContact O-CA 3.47Å; N102-G131 WeakPolarHBondContact OD1-CA 3.07Å; N102-G131 PolarHBondContact OD1-N 3.14Å; S106-G131 WeakPolarHBondContact CA-O 3.29Å; S106-G131 WeakPolarHBondContact CB-O 3.44Å; L128-G131 PolarHBondContact O-N 3.03Å; L128-G131 VanDerWaalsContact O-N 3.09Å; A129-G131 PolarHBondContact O-N 3.27Å; G131-G135 PolarHBondContact O-N 2.96Å
132	S	98.9	Very high	97.8	Very high	0 Å²	0	15 Å²	15	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-65.1	-47.6	-177.3	67.6	0	0	0	0	112	L128 A129 G135 H136 D299	L128-S132 PolarHBondContact O-N 3.48Å; L128-S132 PolarHBondContact O-OG 3.23Å; A129-S132 VanDerWaalsContact CA-OG 3.27Å; A129-S132 WeakPolarHBondContact CA-OG 3.46Å; A129-S132 PolarHBondContact O-OG 2.97Å; S132-G135 PolarHBondContact O-N 3.02Å; S132-H136 VanDerWaalsContact O-CB 3.28Å; S132-H136 WeakPolarHBondContact O-CB 3.49Å; S132-H136 PolarHBondContact O-N 3.11Å; S132-D299 VanDerWaalsContact CB-OD1 3.26Å; S132-D299 WeakPolarHBondContact CB-OD1 3.29Å; S132-D299 WeakPolarHBondContact CB-OD2 3.33Å; S132-D299 PolarHBondContact OG-OD1 3.46Å; S132-D299 PolarHBondContact OG-OD2 3.49Å
133	I	98.9	Very high	97.8	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-70.7	-43.6	-179.5	-64.9	171.3	0	0	0	110	A129 G135 H136 T137 V145 W147 L173 V194 H253	A129-I133 HydrophobicContact CB-CD1 4.25Å; A129-I133 VanDerWaalsContact O-CB 3.27Å; A129-I133 WeakPolarHBondContact O-CB 3.45Å; A129-I133 WeakPolarHBondContact O-CG1 3.3Å; A129-I133 PolarHBondContact O-N 2.94Å; I133-G135 PolarHBondContact O-N 3.2Å; I133-H136 PolarHBondContact O-N 2.53Å; I133-T137 HydrophobicContact CG2-CG2 4.3Å; I133-T137 WeakPolarHBondContact O-CB 3.48Å; I133-T137 WeakPolarHBondContact O-CG2 3.49Å; I133-T137 PolarHBondContact O-N 3.5Å; I133-T137 PolarHBondContact O-OG1 3.35Å; I133-V145 HydrophobicContact CD1-CG1 4.23Å; I133-V145 HydrophobicContact CD1-CG2 4.48Å; I133-V145 HydrophobicContact CG2-CG2 4.4Å; I133-W147 HydrophobicContact CD1-CE3 4.47Å; I133-W147 HydrophobicContact CD1-CZ3 3.91Å; I133-L173 HydrophobicContact CB-CD1 3.93Å; I133-L173 HydrophobicContact CB-CD2 4.2Å; I133-L173 HydrophobicContact CD1-CD1 3.62Å; I133-L173 HydrophobicContact CG1-CD1 4.3Å; I133-L173 HydrophobicContact CG2-CD1 4.14Å; I133-L173 HydrophobicContact CG2-CD2 4.21Å; I133-V194 HydrophobicContact CG2-CG2 3.61Å; I133-H253 WeakPolarHBondContact CG1-NE2 3.35Å
134	H	98.8	Very high	98.3	Very high	25 Å²	25	15.2 Å²	15.2	12%	0.116	11%	0.109	C	C	.	.	H	α-helix	trans	-60.1	-45.8	175	-179.3	-87.6	0	0	0	111.7	S106 I130 H136 T137 A138 W189	S106-H134 PolarHBondContact OG-ND1 3.29Å; I130-H134 WeakPolarHBondContact O-CB 3.29Å; I130-H134 PolarHBondContact O-N 3.34Å; H134-H136 PolarHBondContact O-N 3.08Å; H134-T137 WeakPolarHBondContact CA-OG1 3.32Å; H134-T137 PolarHBondContact O-OG1 3.21Å; H134-A138 WeakPolarHBondContact O-CB 3.29Å; H134-A138 PolarHBondContact O-N 2.97Å; H134-W189 HydrophobicContact CB-CZ3 4.18Å; H134-W189 AromaticContact CE1-CE3 3.82Å; H134-W189 AromaticContact CE1-CZ3 3.82Å; H134-W189 AromaticContact CG-CZ3 3.72Å; H134-W189 AromaticContact ND1-CE3 3.92Å; H134-W189 AromaticContact ND1-CZ3 3.45Å; H134-W189 WeakPolarHBondContact ND1-CZ3 3.25Å
135	G	98.8	Very high	98.4	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-63.8	-40.9	177.9	0	0	0	0	0	112.8	S106 K110 G131 S132 I133 A139	S106-G135 WeakPolarHBondContact O-CA 3.42Å; S106-G135 WeakPolarHBondContact OG-CA 3.46Å; S106-G135 PolarHBondContact OG-N 2.71Å; K110-G135 VanDerWaalsContact CG-O 3.22Å; K110-G135 WeakPolarHBondContact CG-O 3.37Å; G131-G135 PolarHBondContact O-N 2.96Å; S132-G135 PolarHBondContact O-N 3.02Å; I133-G135 PolarHBondContact O-N 3.2Å; G135-A139 WeakPolarHBondContact O-CB 3.39Å; G135-A139 PolarHBondContact O-N 3.39Å
136	H	98.8	Very high	98.4	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-62.5	-54.5	176.9	-176.3	-158.5	0	0	0	111	V109 S132 I133 H134 A138 A139 V140 H253 S296	V109-H136 HydrophobicContact CG1-CB 4.11Å; S132-H136 VanDerWaalsContact O-CB 3.28Å; S132-H136 WeakPolarHBondContact O-CB 3.49Å; S132-H136 PolarHBondContact O-N 3.11Å; I133-H136 PolarHBondContact O-N 2.53Å; H134-H136 PolarHBondContact O-N 3.08Å; H136-A138 VanDerWaalsContact C-N 3.34Å; H136-A138 PolarHBondContact O-N 2.82Å; H136-A139 PolarHBondContact O-N 3.47Å; H136-A139 VanDerWaalsContact O-N 3.09Å; H136-V140 WeakPolarHBondContact O-CG2 3.13Å; H136-V140 PolarHBondContact O-N 2.95Å; H136-H253 AromaticContact CG-ND1 3.85Å; H136-H253 AromaticContact ND1-CG 3.71Å; H136-H253 AromaticContact ND1-ND1 3.19Å; H136-H253 PolarHBondContact ND1-ND1 2.99Å; H136-H253 VanDerWaalsContact ND1-ND1 3.19Å; H136-S296 WeakPolarHBondContact NE2-CB 3.26Å; H136-S296 PolarHBondContact NE2-OG 3.41Å
137	T	98.6	Very high	98.4	Very high	13 Å²	13	15.2 Å²	15.2	8%	0.08	11%	0.109	C	C	.	.	H	α-helix	trans	-61	-40.6	180	52.8	0	0	0	0	112.7	I133 H134 A139 V140 G141 V143 C193	I133-T137 HydrophobicContact CG2-CG2 4.3Å; I133-T137 WeakPolarHBondContact O-CB 3.48Å; I133-T137 WeakPolarHBondContact O-CG2 3.49Å; I133-T137 PolarHBondContact O-N 3.5Å; I133-T137 PolarHBondContact O-OG1 3.35Å; H134-T137 WeakPolarHBondContact CA-OG1 3.32Å; H134-T137 PolarHBondContact O-OG1 3.21Å; T137-A139 PolarHBondContact O-N 2.92Å; T137-V140 PolarHBondContact O-N 3.05Å; T137-G141 VanDerWaalsContact CA-O 3.28Å; T137-G141 WeakPolarHBondContact CA-O 3.43Å; T137-G141 CarbonylContact O-C 3.48Å; T137-G141 VanDerWaalsContact O-CA 3.26Å; T137-G141 WeakPolarHBondContact O-CA 3.42Å; T137-G141 PolarHBondContact O-N 2.85Å; T137-V143 HydrophobicContact CG2-CB 4.29Å; T137-V143 HydrophobicContact CG2-CG1 3.98Å; T137-V143 HydrophobicContact CG2-CG2 3.5Å; T137-V143 VanDerWaalsContact CG2-CG2 3.5Å; T137-C193 HydrophobicContact CG2-CB 4.24Å; T137-C193 WeakPolarHBondContact OG1-CB 3.32Å; T137-C193 PolarHBondContact OG1-SG 2.95Å
138	A	98.4	Very high	98.4	Very high	58 Å²	58	15.2 Å²	15.2	48%	0.479	11%	0.109	S	C	.	.	H	α-helix	trans	-63.5	-27.3	176.8	0	0	0	0	0	113.1	K110 H134 H136	K110-A138 HydrophobicContact CD-CB 3.89Å; K110-A138 HydrophobicContact CG-CB 4.26Å; H134-A138 WeakPolarHBondContact O-CB 3.29Å; H134-A138 PolarHBondContact O-N 2.97Å; H136-A138 VanDerWaalsContact C-N 3.34Å; H136-A138 PolarHBondContact O-N 2.82Å
139	A	98.3	Very high	98.4	Very high	46 Å²	46	15.1 Å²	15.1	38%	0.38	11%	0.109	S	C	.	.	H	α-helix	trans	-86.5	-37.1	178.7	0	0	0	0	0	113.8	K110 K113 G135 H136 T137	K110-A139 HydrophobicContact CG-CB 4.21Å; K113-A139 HydrophobicContact CB-CB 3.53Å; K113-A139 HydrophobicContact CG-CB 4.03Å; G135-A139 WeakPolarHBondContact O-CB 3.39Å; G135-A139 PolarHBondContact O-N 3.39Å; H136-A139 PolarHBondContact O-N 3.47Å; H136-A139 VanDerWaalsContact O-N 3.09Å; T137-A139 PolarHBondContact O-N 2.92Å
140	V	97.4	Very high	98.4	Very high	58 Å²	58	15.1 Å²	15.1	35%	0.352	11%	0.109	S	C	.	.	H	α-helix	trans	-119.5	-1.3	-169.6	-49	0	0	0	0	114.6	K113 H136 T137 V143 P251	K113-V140 HydrophobicContact CB-CG1 4.35Å; K113-V140 HydrophobicContact CG-CG1 4.42Å; H136-V140 WeakPolarHBondContact O-CG2 3.13Å; H136-V140 PolarHBondContact O-N 2.95Å; T137-V140 PolarHBondContact O-N 3.05Å; V140-V143 HydrophobicContact CG2-CG1 3.77Å; V140-P251 HydrophobicContact CG2-CB 4.3Å; V140-P251 HydrophobicContact CG2-CG 4.05Å
141	G	97.1	Very high	98.4	Very high	30 Å²	30	16.2 Å²	16.2	31%	0.309	11%	0.114	S	C	.	.	S	Bend	trans	84.9	-160.3	-173.4	0	0	0	0	0	112.9	T137 V143	T137-G141 VanDerWaalsContact CA-O 3.28Å; T137-G141 WeakPolarHBondContact CA-O 3.43Å; T137-G141 CarbonylContact O-C 3.48Å; T137-G141 VanDerWaalsContact O-CA 3.26Å; T137-G141 WeakPolarHBondContact O-CA 3.42Å; T137-G141 PolarHBondContact O-N 2.85Å; G141-V143 WeakPolarHBondContact O-CG1 3.34Å; G141-V143 PolarHBondContact O-N 3.1Å
142	P	96.4	Very high	98.4	Very high	83 Å²	83	16.2 Å²	16.2	54%	0.539	11%	0.114	S	C	.	.	S	Bend	trans	-58.1	136.7	-178.2	-25.1	34.9	0	0	0	113	K250	P142-K250 HydrophobicContact CB-CD 4.24Å
143	V	97.6	Very high	98.4	Very high	3 Å²	3	16.6 Å²	16.6	2%	0.018	12%	0.116	C	C	.	.			trans	-121.9	159.4	179.5	-54.7	0	0	0	0	110.4	T137 V140 G141 V145 P251 H253	T137-V143 HydrophobicContact CG2-CB 4.29Å; T137-V143 HydrophobicContact CG2-CG1 3.98Å; T137-V143 HydrophobicContact CG2-CG2 3.5Å; T137-V143 VanDerWaalsContact CG2-CG2 3.5Å; V140-V143 HydrophobicContact CG2-CG1 3.77Å; G141-V143 WeakPolarHBondContact O-CG1 3.34Å; G141-V143 PolarHBondContact O-N 3.1Å; V143-V145 HydrophobicContact CG2-CG2 4.11Å; V143-P251 WeakPolarHBondContact CA-O 3.32Å; V143-P251 WeakPolarHBondContact CB-O 3.46Å; V143-P251 HydrophobicContact CG1-CB 4.42Å; V143-H253 HydrophobicContact CG2-CB 4.21Å
144	S	98.2	Very high	98.4	Very high	2 Å²	2	16.6 Å²	16.6	1%	0.014	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	134.1	164	-65.2	0	0	0	0	109.2	D198 P251 I252 H253	S144-D198 CarbonylContact C-O 3.5Å; S144-D198 WeakPolarHBondContact CA-O 3.47Å; S144-P251 PolarHBondContact N-O 2.95Å; S144-I252 CarbonylContact O-C 3.44Å; S144-I252 WeakPolarHBondContact O-CA 3.41Å; S144-H253 PolarHBondContact O-N 3.09Å
145	V	98.8	Very high	98.4	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	123.5	179.2	-176.3	0	0	0	0	109.3	I133 V143 W147 M170 V194 D198 L199 V200 H253	I133-V145 HydrophobicContact CD1-CG1 4.23Å; I133-V145 HydrophobicContact CD1-CG2 4.48Å; I133-V145 HydrophobicContact CG2-CG2 4.4Å; V143-V145 HydrophobicContact CG2-CG2 4.11Å; V145-W147 HydrophobicContact CG1-CE3 4.2Å; V145-M170 HydrophobicContact CG1-CE 4.26Å; V145-V194 HydrophobicContact CG2-CG1 4.07Å; V145-V194 HydrophobicContact CG2-CG2 4.06Å; V145-D198 PolarHBondContact N-O 3.15Å; V145-L199 HydrophobicContact CB-CD1 3.9Å; V145-L199 HydrophobicContact CG1-CD1 3.78Å; V145-L199 WeakPolarHBondContact O-CA 3.23Å; V145-V200 PolarHBondContact O-N 2.68Å; V145-H253 WeakPolarHBondContact CA-O 3.25Å
146	V	98.9	Very high	98.4	Very high	0 Å²	0	16 Å²	16	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	115.3	165.9	-178.9	0	0	0	0	106.7	V148 I202 T240 L244 I252 H253 L254 S255 L289	V146-V148 HydrophobicContact CG1-CG2 4Å; V146-I202 HydrophobicContact CG1-CD1 3.96Å; V146-T240 HydrophobicContact CG2-CG2 4.17Å; V146-L244 HydrophobicContact CG2-CD1 3.8Å; V146-I252 HydrophobicContact CG2-CG2 4.14Å; V146-H253 PolarHBondContact N-O 3.15Å; V146-L254 HydrophobicContact CB-CD1 4.24Å; V146-L254 HydrophobicContact CG1-CD1 4.16Å; V146-L254 WeakPolarHBondContact O-CA 3.18Å; V146-S255 PolarHBondContact O-N 3.1Å; V146-L289 HydrophobicContact CG1-CD1 4.4Å; V146-L289 HydrophobicContact CG2-CD2 4.3Å
147	W	98.9	Very high	98.2	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	108.9	-178	-164.2	-75.4	0	0	0	108.9	H126 A129 I133 V145 D149 D153 P169 M170 L199 V200 Y201 I202	H126-W147 AromaticContact CD2-CH2 3.64Å; H126-W147 AromaticContact CD2-CZ2 3.57Å; H126-W147 AromaticContact CE1-CE2 3.38Å; H126-W147 AromaticContact CE1-CH2 3.9Å; H126-W147 AromaticContact CE1-CZ2 3.15Å; H126-W147 WeakPolarHBondContact CE1-CZ2 3.24Å; H126-W147 AromaticContact CE1-NE1 3.54Å; H126-W147 AromaticContact CG-CZ2 3.84Å; H126-W147 AromaticContact ND1-CZ2 3.59Å; H126-W147 AromaticContact NE2-CE2 3.64Å; H126-W147 AromaticContact NE2-CH2 3.39Å; H126-W147 WeakPolarHBondContact NE2-CH2 3.3Å; H126-W147 AromaticContact NE2-CZ2 3.15Å; H126-W147 WeakPolarHBondContact NE2-CZ2 3.41Å; A129-W147 HydrophobicContact CB-CH2 3.51Å; A129-W147 HydrophobicContact CB-CZ3 3.76Å; I133-W147 HydrophobicContact CD1-CE3 4.47Å; I133-W147 HydrophobicContact CD1-CZ3 3.91Å; V145-W147 HydrophobicContact CG1-CE3 4.2Å; W147-D149 PolarHBondContact NE1-OD2 2.9Å; W147-D153 HydrophobicContact CZ2-CB 3.59Å; W147-P169 HydrophobicContact CH2-CB 4.22Å; W147-P169 HydrophobicContact CH2-CG 3.59Å; W147-P169 HydrophobicContact CZ2-CG 3.92Å; W147-M170 HydrophobicContact CD2-CE 4.12Å; W147-M170 HydrophobicContact CE3-CE 3.26Å; W147-M170 HydrophobicContact CH2-CE 4.33Å; W147-M170 HydrophobicContact CZ3-CE 3.4Å; W147-L199 HydrophobicContact CB-CD1 4.11Å; W147-V200 PolarHBondContact N-O 3.18Å; W147-Y201 HydrophobicContact CB-CD1 3.61Å; W147-Y201 HydrophobicContact CB-CE1 3.74Å; W147-Y201 HydrophobicContact CB-CG 4.36Å; W147-Y201 AromaticContact CD1-CD1 3.46Å; W147-Y201 VanDerWaalsContact CD1-CD1 3.46Å; W147-Y201 AromaticContact CD1-CE1 3.33Å; W147-Y201 HydrophobicContact CD2-CE1 4.1Å; W147-Y201 AromaticContact CG-CD1 3.66Å; W147-Y201 HydrophobicContact CG-CD1 3.66Å; W147-Y201 AromaticContact CG-CE1 3.43Å; W147-Y201 HydrophobicContact CG-CE1 3.43Å; W147-Y201 VanDerWaalsContact CG-CE1 3.43Å; W147-Y201 AromaticContact NE1-CE1 3.91Å; W147-Y201 CarbonylContact O-C 3.56Å; W147-Y201 WeakPolarHBondContact O-CA 3.43Å; W147-I202 PolarHBondContact O-N 2.92Å
148	V	98.9	Very high	98	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	107.4	-177.3	-174.5	0	0	0	0	108.1	V146 I202 L254 S255 Y256 D257 A260 L277 I285	V146-V148 HydrophobicContact CG1-CG2 4Å; V148-I202 WeakPolarHBondContact CA-O 3.4Å; V148-I202 HydrophobicContact CG2-CB 4.49Å; V148-L254 HydrophobicContact CG2-CD1 3.68Å; V148-S255 PolarHBondContact N-O 2.83Å; V148-Y256 HydrophobicContact CB-CD2 3.91Å; V148-Y256 HydrophobicContact CB-CE2 4.03Å; V148-Y256 HydrophobicContact CB-CG 4.16Å; V148-Y256 HydrophobicContact CG1-CD1 4.46Å; V148-Y256 HydrophobicContact CG1-CD2 4.1Å; V148-Y256 HydrophobicContact CG1-CE1 4.06Å; V148-Y256 HydrophobicContact CG1-CE2 3.68Å; V148-Y256 HydrophobicContact CG1-CG 4.46Å; V148-Y256 HydrophobicContact CG2-CD2 4.16Å; V148-Y256 HydrophobicContact CG2-CE2 4.29Å; V148-D257 PolarHBondContact O-N 3.06Å; V148-A260 HydrophobicContact CG1-CB 3.73Å; V148-L277 HydrophobicContact CG1-CD1 3.78Å; V148-I285 HydrophobicContact CG1-CD1 4.01Å; V148-I285 HydrophobicContact CG2-CD1 4.43Å; V148-I285 HydrophobicContact CG2-CG2 4.17Å
149	D	98.9	Very high	97.9	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	13%	0.131	C	C	.	.	S	Bend	trans	-163.5	154.6	-163.8	-158.6	-39.2	0	0	0	111.1	H126 W147 H151 I202 G203 L204 D257	H126-D149 IonicContact CE1-OD2 2.97Å; H126-D149 PolarHBondContact CE1-OD2 3.27Å; H126-D149 IonicContact ND1-OD2 3.06Å; H126-D149 PolarHBondContact ND1-OD2 3.23Å; H126-D149 VanDerWaalsContact ND1-OD2 3.1Å; W147-D149 PolarHBondContact NE1-OD2 2.9Å; D149-H151 VanDerWaalsContact C-N 3.34Å; D149-H151 WeakPolarHBondContact CB-O 3.43Å; D149-H151 IonicContact OD1-CG 3.92Å; D149-H151 PolarHBondContact OD1-N 2.92Å; D149-H151 IonicContact OD1-ND1 3.98Å; D149-H151 PolarHBondContact OD1-ND1 3.29Å; D149-I202 PolarHBondContact N-O 3.3Å; D149-G203 CarbonylContact O-C 3.51Å; D149-G203 WeakPolarHBondContact O-CA 3.39Å; D149-L204 PolarHBondContact O-N 3.18Å; D149-D257 HydrophobicContact CB-CB 4.05Å; D149-D257 VanDerWaalsContact CG-CB 3.5Å; D149-D257 WeakPolarHBondContact OD2-CB 3.36Å
150	A	98.9	Very high	97.8	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	12%	0.12	C	C	.	.	S	Bend	trans	-74.1	-26.8	165.8	0	0	0	0	0	112.8	L204 R205 D206 D259 A273	A150-L204 WeakPolarHBondContact O-CA 3.05Å; A150-R205 HydrophobicContact CB-CG 4.14Å; A150-R205 PolarHBondContact O-N 3.01Å; A150-D206 PolarHBondContact O-N 2.88Å; A150-D259 WeakPolarHBondContact CB-OD1 3.41Å; A150-D259 PolarHBondContact N-OD1 3.43Å; A150-A273 HydrophobicContact CB-CB 4.02Å
151	H	98.9	Very high	97.7	Very high	22 Å²	22	23.3 Å²	23.3	10%	0.102	14%	0.139	C	C	.	.	S	Bend	trans	-113	159.5	-172.5	-46.5	91.6	0	0	0	111.7	D149 D153 L204 D206 D259 T271	D149-H151 VanDerWaalsContact C-N 3.34Å; D149-H151 WeakPolarHBondContact CB-O 3.43Å; D149-H151 IonicContact OD1-CG 3.92Å; D149-H151 PolarHBondContact OD1-N 2.92Å; D149-H151 IonicContact OD1-ND1 3.98Å; D149-H151 PolarHBondContact OD1-ND1 3.29Å; H151-D153 WeakPolarHBondContact CB-OD1 3.47Å; H151-L204 WeakPolarHBondContact O-CD2 3.4Å; H151-D206 WeakPolarHBondContact CA-O 3.41Å; H151-D206 PolarHBondContact CD2-O 2.78Å; H151-D206 IonicContact NE2-OD2 3.72Å; H151-D259 IonicContact CE1-OD1 3.92Å; H151-D259 IonicContact CE1-OD2 3.28Å; H151-D259 PolarHBondContact CE1-OD2 3.31Å; H151-D259 IonicContact ND1-OD1 2.92Å; H151-D259 IonicContact ND1-OD2 3.8Å; H151-D259 PolarHBondContact ND1-OD2 3.44Å; H151-T271 PolarHBondContact CE1-O 3.17Å
152	A	98.7	Very high	97.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.146	C	C	.	.			trans	-87.3	-23.9	179.2	0	0	0	0	0	112.7	I154 Y201 L204 V207 E211 M215	A152-I154 HydrophobicContact CB-CG2 3.75Å; A152-I154 PolarHBondContact O-N 3.42Å; A152-Y201 WeakPolarHBondContact O-CE1 3.17Å; A152-Y201 PolarHBondContact O-OH 3.39Å; A152-L204 HydrophobicContact CB-CD1 4.4Å; A152-V207 HydrophobicContact CB-CG1 4.29Å; A152-E211 HydrophobicContact CB-CB 4.06Å; A152-E211 HydrophobicContact CB-CG 4.49Å; A152-M215 HydrophobicContact CB-CE 3.95Å; A152-M215 HydrophobicContact CB-SD 4Å
153	D	98.8	Very high	97.6	Very high	8 Å²	8	21.6 Å²	21.6	4%	0.043	12%	0.121	C	C	.	.			trans	51.8	36.3	176.7	-76.3	5	0	0	0	113.5	H126 W147 H151 H166 G167 Q168 P169 M170 E211	H126-D153 IonicContact CE1-OD2 3.1Å; H126-D153 IonicContact CG-OD2 2.97Å; H126-D153 IonicContact ND1-OD2 3.25Å; H126-D153 PolarHBondContact ND1-OD2 2.71Å; H126-D153 VanDerWaalsContact ND1-OD2 3.09Å; W147-D153 HydrophobicContact CZ2-CB 3.59Å; H151-D153 WeakPolarHBondContact CB-OD1 3.47Å; D153-H166 VanDerWaalsContact OD2-O 3.11Å; D153-G167 CarbonylContact C-O 3.36Å; D153-G167 WeakPolarHBondContact CA-O 3.33Å; D153-G167 WeakPolarHBondContact OD1-CA 3.25Å; D153-Q168 CarbonylContact O-C 3.52Å; D153-P169 HydrophobicContact CB-CG 3.9Å; D153-P169 VanDerWaalsContact O-CD 3.32Å; D153-P169 WeakPolarHBondContact O-CD 3.2Å; D153-M170 WeakPolarHBondContact O-CB 3.47Å; D153-M170 PolarHBondContact O-N 3.33Å; D153-E211 PolarHBondContact N-OE1 2.95Å; D153-E211 VanDerWaalsContact N-OE1 3.16Å
154	I	98.8	Very high	97.7	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.124	C	C	.	.			trans	-123.6	8	-171	-160.6	169.6	0	0	0	111.9	A152 T156 M170 L174 L177 E211 I214	A152-I154 HydrophobicContact CB-CG2 3.75Å; A152-I154 PolarHBondContact O-N 3.42Å; I154-T156 PolarHBondContact O-N 2.89Å; I154-M170 HydrophobicContact CB-CB 4.09Å; I154-M170 HydrophobicContact CD1-CB 4.48Å; I154-M170 HydrophobicContact CD1-CG 4.03Å; I154-M170 HydrophobicContact CG1-CB 4.01Å; I154-M170 HydrophobicContact CG1-CG 4.08Å; I154-L174 HydrophobicContact CD1-CD1 3.51Å; I154-L174 HydrophobicContact CG1-CD1 4.21Å; I154-L177 HydrophobicContact CD1-CD1 4.39Å; I154-L177 HydrophobicContact CG1-CD1 4.06Å; I154-E211 HydrophobicContact CG2-CB 3.63Å; I154-E211 HydrophobicContact CG2-CG 3.68Å; I154-E211 PolarHBondContact N-OE1 3.12Å; I154-I214 HydrophobicContact CD1-CG2 3.71Å; I154-I214 HydrophobicContact CG1-CG2 4.01Å
155	N	98.7	Very high	97.7	Very high	6 Å²	6	22.1 Å²	22.1	3%	0.032	12%	0.124	C	C	.	.			trans	-56.2	137.3	168.6	-88.1	-65.4	0	0	0	110.3	T159 G167 Q168 S171 D208 E211	N155-T159 WeakPolarHBondContact CA-OG1 3.36Å; N155-T159 WeakPolarHBondContact OD1-CB 3.37Å; N155-T159 PolarHBondContact OD1-O 3.3Å; N155-T159 PolarHBondContact OD1-OG1 2.9Å; N155-G167 WeakPolarHBondContact CB-O 3.5Å; N155-G167 PolarHBondContact N-O 3.32Å; N155-Q168 HydrophobicContact CB-CG 4.15Å; N155-Q168 WeakPolarHBondContact O-CA 3.36Å; N155-Q168 WeakPolarHBondContact O-CB 3.36Å; N155-Q168 WeakPolarHBondContact O-CG 3.49Å; N155-S171 VanDerWaalsContact O-CB 3.25Å; N155-S171 WeakPolarHBondContact O-CB 3.38Å; N155-S171 PolarHBondContact O-OG 2.87Å; N155-D208 PolarHBondContact ND2-OD2 3.28Å; N155-E211 HydrophobicContact CB-CG 4.36Å; N155-E211 PolarHBondContact N-OE1 3.2Å; N155-E211 WeakPolarHBondContact ND2-CG 3.49Å; N155-E211 PolarHBondContact ND2-OE1 2.83Å
156	T	97.7	Very high	97.7	Very high	8 Å²	8	23.2 Å²	23.2	5%	0.049	13%	0.129	C	C	.	.			trans	-79.4	164.3	165.9	70.5	0	0	0	0	109.6	I154 L158 T159 S160 K180 I214	I154-T156 PolarHBondContact O-N 2.89Å; T156-L158 PolarHBondContact O-N 3.46Å; T156-L158 PolarHBondContact OG1-N 3.43Å; T156-T159 PolarHBondContact N-OG1 2.9Å; T156-T159 PolarHBondContact O-N 3.5Å; T156-T159 PolarHBondContact O-OG1 3.19Å; T156-T159 WeakPolarHBondContact OG1-CG2 3.46Å; T156-T159 PolarHBondContact OG1-N 2.97Å; T156-T159 PolarHBondContact OG1-OG1 3.08Å; T156-S160 PolarHBondContact O-N 3.38Å; T156-K180 HydrophobicContact CG2-CB 4.3Å; T156-I214 HydrophobicContact CG2-CD1 4.37Å
157	P	95.6	Very high	97.6	Very high	3 Å²	3	23.8 Å²	23.8	2%	0.019	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-29.5	171.4	-29.4	35.9	0	0	0	114	L181 P182 L184	P157-L181 HydrophobicContact CG-CD2 4.32Å; P157-P182 HydrophobicContact CB-CG 4.42Å; P157-L184 HydrophobicContact CG-CD1 4.03Å
158	L	94.9	Very high	97.6	Very high	121 Å²	121	23.8 Å²	23.8	63%	0.634	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-13.9	-177.6	-59	179.1	0	0	0	114.1	N90 T156	N90-L158 HydrophobicContact CB-CD2 4.21Å; T156-L158 PolarHBondContact O-N 3.46Å; T156-L158 PolarHBondContact OG1-N 3.43Å
159	T	96.6	Very high	97.6	Very high	44 Å²	44	23.8 Å²	23.8	27%	0.27	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-21.9	179.4	61.1	0	0	0	0	112.8	N155 T156 N161 A210	N155-T159 WeakPolarHBondContact CA-OG1 3.36Å; N155-T159 WeakPolarHBondContact OD1-CB 3.37Å; N155-T159 PolarHBondContact OD1-O 3.3Å; N155-T159 PolarHBondContact OD1-OG1 2.9Å; T156-T159 PolarHBondContact N-OG1 2.9Å; T156-T159 PolarHBondContact O-N 3.5Å; T156-T159 PolarHBondContact O-OG1 3.19Å; T156-T159 WeakPolarHBondContact OG1-CG2 3.46Å; T156-T159 PolarHBondContact OG1-N 2.97Å; T156-T159 PolarHBondContact OG1-OG1 3.08Å; T159-N161 PolarHBondContact O-N 3.09Å; T159-A210 HydrophobicContact CG2-CB 4.01Å
160	S	95.9	Very high	97.6	Very high	19 Å²	19	23.8 Å²	23.8	13%	0.133	14%	0.135	C	C	.	.			trans	-63.7	125.2	178.2	-176.6	0	0	0	0	111.5	T156 T162 G163	T156-S160 PolarHBondContact O-N 3.38Å; S160-T162 PolarHBondContact OG-N 2.86Å; S160-T162 PolarHBondContact OG-OG1 3.32Å; S160-G163 PolarHBondContact OG-N 3.11Å; S160-G163 VanDerWaalsContact OG-N 3.15Å
161	N	93.7	Very high	97.6	Very high	140 Å²	140	23.8 Å²	23.8	75%	0.749	14%	0.135	S	C	*	.	S	Bend	trans	-78.2	-22.1	174.8	-65.6	-51.4	0	0	0	113	T159	T159-N161 PolarHBondContact O-N 3.09Å
162	T	96.3	Very high	97.5	Very high	76 Å²	76	22.8 Å²	22.8	47%	0.466	13%	0.13	S	C	.	.	S	Bend	trans	-99.4	-24.3	-173.6	64.8	0	0	0	0	112.7	K93 S160 N164	K93-T162 WeakPolarHBondContact CE-O 3.36Å; K93-T162 PolarHBondContact NZ-O 3.4Å; S160-T162 PolarHBondContact OG-N 2.86Å; S160-T162 PolarHBondContact OG-OG1 3.32Å; T162-N164 PolarHBondContact O-N 3.43Å; T162-N164 WeakPolarHBondContact OG1-CB 3.46Å; T162-N164 PolarHBondContact OG1-N 2.92Å; T162-N164 VanDerWaalsContact OG1-N 3.15Å
163	G	96.5	Very high	97.5	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.01	13%	0.13	C	C	.	.			trans	70.4	6.1	-170.2	0	0	0	0	0	114	G91 S92 K93 S160	G91-G163 WeakPolarHBondContact O-CA 3.28Å; S92-G163 CarbonylContact C-O 3.37Å; S92-G163 WeakPolarHBondContact CA-O 3.36Å; K93-G163 PolarHBondContact N-O 2.87Å; S160-G163 PolarHBondContact OG-N 3.11Å; S160-G163 VanDerWaalsContact OG-N 3.15Å
164	N	98.3	Very high	97.5	Very high	17 Å²	17	22.4 Å²	22.4	9%	0.091	13%	0.128	C	C	.	.			trans	-79.9	121.2	177.2	-63.2	-7.5	0	0	0	108.6	G43 Q44 K93 T162 H166 G167 Q168	G43-N164 CarbonylContact O-C 2.93Å; G43-N164 VanDerWaalsContact O-C 3.25Å; G43-N164 WeakPolarHBondContact O-CA 3.25Å; G43-N164 WeakPolarHBondContact O-CB 3.38Å; Q44-N164 HydrophobicContact CB-CB 4.42Å; K93-N164 PolarHBondContact NZ-OD1 2.95Å; K93-N164 VanDerWaalsContact NZ-OD1 3.15Å; T162-N164 PolarHBondContact O-N 3.43Å; T162-N164 WeakPolarHBondContact OG1-CB 3.46Å; T162-N164 PolarHBondContact OG1-N 2.92Å; T162-N164 VanDerWaalsContact OG1-N 3.15Å; N164-H166 VanDerWaalsContact C-N 3.27Å; N164-H166 PolarHBondContact O-N 3.18Å; N164-G167 PolarHBondContact O-N 3.22Å; N164-Q168 PolarHBondContact O-NE2 3.31Å
165	I	98.4	Very high	97.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-72.2	-18.5	-175.4	-56.7	-176.8	0	0	0	112.5	G43 K93 V95 V98 I130 G167 Q168 P169 Y172	G43-I165 PolarHBondContact O-N 2.94Å; K93-I165 WeakPolarHBondContact O-CD1 3.48Å; V95-I165 HydrophobicContact CB-CD1 4.45Å; V95-I165 HydrophobicContact CG2-CD1 3.99Å; V98-I165 HydrophobicContact CB-CD1 3.96Å; V98-I165 HydrophobicContact CG1-CB 4.28Å; V98-I165 HydrophobicContact CG1-CD1 4.1Å; V98-I165 HydrophobicContact CG1-CG2 3.86Å; V98-I165 HydrophobicContact CG2-CB 4.48Å; V98-I165 HydrophobicContact CG2-CD1 4Å; I130-I165 HydrophobicContact CD1-CG2 4.13Å; I165-G167 PolarHBondContact O-N 3.47Å; I165-Q168 HydrophobicContact CG2-CB 4.42Å; I165-Q168 WeakPolarHBondContact O-CB 3.44Å; I165-Q168 PolarHBondContact O-N 3.31Å; I165-P169 VanDerWaalsContact O-CD 3.32Å; I165-P169 WeakPolarHBondContact O-CD 3.45Å; I165-Y172 HydrophobicContact CG2-CE2 3.95Å
166	H	98.6	Very high	97.5	Very high	23 Å²	23	31 Å²	31	11%	0.106	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-60.6	-27.7	175.6	80.6	145.1	0	0	0	113.1	G43 Q44 D125 H126 D153 N164 Q168 P169 E302	G43-H166 PolarHBondContact O-N 2.86Å; Q44-H166 HydrophobicContact CB-CB 4.23Å; Q44-H166 HydrophobicContact CG-CB 4.38Å; D125-H166 HydrophobicContact CB-CB 4.16Å; H126-H166 HydrophobicContact CB-CB 4.44Å; D153-H166 VanDerWaalsContact OD2-O 3.11Å; N164-H166 VanDerWaalsContact C-N 3.27Å; N164-H166 PolarHBondContact O-N 3.18Å; H166-Q168 VanDerWaalsContact C-N 3.31Å; H166-Q168 PolarHBondContact O-N 2.86Å; H166-P169 WeakPolarHBondContact O-CD 3.39Å; H166-E302 IonicContact CG-OE1 3.96Å; H166-E302 IonicContact ND1-OE1 3.88Å; H166-E302 PolarHBondContact ND1-OE1 3.36Å
167	G	98.6	Very high	97.5	Very high	12 Å²	12	31.1 Å²	31.1	12%	0.124	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-90.6	14.5	173.9	0	0	0	0	0	114.2	D153 N155 N164 I165	D153-G167 CarbonylContact C-O 3.36Å; D153-G167 WeakPolarHBondContact CA-O 3.33Å; D153-G167 WeakPolarHBondContact OD1-CA 3.25Å; N155-G167 WeakPolarHBondContact CB-O 3.5Å; N155-G167 PolarHBondContact N-O 3.32Å; N164-G167 PolarHBondContact O-N 3.22Å; I165-G167 PolarHBondContact O-N 3.47Å
168	Q	98.6	Very high	97.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.189	C	C	.	.			trans	-124.4	-9.2	-177.5	-54.8	176.6	18.4	0	0	116.8	S92 D153 N155 N164 I165 H166 M170 S171 Y172	S92-Q168 PolarHBondContact OG-NE2 2.84Å; S92-Q168 VanDerWaalsContact OG-NE2 3.14Å; S92-Q168 PolarHBondContact OG-OE1 3.27Å; D153-Q168 CarbonylContact O-C 3.52Å; N155-Q168 HydrophobicContact CB-CG 4.15Å; N155-Q168 WeakPolarHBondContact O-CA 3.36Å; N155-Q168 WeakPolarHBondContact O-CB 3.36Å; N155-Q168 WeakPolarHBondContact O-CG 3.49Å; N164-Q168 PolarHBondContact O-NE2 3.31Å; I165-Q168 HydrophobicContact CG2-CB 4.42Å; I165-Q168 WeakPolarHBondContact O-CB 3.44Å; I165-Q168 PolarHBondContact O-N 3.31Å; H166-Q168 VanDerWaalsContact C-N 3.31Å; H166-Q168 PolarHBondContact O-N 2.86Å; Q168-M170 VanDerWaalsContact C-N 3.28Å; Q168-M170 PolarHBondContact O-N 2.85Å; Q168-M170 VanDerWaalsContact O-N 3.11Å; Q168-S171 WeakPolarHBondContact O-CB 3.45Å; Q168-S171 PolarHBondContact O-N 2.7Å; Q168-S171 PolarHBondContact O-OG 2.88Å; Q168-Y172 HydrophobicContact CB-CD2 4.38Å; Q168-Y172 HydrophobicContact CB-CE2 3.61Å; Q168-Y172 WeakPolarHBondContact O-CD2 3.36Å; Q168-Y172 WeakPolarHBondContact O-CE2 3.44Å; Q168-Y172 PolarHBondContact OE1-OH 3.1Å
169	P	98.7	Very high	97.5	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-55.5	-38.5	-163.2	24.7	-37.2	0	0	0	113.7	A129 I130 W147 D153 I165 H166 S171 Y172 L173	A129-P169 HydrophobicContact CB-CB 4.1Å; A129-P169 HydrophobicContact CB-CG 4.47Å; I130-P169 HydrophobicContact CD1-CB 4.33Å; I130-P169 HydrophobicContact CG1-CB 3.66Å; W147-P169 HydrophobicContact CH2-CB 4.22Å; W147-P169 HydrophobicContact CH2-CG 3.59Å; W147-P169 HydrophobicContact CZ2-CG 3.92Å; D153-P169 HydrophobicContact CB-CG 3.9Å; D153-P169 VanDerWaalsContact O-CD 3.32Å; D153-P169 WeakPolarHBondContact O-CD 3.2Å; I165-P169 VanDerWaalsContact O-CD 3.32Å; I165-P169 WeakPolarHBondContact O-CD 3.45Å; H166-P169 WeakPolarHBondContact O-CD 3.39Å; P169-S171 VanDerWaalsContact C-N 3.26Å; P169-S171 PolarHBondContact O-N 2.88Å; P169-Y172 WeakPolarHBondContact O-CB 3.34Å; P169-Y172 PolarHBondContact O-N 2.81Å; P169-Y172 VanDerWaalsContact O-N 3.16Å; P169-L173 PolarHBondContact O-N 3.25Å
170	M	98.7	Very high	97.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-66.9	-29.3	-177.6	-168.9	56.2	61.3	0	0	112.5	V145 W147 D153 I154 Q168 Y172 L173 L174 L199 Y201	V145-M170 HydrophobicContact CG1-CE 4.26Å; W147-M170 HydrophobicContact CD2-CE 4.12Å; W147-M170 HydrophobicContact CE3-CE 3.26Å; W147-M170 HydrophobicContact CH2-CE 4.33Å; W147-M170 HydrophobicContact CZ3-CE 3.4Å; D153-M170 WeakPolarHBondContact O-CB 3.47Å; D153-M170 PolarHBondContact O-N 3.33Å; I154-M170 HydrophobicContact CB-CB 4.09Å; I154-M170 HydrophobicContact CD1-CB 4.48Å; I154-M170 HydrophobicContact CD1-CG 4.03Å; I154-M170 HydrophobicContact CG1-CB 4.01Å; I154-M170 HydrophobicContact CG1-CG 4.08Å; Q168-M170 VanDerWaalsContact C-N 3.28Å; Q168-M170 PolarHBondContact O-N 2.85Å; Q168-M170 VanDerWaalsContact O-N 3.11Å; M170-Y172 PolarHBondContact O-N 2.89Å; M170-L173 PolarHBondContact O-N 3.44Å; M170-L173 VanDerWaalsContact O-N 3.12Å; M170-L173 HydrophobicContact SD-CB 4.22Å; M170-L173 HydrophobicContact SD-CD1 4.47Å; M170-L174 HydrophobicContact CG-CD1 3.85Å; M170-L174 HydrophobicContact CG-CG 3.94Å; M170-L174 WeakPolarHBondContact O-CG 3.4Å; M170-L174 PolarHBondContact O-N 3.41Å; M170-L174 VanDerWaalsContact O-N 3.14Å; M170-L174 HydrophobicContact SD-CD1 4.47Å; M170-L174 HydrophobicContact SD-CD2 4.2Å; M170-L174 HydrophobicContact SD-CG 3.97Å; M170-L199 HydrophobicContact CE-CD1 3.77Å; M170-L199 HydrophobicContact CE-CD2 4.11Å; M170-L199 HydrophobicContact CG-CD2 3.75Å; M170-L199 HydrophobicContact SD-CD1 4.38Å; M170-L199 HydrophobicContact SD-CD2 3.74Å; M170-Y201 WeakPolarHBondContact CG-OH 3.48Å
171	S	98.3	Very high	97.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.6	-32.2	176.4	77.2	0	0	0	0	112.7	N155 Q168 P169 L181	N155-S171 VanDerWaalsContact O-CB 3.25Å; N155-S171 WeakPolarHBondContact O-CB 3.38Å; N155-S171 PolarHBondContact O-OG 2.87Å; Q168-S171 WeakPolarHBondContact O-CB 3.45Å; Q168-S171 PolarHBondContact O-N 2.7Å; Q168-S171 PolarHBondContact O-OG 2.88Å; P169-S171 VanDerWaalsContact C-N 3.26Å; P169-S171 PolarHBondContact O-N 2.88Å; S171-L181 WeakPolarHBondContact O-CD1 3.32Å
172	Y	98.1	Very high	97.1	Very high	1 Å²	1	34.7 Å²	34.7	0%	0.004	18%	0.18	C	C	.	.	H	α-helix	trans	-71.9	-31.9	176.7	-63.1	-95.6	0	0	0	112.2	I130 I165 Q168 P169 M170 L181 L184 F187 M190	I130-Y172 HydrophobicContact CD1-CD2 3.71Å; I130-Y172 HydrophobicContact CD1-CE2 4.12Å; I130-Y172 HydrophobicContact CD1-CG 3.95Å; I130-Y172 HydrophobicContact CG1-CD2 4.3Å; I130-Y172 HydrophobicContact CG1-CG 4.43Å; I165-Y172 HydrophobicContact CG2-CE2 3.95Å; Q168-Y172 HydrophobicContact CB-CD2 4.38Å; Q168-Y172 HydrophobicContact CB-CE2 3.61Å; Q168-Y172 WeakPolarHBondContact O-CD2 3.36Å; Q168-Y172 WeakPolarHBondContact O-CE2 3.44Å; Q168-Y172 PolarHBondContact OE1-OH 3.1Å; P169-Y172 WeakPolarHBondContact O-CB 3.34Å; P169-Y172 PolarHBondContact O-N 2.81Å; P169-Y172 VanDerWaalsContact O-N 3.16Å; M170-Y172 PolarHBondContact O-N 2.89Å; Y172-L181 HydrophobicContact CD1-CD1 4.46Å; Y172-L184 HydrophobicContact CE1-CD1 3.5Å; Y172-F187 HydrophobicContact CD1-CD1 4.08Å; Y172-F187 AromaticContact CD1-CE1 3.92Å; Y172-F187 HydrophobicContact CD1-CE1 3.92Å; Y172-F187 HydrophobicContact CE1-CD1 4.21Å; Y172-F187 AromaticContact CE1-CE1 3.89Å; Y172-F187 HydrophobicContact CE1-CE1 3.89Å; Y172-F187 HydrophobicContact CE1-CZ 4.1Å; Y172-M190 HydrophobicContact CD1-CE 4.07Å
173	L	98.6	Very high	96.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-89.9	-26	-169.8	-66.7	168.3	0	0	0	113.4	I133 P169 M170 P192 C193 V194	I133-L173 HydrophobicContact CB-CD1 3.93Å; I133-L173 HydrophobicContact CB-CD2 4.2Å; I133-L173 HydrophobicContact CD1-CD1 3.62Å; I133-L173 HydrophobicContact CG1-CD1 4.3Å; I133-L173 HydrophobicContact CG2-CD1 4.14Å; I133-L173 HydrophobicContact CG2-CD2 4.21Å; P169-L173 PolarHBondContact O-N 3.25Å; M170-L173 PolarHBondContact O-N 3.44Å; M170-L173 VanDerWaalsContact O-N 3.12Å; M170-L173 HydrophobicContact SD-CB 4.22Å; M170-L173 HydrophobicContact SD-CD1 4.47Å; L173-P192 CarbonylContact O-C 3.56Å; L173-P192 WeakPolarHBondContact O-CA 3.18Å; L173-C193 PolarHBondContact O-N 2.8Å; L173-V194 HydrophobicContact CB-CG2 4.24Å; L173-V194 PolarHBondContact O-N 2.89Å
174	L	98.6	Very high	96.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-77.9	126	-175.2	-74.1	176.2	0	0	0	113.4	I154 M170 E176 L177 Q178 V194 L199 L218	I154-L174 HydrophobicContact CD1-CD1 3.51Å; I154-L174 HydrophobicContact CG1-CD1 4.21Å; M170-L174 HydrophobicContact CG-CD1 3.85Å; M170-L174 HydrophobicContact CG-CG 3.94Å; M170-L174 WeakPolarHBondContact O-CG 3.4Å; M170-L174 PolarHBondContact O-N 3.41Å; M170-L174 VanDerWaalsContact O-N 3.14Å; M170-L174 HydrophobicContact SD-CD1 4.47Å; M170-L174 HydrophobicContact SD-CD2 4.2Å; M170-L174 HydrophobicContact SD-CG 3.97Å; L174-E176 PolarHBondContact O-N 3.36Å; L174-L177 HydrophobicContact CB-CB 4.28Å; L174-L177 HydrophobicContact CB-CD1 4.26Å; L174-L177 HydrophobicContact CB-CG 4.26Å; L174-L177 HydrophobicContact CD1-CD1 3.93Å; L174-L177 HydrophobicContact CD1-CG 4.49Å; L174-L177 PolarHBondContact O-N 2.91Å; L174-L177 VanDerWaalsContact O-N 3.16Å; L174-Q178 PolarHBondContact O-N 3Å; L174-V194 CarbonylContact C-O 3.46Å; L174-V194 VanDerWaalsContact CA-O 3.29Å; L174-V194 WeakPolarHBondContact CA-O 3.33Å; L174-V194 HydrophobicContact CD2-CB 4.24Å; L174-V194 HydrophobicContact CD2-CG1 4.01Å; L174-L199 HydrophobicContact CD2-CD2 4.39Å; L174-L218 HydrophobicContact CD1-CD1 4.07Å
175	Y	98.3	Very high	96.6	Very high	121 Å²	121	39.2 Å²	39.2	48%	0.475	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-55.1	-41.1	174.4	-66.9	-64.6	0	0	0	111.6	L177 Q178 P192 C193 V194	Y175-L177 PolarHBondContact O-N 3.35Å; Y175-Q178 WeakPolarHBondContact O-CB 3.28Å; Y175-Q178 PolarHBondContact O-N 3.08Å; Y175-P192 HydrophobicContact CD1-CB 3.88Å; Y175-P192 HydrophobicContact CE1-CB 4.44Å; Y175-P192 WeakPolarHBondContact CE1-O 3.43Å; Y175-P192 HydrophobicContact CG-CB 4.43Å; Y175-C193 WeakPolarHBondContact OH-CA 3.41Å; Y175-C193 PolarHBondContact OH-O 2.89Å; Y175-V194 WeakPolarHBondContact CD2-O 3.43Å; Y175-V194 PolarHBondContact N-O 3Å
176	E	98.4	Very high	96.4	Very high	66 Å²	66	42.4 Å²	42.4	31%	0.308	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-68.1	-18.8	-175.2	-60	82.5	178.1	0	0	112.9	L174 S195 S196 L218	L174-E176 PolarHBondContact O-N 3.36Å; E176-S195 WeakPolarHBondContact OE1-CA 3.24Å; E176-S195 PolarHBondContact OE1-OG 3.33Å; E176-S196 PolarHBondContact OE1-N 2.64Å; E176-S196 VanDerWaalsContact OE1-N 3.12Å; E176-S196 PolarHBondContact OE2-N 3.21Å; E176-S196 VanDerWaalsContact OE2-N 3.13Å; E176-L218 HydrophobicContact CB-CD1 4.15Å; E176-L218 HydrophobicContact CB-CD2 3.65Å; E176-L218 HydrophobicContact CG-CD2 4.29Å
177	L	97.7	Very high	96.3	Very high	9 Å²	9	41.9 Å²	41.9	5%	0.047	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-102.9	-0.6	179.7	-65.9	178.7	0	0	0	114	I154 L174 Y175 S179 K180 I214 L218	I154-L177 HydrophobicContact CD1-CD1 4.39Å; I154-L177 HydrophobicContact CG1-CD1 4.06Å; L174-L177 HydrophobicContact CB-CB 4.28Å; L174-L177 HydrophobicContact CB-CD1 4.26Å; L174-L177 HydrophobicContact CB-CG 4.26Å; L174-L177 HydrophobicContact CD1-CD1 3.93Å; L174-L177 HydrophobicContact CD1-CG 4.49Å; L174-L177 PolarHBondContact O-N 2.91Å; L174-L177 VanDerWaalsContact O-N 3.16Å; Y175-L177 PolarHBondContact O-N 3.35Å; L177-S179 PolarHBondContact O-N 3.35Å; L177-S179 VanDerWaalsContact O-N 3.11Å; L177-K180 HydrophobicContact CD2-CG 4.3Å; L177-K180 WeakPolarHBondContact O-CA 3.47Å; L177-K180 WeakPolarHBondContact O-CB 3.39Å; L177-K180 PolarHBondContact O-N 3.07Å; L177-I214 HydrophobicContact CD1-CG2 3.93Å; L177-I214 HydrophobicContact CD2-CG2 4.23Å; L177-L218 HydrophobicContact CD1-CD1 4.22Å; L177-L218 HydrophobicContact CD2-CD1 4.04Å; L177-L218 HydrophobicContact CG-CD1 3.92Å
178	Q	95.9	Very high	96.1	Very high	118 Å²	118	46.9 Å²	46.9	55%	0.551	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-51.4	-42.5	-178.2	-169.5	177	26.1	0	0	113	L174 Y175 K180 L181 P192	L174-Q178 PolarHBondContact O-N 3Å; Y175-Q178 WeakPolarHBondContact O-CB 3.28Å; Y175-Q178 PolarHBondContact O-N 3.08Å; Q178-K180 PolarHBondContact O-N 3.07Å; Q178-L181 PolarHBondContact O-N 3.03Å; Q178-P192 HydrophobicContact CB-CG 3.87Å; Q178-P192 HydrophobicContact CG-CG 3.8Å
179	S	95.1	Very high	96	Very high	98 Å²	98	48.8 Å²	48.8	69%	0.685	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-69.2	-10.5	179.9	68.1	0	0	0	0	114.4	L177	L177-S179 PolarHBondContact O-N 3.35Å; L177-S179 VanDerWaalsContact O-N 3.11Å
180	K	94.4	Very high	95.8	Very high	123 Å²	123	50 Å²	50	54%	0.535	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-99.8	-8.3	-179.5	-53.4	-54.4	-180	-173.9	0	112.8	T156 L177 Q178	T156-K180 HydrophobicContact CG2-CB 4.3Å; L177-K180 HydrophobicContact CD2-CG 4.3Å; L177-K180 WeakPolarHBondContact O-CA 3.47Å; L177-K180 WeakPolarHBondContact O-CB 3.39Å; L177-K180 PolarHBondContact O-N 3.07Å; Q178-K180 PolarHBondContact O-N 3.07Å
181	L	92.9	Very high	95.6	Very high	31 Å²	31	57 Å²	57	16%	0.162	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-91.1	123.1	176.5	-60.6	174.3	0	0	0	110	P157 S171 Y172 Q178 M190	P157-L181 HydrophobicContact CG-CD2 4.32Å; S171-L181 WeakPolarHBondContact O-CD1 3.32Å; Y172-L181 HydrophobicContact CD1-CD1 4.46Å; Q178-L181 PolarHBondContact O-N 3.03Å; L181-M190 HydrophobicContact CD1-CE 4.28Å
182	P	91.1	Very high	95.6	Very high	32 Å²	32	57.6 Å²	57.6	21%	0.208	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-68.1	160.7	169.6	30.5	-33.8	0	0	0	110.2	N90 P157 L184	N90-P182 HydrophobicContact CB-CG 4.24Å; N90-P182 WeakPolarHBondContact ND2-CB 3.07Å; N90-P182 WeakPolarHBondContact ND2-CG 3.49Å; P157-P182 HydrophobicContact CB-CG 4.42Å; P182-L184 HydrophobicContact CG-CD2 4.15Å; P182-L184 HydrophobicContact CG-CG 4.35Å; P182-L184 WeakPolarHBondContact O-CG 3.47Å; P182-L184 PolarHBondContact O-N 3.33Å
183	P	90.7	Very high	95.6	Very high	128 Å²	128	58.3 Å²	58.3	83%	0.831	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-57.8	125.3	165.3	-21.8	33.3	0	0	0	110
184	L	93.6	Very high	95.5	Very high	21 Å²	21	58.4 Å²	58.4	11%	0.11	31%	0.311	C	S	.	.			trans	-120	138.6	-179.5	-67	168.1	0	0	0	110.3	V89 V95 P157 Y172 P182 F187	V89-L184 HydrophobicContact CB-CD2 4.41Å; V89-L184 HydrophobicContact CG1-CD2 3.89Å; V95-L184 HydrophobicContact CG1-CB 3.97Å; V95-L184 HydrophobicContact CG1-CD2 4.08Å; V95-L184 HydrophobicContact CG1-CG 4.42Å; P157-L184 HydrophobicContact CG-CD1 4.03Å; Y172-L184 HydrophobicContact CE1-CD1 3.5Å; P182-L184 HydrophobicContact CG-CD2 4.15Å; P182-L184 HydrophobicContact CG-CG 4.35Å; P182-L184 WeakPolarHBondContact O-CG 3.47Å; P182-L184 PolarHBondContact O-N 3.33Å; L184-F187 HydrophobicContact CB-CB 4.12Å; L184-F187 HydrophobicContact CB-CD2 3.84Å; L184-F187 HydrophobicContact CB-CG 4.25Å; L184-F187 PolarHBondContact O-N 3.14Å
185	P	94.4	Very high	95.5	Very high	40 Å²	40	59.5 Å²	59.5	26%	0.26	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	142.5	178.3	30.1	-36.8	0	0	0	110.6	V89 V95 R96 F187	V89-P185 HydrophobicContact CG2-CG 4.07Å; V95-P185 HydrophobicContact CG1-CG 4.07Å; R96-P185 HydrophobicContact CG-CB 3.89Å; R96-P185 HydrophobicContact CG-CG 3.69Å; P185-F187 WeakPolarHBondContact O-CD2 3.47Å; P185-F187 PolarHBondContact O-N 2.93Å
186	N	95.8	Very high	95.4	Very high	68 Å²	68	54 Å²	54	36%	0.364	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	60	18.8	-177.9	-58	14.6	0	0	0	115.2	R96 G99 S100 W189	R96-N186 PolarHBondContact O-ND2 3.3Å; G99-N186 CarbonylContact C-O 3.59Å; G99-N186 WeakPolarHBondContact CA-O 3.46Å; S100-N186 PolarHBondContact OG-ND2 3.08Å; N186-W189 PolarHBondContact O-NE1 2.93Å
187	F	96.4	Very high	95.3	Very high	11 Å²	11	58 Å²	58	5%	0.048	31%	0.31	C	S	.	.			trans	-112.2	5.3	169.8	-79.9	-90	0	0	0	113.5	V95 V98 G99 I130 Y172 L184 P185 W189 M190	V95-F187 HydrophobicContact CG1-CD2 3.96Å; V95-F187 HydrophobicContact CG1-CE2 3.7Å; V95-F187 VanDerWaalsContact O-CE2 3.25Å; V95-F187 WeakPolarHBondContact O-CE2 3.2Å; V98-F187 HydrophobicContact CG1-CZ 4.16Å; G99-F187 VanDerWaalsContact CA-CE2 3.5Å; I130-F187 HydrophobicContact CD1-CE1 4.04Å; I130-F187 HydrophobicContact CD1-CZ 4.46Å; I130-F187 HydrophobicContact CG2-CE1 4.36Å; Y172-F187 HydrophobicContact CD1-CD1 4.08Å; Y172-F187 AromaticContact CD1-CE1 3.92Å; Y172-F187 HydrophobicContact CD1-CE1 3.92Å; Y172-F187 HydrophobicContact CE1-CD1 4.21Å; Y172-F187 AromaticContact CE1-CE1 3.89Å; Y172-F187 HydrophobicContact CE1-CE1 3.89Å; Y172-F187 HydrophobicContact CE1-CZ 4.1Å; L184-F187 HydrophobicContact CB-CB 4.12Å; L184-F187 HydrophobicContact CB-CD2 3.84Å; L184-F187 HydrophobicContact CB-CG 4.25Å; L184-F187 PolarHBondContact O-N 3.14Å; P185-F187 WeakPolarHBondContact O-CD2 3.47Å; P185-F187 PolarHBondContact O-N 2.93Å; F187-W189 PolarHBondContact O-N 3.49Å; F187-W189 VanDerWaalsContact O-N 3.11Å; F187-M190 HydrophobicContact CD1-CB 4.47Å; F187-M190 WeakPolarHBondContact O-CB 3.46Å; F187-M190 PolarHBondContact O-N 3.36Å
188	S	94.6	Very high	95.3	Very high	117 Å²	117	58.6 Å²	58.6	82%	0.818	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-19.5	-177	59.1	0	0	0	0	114.7	M190	S188-M190 VanDerWaalsContact C-N 3.34Å
189	W	96.3	Very high	95.4	Very high	40 Å²	40	53 Å²	53	15%	0.152	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-23.7	174.7	61.8	-90.4	0	0	0	112.4	G99 N102 Q103 I130 H134 N186 F187	G99-W189 PolarHBondContact O-NE1 3.09Å; N102-W189 VanDerWaalsContact C-CZ2 3.45Å; N102-W189 HydrophobicContact CB-CH2 3.93Å; N102-W189 HydrophobicContact CB-CZ2 3.72Å; N102-W189 WeakPolarHBondContact O-CH2 3.39Å; Q103-W189 VanDerWaalsContact CA-CZ2 3.49Å; Q103-W189 HydrophobicContact CB-CD2 3.88Å; Q103-W189 HydrophobicContact CB-CG 4.1Å; Q103-W189 HydrophobicContact CB-CZ2 3.96Å; Q103-W189 HydrophobicContact CG-CB 4.28Å; Q103-W189 HydrophobicContact CG-CD2 3.75Å; Q103-W189 HydrophobicContact CG-CE3 4.36Å; Q103-W189 HydrophobicContact CG-CG 3.66Å; I130-W189 HydrophobicContact CG2-CH2 4.34Å; H134-W189 HydrophobicContact CB-CZ3 4.18Å; H134-W189 AromaticContact CE1-CE3 3.82Å; H134-W189 AromaticContact CE1-CZ3 3.82Å; H134-W189 AromaticContact CG-CZ3 3.72Å; H134-W189 AromaticContact ND1-CE3 3.92Å; H134-W189 AromaticContact ND1-CZ3 3.45Å; H134-W189 WeakPolarHBondContact ND1-CZ3 3.25Å; N186-W189 PolarHBondContact O-NE1 2.93Å; F187-W189 PolarHBondContact O-N 3.49Å; F187-W189 VanDerWaalsContact O-N 3.11Å
190	M	93.6	Very high	95.6	Very high	26 Å²	26	48.3 Å²	48.3	13%	0.128	25%	0.254	C	S	.	.			trans	-81.7	132.6	-173.7	-176.1	-76.4	-67.1	0	0	109.8	I130 Y172 L181 F187 S188	I130-M190 HydrophobicContact CG2-CG 4.26Å; Y172-M190 HydrophobicContact CD1-CE 4.07Å; L181-M190 HydrophobicContact CD1-CE 4.28Å; F187-M190 HydrophobicContact CD1-CB 4.47Å; F187-M190 WeakPolarHBondContact O-CB 3.46Å; F187-M190 PolarHBondContact O-N 3.36Å; S188-M190 VanDerWaalsContact C-N 3.34Å
191	K	94.6	Very high	95.8	Very high	148 Å²	148	42.5 Å²	42.5	64%	0.643	23%	0.229	S	C	*	.			trans	-124.1	140.3	165.7	-63.1	179.2	-176.9	177.6	0	107.8	C193	K191-C193 PolarHBondContact O-N 3.25Å
192	P	97.5	Very high	96.1	Very high	12 Å²	12	41 Å²	41	8%	0.078	22%	0.221	C	C	.	.			trans	-51.8	140.9	171	-25.9	34.4	0	0	0	110.3	L173 Y175 Q178	L173-P192 CarbonylContact O-C 3.56Å; L173-P192 WeakPolarHBondContact O-CA 3.18Å; Y175-P192 HydrophobicContact CD1-CB 3.88Å; Y175-P192 HydrophobicContact CE1-CB 4.44Å; Y175-P192 WeakPolarHBondContact CE1-O 3.43Å; Y175-P192 HydrophobicContact CG-CB 4.43Å; Q178-P192 HydrophobicContact CB-CG 3.87Å; Q178-P192 HydrophobicContact CG-CG 3.8Å
193	C	98.3	Very high	96.4	Very high	16 Å²	16	39.5 Å²	39.5	11%	0.108	21%	0.211	C	C	.	.			trans	-138.8	-3.5	-170.2	62	0	0	0	0	114	T137 L173 Y175 K191	T137-C193 HydrophobicContact CG2-CB 4.24Å; T137-C193 WeakPolarHBondContact OG1-CB 3.32Å; T137-C193 PolarHBondContact OG1-SG 2.95Å; L173-C193 PolarHBondContact O-N 2.8Å; Y175-C193 WeakPolarHBondContact OH-CA 3.41Å; Y175-C193 PolarHBondContact OH-O 2.89Å; K191-C193 PolarHBondContact O-N 3.25Å
194	V	98	Very high	96.8	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.012	17%	0.173	C	C	.	.	B	Isolated β-bridge	trans	-120.8	138.3	-178.4	-177.3	0	0	0	0	109.4	I133 V145 L173 L174 Y175	I133-V194 HydrophobicContact CG2-CG2 3.61Å; V145-V194 HydrophobicContact CG2-CG1 4.07Å; V145-V194 HydrophobicContact CG2-CG2 4.06Å; L173-V194 HydrophobicContact CB-CG2 4.24Å; L173-V194 PolarHBondContact O-N 2.89Å; L174-V194 CarbonylContact C-O 3.46Å; L174-V194 VanDerWaalsContact CA-O 3.29Å; L174-V194 WeakPolarHBondContact CA-O 3.33Å; L174-V194 HydrophobicContact CD2-CB 4.24Å; L174-V194 HydrophobicContact CD2-CG1 4.01Å; Y175-V194 WeakPolarHBondContact CD2-O 3.43Å; Y175-V194 PolarHBondContact N-O 3Å
195	S	97.1	Very high	97.1	Very high	23 Å²	23	35.3 Å²	35.3	16%	0.161	18%	0.178	C	C	.	.			trans	-94.8	147.9	166.6	175.5	0	0	0	0	109.6	E176 R197 D198	E176-S195 WeakPolarHBondContact OE1-CA 3.24Å; E176-S195 PolarHBondContact OE1-OG 3.33Å; S195-R197 PolarHBondContact O-N 2.92Å; S195-R197 PolarHBondContact OG-N 3.42Å; S195-D198 PolarHBondContact O-N 2.78Å
196	S	97	Very high	97.3	Very high	6 Å²	6	37.6 Å²	37.6	4%	0.042	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-55.5	-24.1	175.1	70.5	0	0	0	0	113.3	E176 D198 L218	E176-S196 PolarHBondContact OE1-N 2.64Å; E176-S196 VanDerWaalsContact OE1-N 3.12Å; E176-S196 PolarHBondContact OE2-N 3.21Å; E176-S196 VanDerWaalsContact OE2-N 3.13Å; S196-D198 VanDerWaalsContact C-N 3.31Å; S196-L218 PolarHBondContact OG-O 3.05Å; S196-L218 VanDerWaalsContact OG-O 3.05Å
197	R	96.1	Very high	97.4	Very high	148 Å²	148	36.4 Å²	36.4	56%	0.558	18%	0.183	S	C	*	.	G	3₁₀ helix	trans	-76.4	-15.4	176.9	-63.6	-178.9	174.9	175.5	-0.3	114.5	S195 Y243	S195-R197 PolarHBondContact O-N 2.92Å; S195-R197 PolarHBondContact OG-N 3.42Å; R197-Y243 VanDerWaalsContact O-CE1 3.32Å; R197-Y243 WeakPolarHBondContact O-CE1 3.34Å
198	D	97.4	Very high	97.5	Very high	23 Å²	23	38.4 Å²	38.4	12%	0.123	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-101.6	9.9	178.3	-68.6	-40	0	0	0	111.8	S144 V145 S195 S196 K250	S144-D198 CarbonylContact C-O 3.5Å; S144-D198 WeakPolarHBondContact CA-O 3.47Å; V145-D198 PolarHBondContact N-O 3.15Å; S195-D198 PolarHBondContact O-N 2.78Å; S196-D198 VanDerWaalsContact C-N 3.31Å; D198-K250 IonicContact OD1-NZ 3.51Å; D198-K250 PolarHBondContact OD1-NZ 3.32Å; D198-K250 IonicContact OD2-NZ 2.81Å; D198-K250 PolarHBondContact OD2-NZ 3.47Å
199	L	98.3	Very high	97.7	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	130.9	-175.8	176.2	61.4	0	0	0	111	V145 W147 M170 L174 Y201 V220	V145-L199 HydrophobicContact CB-CD1 3.9Å; V145-L199 HydrophobicContact CG1-CD1 3.78Å; V145-L199 WeakPolarHBondContact O-CA 3.23Å; W147-L199 HydrophobicContact CB-CD1 4.11Å; M170-L199 HydrophobicContact CE-CD1 3.77Å; M170-L199 HydrophobicContact CE-CD2 4.11Å; M170-L199 HydrophobicContact CG-CD2 3.75Å; M170-L199 HydrophobicContact SD-CD1 4.38Å; M170-L199 HydrophobicContact SD-CD2 3.74Å; L174-L199 HydrophobicContact CD2-CD2 4.39Å; L199-Y201 HydrophobicContact CD1-CE2 4.27Å; L199-Y201 HydrophobicContact CD2-CD2 4.29Å; L199-Y201 HydrophobicContact CD2-CE2 3.47Å; L199-Y201 VanDerWaalsContact CD2-CE2 3.47Å; L199-Y201 HydrophobicContact CG-CD2 4.22Å; L199-Y201 HydrophobicContact CG-CE2 3.86Å; L199-V220 HydrophobicContact CB-CG1 4.43Å; L199-V220 HydrophobicContact CD2-CG1 4.03Å; L199-V220 HydrophobicContact CG-CG1 4.02Å
200	V	98.8	Very high	97.8	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	127.6	169.7	-178.7	0	0	0	0	109.4	V145 W147 I202 K221 F223 T240 Y243 L244	V145-V200 PolarHBondContact O-N 2.68Å; W147-V200 PolarHBondContact N-O 3.18Å; V200-I202 HydrophobicContact CG1-CG1 4.26Å; V200-K221 WeakPolarHBondContact CA-O 3.28Å; V200-K221 HydrophobicContact CG1-CG 4.18Å; V200-K221 HydrophobicContact CG2-CB 4.14Å; V200-K221 HydrophobicContact CG2-CG 4.15Å; V200-F223 HydrophobicContact CG1-CD2 3.76Å; V200-F223 HydrophobicContact CG1-CE2 3.79Å; V200-T240 HydrophobicContact CB-CG2 4.17Å; V200-T240 HydrophobicContact CG1-CG2 3.94Å; V200-T240 HydrophobicContact CG2-CG2 4.24Å; V200-Y243 HydrophobicContact CG2-CD1 3.54Å; V200-Y243 HydrophobicContact CG2-CE1 4Å; V200-Y243 HydrophobicContact CG2-CG 4.49Å; V200-L244 HydrophobicContact CG2-CD1 4.28Å; V200-L244 HydrophobicContact CG2-CD2 3.88Å; V200-L244 HydrophobicContact CG2-CG 3.93Å
201	Y	98.9	Very high	98	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	141.6	169.7	-72.7	-83.7	0	0	0	111.8	W147 A152 M170 L199 L204 M215 V220 K221 V222 F223	W147-Y201 HydrophobicContact CB-CD1 3.61Å; W147-Y201 HydrophobicContact CB-CE1 3.74Å; W147-Y201 HydrophobicContact CB-CG 4.36Å; W147-Y201 AromaticContact CD1-CD1 3.46Å; W147-Y201 VanDerWaalsContact CD1-CD1 3.46Å; W147-Y201 AromaticContact CD1-CE1 3.33Å; W147-Y201 HydrophobicContact CD2-CE1 4.1Å; W147-Y201 AromaticContact CG-CD1 3.66Å; W147-Y201 HydrophobicContact CG-CD1 3.66Å; W147-Y201 AromaticContact CG-CE1 3.43Å; W147-Y201 HydrophobicContact CG-CE1 3.43Å; W147-Y201 VanDerWaalsContact CG-CE1 3.43Å; W147-Y201 AromaticContact NE1-CE1 3.91Å; W147-Y201 CarbonylContact O-C 3.56Å; W147-Y201 WeakPolarHBondContact O-CA 3.43Å; A152-Y201 WeakPolarHBondContact O-CE1 3.17Å; A152-Y201 PolarHBondContact O-OH 3.39Å; M170-Y201 WeakPolarHBondContact CG-OH 3.48Å; L199-Y201 HydrophobicContact CD1-CE2 4.27Å; L199-Y201 HydrophobicContact CD2-CD2 4.29Å; L199-Y201 HydrophobicContact CD2-CE2 3.47Å; L199-Y201 VanDerWaalsContact CD2-CE2 3.47Å; L199-Y201 HydrophobicContact CG-CD2 4.22Å; L199-Y201 HydrophobicContact CG-CE2 3.86Å; Y201-L204 HydrophobicContact CD1-CD1 4.42Å; Y201-L204 HydrophobicContact CD1-CD2 3.85Å; Y201-L204 HydrophobicContact CD1-CG 4.47Å; Y201-L204 HydrophobicContact CG-CD1 4.1Å; Y201-L204 HydrophobicContact CG-CD2 4.24Å; Y201-L204 HydrophobicContact CG-CG 4.38Å; Y201-M215 HydrophobicContact CD2-SD 4.07Å; Y201-M215 HydrophobicContact CE2-SD 4.13Å; Y201-V220 HydrophobicContact CD2-CG1 3.66Å; Y201-V220 HydrophobicContact CE2-CG1 3.81Å; Y201-K221 PolarHBondContact N-O 2.94Å; Y201-V222 HydrophobicContact CD2-CG2 4.18Å; Y201-F223 PolarHBondContact O-N 2.89Å
202	I	98.9	Very high	98.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	127.8	174	-54.4	175.9	0	0	0	109	V146 W147 V148 D149 V200 F223 M233 V236 M237 T240 I285	V146-I202 HydrophobicContact CG1-CD1 3.96Å; W147-I202 PolarHBondContact O-N 2.92Å; V148-I202 WeakPolarHBondContact CA-O 3.4Å; V148-I202 HydrophobicContact CG2-CB 4.49Å; D149-I202 PolarHBondContact N-O 3.3Å; V200-I202 HydrophobicContact CG1-CG1 4.26Å; I202-F223 CarbonylContact C-O 3.45Å; I202-F223 WeakPolarHBondContact CA-O 3.45Å; I202-F223 HydrophobicContact CG1-CB 4.5Å; I202-F223 HydrophobicContact CG1-CD2 4.27Å; I202-M233 HydrophobicContact CG2-CE 4.11Å; I202-V236 HydrophobicContact CD1-CG1 4.19Å; I202-V236 HydrophobicContact CG1-CG1 4.33Å; I202-V236 HydrophobicContact CG2-CG1 4.16Å; I202-M237 HydrophobicContact CD1-SD 3.81Å; I202-T240 HydrophobicContact CD1-CG2 4.42Å; I202-I285 HydrophobicContact CG2-CD1 4.1Å
203	G	98.8	Very high	98.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.203	C	C	.	.	S	Bend	trans	104.2	0.4	173.3	0	0	0	0	0	115.8	D149 R205 F223	D149-G203 CarbonylContact O-C 3.51Å; D149-G203 WeakPolarHBondContact O-CA 3.39Å; G203-R205 PolarHBondContact O-N 2.96Å; G203-R205 PolarHBondContact O-NH1 3.12Å; G203-F223 PolarHBondContact N-O 3.42Å
204	L	98.9	Very high	98.3	Very high	4 Å²	4	40.5 Å²	40.5	2%	0.021	20%	0.201	C	C	.	.			trans	-56.2	133.6	-175.8	-58.4	-165.5	0	0	0	111.9	D149 A150 H151 A152 Y201 V207 M215 V222 S224 M225	D149-L204 PolarHBondContact O-N 3.18Å; A150-L204 WeakPolarHBondContact O-CA 3.05Å; H151-L204 WeakPolarHBondContact O-CD2 3.4Å; A152-L204 HydrophobicContact CB-CD1 4.4Å; Y201-L204 HydrophobicContact CD1-CD1 4.42Å; Y201-L204 HydrophobicContact CD1-CD2 3.85Å; Y201-L204 HydrophobicContact CD1-CG 4.47Å; Y201-L204 HydrophobicContact CG-CD1 4.1Å; Y201-L204 HydrophobicContact CG-CD2 4.24Å; Y201-L204 HydrophobicContact CG-CG 4.38Å; L204-V207 HydrophobicContact CB-CG2 3.99Å; L204-V207 HydrophobicContact CD1-CG2 4.12Å; L204-M215 HydrophobicContact CD1-CE 3.72Å; L204-M215 HydrophobicContact CD1-SD 3.67Å; L204-V222 HydrophobicContact CD1-CG1 3.58Å; L204-V222 HydrophobicContact CD1-CG2 4.33Å; L204-V222 HydrophobicContact CG-CG1 4.14Å; L204-S224 CarbonylContact O-C 3.56Å; L204-S224 VanDerWaalsContact O-CA 3.23Å; L204-S224 WeakPolarHBondContact O-CA 3.28Å; L204-S224 WeakPolarHBondContact O-CB 3.23Å; L204-M225 PolarHBondContact O-N 3.31Å
205	R	98.8	Very high	98.3	Very high	58 Å²	58	41 Å²	41	22%	0.219	20%	0.203	C	C	.	.			trans	-159	-8.3	177.6	62.8	-169.1	-179.9	-84	3.4	114.8	A150 G203 M225 D259 A260 A273 V274 G275	A150-R205 HydrophobicContact CB-CG 4.14Å; A150-R205 PolarHBondContact O-N 3.01Å; G203-R205 PolarHBondContact O-N 2.96Å; G203-R205 PolarHBondContact O-NH1 3.12Å; R205-M225 HydrophobicContact CB-CB 4.47Å; R205-M225 HydrophobicContact CB-CG 3.99Å; R205-M225 HydrophobicContact CG-CG 4.37Å; R205-D259 PolarHBondContact NH2-O 3.01Å; R205-A260 PolarHBondContact NH1-O 3.05Å; R205-A260 PolarHBondContact NH2-O 3.08Å; R205-A273 HydrophobicContact CG-CB 4.12Å; R205-A273 PolarHBondContact NE-O 3.22Å; R205-A273 PolarHBondContact NH2-O 3.37Å; R205-V274 WeakPolarHBondContact CD-O 3.38Å; R205-G275 WeakPolarHBondContact CD-O 3.14Å
206	D	98.5	Very high	98.4	Very high	88 Å²	88	46.9 Å²	46.9	47%	0.471	23%	0.226	S	C	.	.			trans	-131.5	96.3	170.1	-166.9	13.1	0	0	0	108.8	A150 H151 A273	A150-D206 PolarHBondContact O-N 2.88Å; H151-D206 WeakPolarHBondContact CA-O 3.41Å; H151-D206 PolarHBondContact CD2-O 2.78Å; H151-D206 IonicContact NE2-OD2 3.72Å; D206-A273 HydrophobicContact CB-CB 4.27Å
207	V	98.7	Very high	98.4	Very high	43 Å²	43	52 Å²	52	26%	0.261	25%	0.252	S	S	.	.			trans	-130.2	124.7	-169.1	179.9	0	0	0	0	109.2	A152 L204 E211 H212 M215	A152-V207 HydrophobicContact CB-CG1 4.29Å; L204-V207 HydrophobicContact CB-CG2 3.99Å; L204-V207 HydrophobicContact CD1-CG2 4.12Å; V207-E211 HydrophobicContact CG1-CB 3.79Å; V207-H212 HydrophobicContact CG1-CB 4Å; V207-M215 HydrophobicContact CG1-CE 3.56Å; V207-M215 HydrophobicContact CG2-CE 4.43Å
208	D	98.6	Very high	98.5	Very high	52 Å²	52	46.2 Å²	46.2	28%	0.278	23%	0.232	S	C	.	.			trans	-65	151.7	178.1	-82.2	-29.6	0	0	0	111.4	N155 A210 E211 H212	N155-D208 PolarHBondContact ND2-OD2 3.28Å; D208-A210 PolarHBondContact O-N 3.3Å; D208-A210 VanDerWaalsContact O-N 3.17Å; D208-E211 HydrophobicContact CB-CB 4.34Å; D208-E211 HydrophobicContact CB-CG 3.97Å; D208-E211 PolarHBondContact N-OE2 3.11Å; D208-E211 VanDerWaalsContact N-OE2 3.13Å; D208-E211 WeakPolarHBondContact O-CB 3.44Å; D208-E211 PolarHBondContact O-N 2.92Å; D208-E211 VanDerWaalsContact O-N 3.08Å; D208-H212 PolarHBondContact O-N 3.49Å
209	P	98.6	Very high	98.5	Very high	108 Å²	108	48.6 Å²	48.6	70%	0.701	26%	0.255	S	S	*	.	H	α-helix	trans	-54.7	-38	177	-28	35.2	0	0	0	114	Y213	P209-Y213 WeakPolarHBondContact O-CB 3.31Å; P209-Y213 PolarHBondContact O-N 3.5Å
210	A	98.3	Very high	98.5	Very high	29 Å²	29	49.2 Å²	49.2	24%	0.24	26%	0.259	C	S	.	.	H	α-helix	trans	-68.8	-40.6	178.4	0	0	0	0	0	111.9	T159 D208 Y213 I214	T159-A210 HydrophobicContact CG2-CB 4.01Å; D208-A210 PolarHBondContact O-N 3.3Å; D208-A210 VanDerWaalsContact O-N 3.17Å; A210-Y213 WeakPolarHBondContact O-CB 3.26Å; A210-Y213 PolarHBondContact O-N 3.16Å; A210-I214 VanDerWaalsContact O-CG1 3.27Å; A210-I214 WeakPolarHBondContact O-CG1 3.46Å; A210-I214 PolarHBondContact O-N 3.14Å
211	E	98.8	Very high	98.5	Very high	7 Å²	7	51.9 Å²	51.9	3%	0.033	27%	0.271	C	S	.	.	H	α-helix	trans	-65.4	-45.5	176.5	-64.8	-174.7	127.7	0	0	111.5	A152 D153 I154 N155 V207 D208 Y213 I214 M215	A152-E211 HydrophobicContact CB-CB 4.06Å; A152-E211 HydrophobicContact CB-CG 4.49Å; D153-E211 PolarHBondContact N-OE1 2.95Å; D153-E211 VanDerWaalsContact N-OE1 3.16Å; I154-E211 HydrophobicContact CG2-CB 3.63Å; I154-E211 HydrophobicContact CG2-CG 3.68Å; I154-E211 PolarHBondContact N-OE1 3.12Å; N155-E211 HydrophobicContact CB-CG 4.36Å; N155-E211 PolarHBondContact N-OE1 3.2Å; N155-E211 WeakPolarHBondContact ND2-CG 3.49Å; N155-E211 PolarHBondContact ND2-OE1 2.83Å; V207-E211 HydrophobicContact CG1-CB 3.79Å; D208-E211 HydrophobicContact CB-CB 4.34Å; D208-E211 HydrophobicContact CB-CG 3.97Å; D208-E211 PolarHBondContact N-OE2 3.11Å; D208-E211 VanDerWaalsContact N-OE2 3.13Å; D208-E211 WeakPolarHBondContact O-CB 3.44Å; D208-E211 PolarHBondContact O-N 2.92Å; D208-E211 VanDerWaalsContact O-N 3.08Å; E211-Y213 VanDerWaalsContact C-N 3.29Å; E211-Y213 PolarHBondContact O-N 3.11Å; E211-I214 PolarHBondContact O-N 3.31Å; E211-M215 WeakPolarHBondContact O-CG 3.26Å; E211-M215 PolarHBondContact O-N 2.87Å
212	H	98.8	Very high	98.5	Very high	97 Å²	97	53.7 Å²	53.7	45%	0.449	28%	0.282	S	S	.	.	H	α-helix	trans	-57.7	-43.6	174.2	178.2	-98.5	0	0	0	111.2	V207 D208 M215 K216	V207-H212 HydrophobicContact CG1-CB 4Å; D208-H212 PolarHBondContact O-N 3.49Å; H212-M215 PolarHBondContact O-N 2.98Å; H212-K216 WeakPolarHBondContact NE2-CE 3.32Å; H212-K216 WeakPolarHBondContact O-CG 3.3Å; H212-K216 PolarHBondContact O-N 3.44Å; H212-K216 VanDerWaalsContact O-N 3.07Å
213	Y	98.6	Very high	98.5	Very high	150 Å²	150	53.8 Å²	53.8	59%	0.588	28%	0.282	S	S	*	.	H	α-helix	trans	-60.4	-47.3	174.9	177.7	-94.9	0	0	0	112.2	P209 A210 E211 M215 K216 L217	P209-Y213 WeakPolarHBondContact O-CB 3.31Å; P209-Y213 PolarHBondContact O-N 3.5Å; A210-Y213 WeakPolarHBondContact O-CB 3.26Å; A210-Y213 PolarHBondContact O-N 3.16Å; E211-Y213 VanDerWaalsContact C-N 3.29Å; E211-Y213 PolarHBondContact O-N 3.11Å; Y213-M215 PolarHBondContact O-N 2.74Å; Y213-K216 PolarHBondContact O-N 3.05Å; Y213-L217 HydrophobicContact CE1-CB 4.46Å; Y213-L217 HydrophobicContact CE1-CD2 3.99Å; Y213-L217 VanDerWaalsContact O-CB 3.32Å; Y213-L217 WeakPolarHBondContact O-CB 3.43Å; Y213-L217 PolarHBondContact O-N 3.44Å
214	I	98.6	Very high	98.5	Very high	12 Å²	12	55 Å²	55	6%	0.062	29%	0.29	C	S	.	.	H	α-helix	trans	-58.6	-48.5	178.1	-70.7	164.7	0	0	0	110.6	I154 T156 L177 A210 E211 K216 L217 L218	I154-I214 HydrophobicContact CD1-CG2 3.71Å; I154-I214 HydrophobicContact CG1-CG2 4.01Å; T156-I214 HydrophobicContact CG2-CD1 4.37Å; L177-I214 HydrophobicContact CD1-CG2 3.93Å; L177-I214 HydrophobicContact CD2-CG2 4.23Å; A210-I214 VanDerWaalsContact O-CG1 3.27Å; A210-I214 WeakPolarHBondContact O-CG1 3.46Å; A210-I214 PolarHBondContact O-N 3.14Å; E211-I214 PolarHBondContact O-N 3.31Å; I214-K216 VanDerWaalsContact C-N 3.32Å; I214-K216 PolarHBondContact O-N 3.16Å; I214-L217 PolarHBondContact O-N 3.27Å; I214-L218 HydrophobicContact CG2-CD1 3.81Å; I214-L218 HydrophobicContact CG2-CG 4.31Å; I214-L218 WeakPolarHBondContact O-CB 3.16Å; I214-L218 WeakPolarHBondContact O-CG 3.11Å; I214-L218 PolarHBondContact O-N 3.38Å
215	M	98.4	Very high	98.5	Very high	12 Å²	12	55.7 Å²	55.7	6%	0.059	29%	0.294	C	S	.	.	H	α-helix	trans	-61.5	-39.7	-179.7	-71.5	-168.8	-69.6	0	0	112.3	A152 Y201 L204 V207 E211 H212 Y213 A219 V220 V222	A152-M215 HydrophobicContact CB-CE 3.95Å; A152-M215 HydrophobicContact CB-SD 4Å; Y201-M215 HydrophobicContact CD2-SD 4.07Å; Y201-M215 HydrophobicContact CE2-SD 4.13Å; L204-M215 HydrophobicContact CD1-CE 3.72Å; L204-M215 HydrophobicContact CD1-SD 3.67Å; V207-M215 HydrophobicContact CG1-CE 3.56Å; V207-M215 HydrophobicContact CG2-CE 4.43Å; E211-M215 WeakPolarHBondContact O-CG 3.26Å; E211-M215 PolarHBondContact O-N 2.87Å; H212-M215 PolarHBondContact O-N 2.98Å; Y213-M215 PolarHBondContact O-N 2.74Å; M215-A219 PolarHBondContact O-N 3.07Å; M215-A219 VanDerWaalsContact O-N 3.09Å; M215-V220 HydrophobicContact CB-CB 4.38Å; M215-V220 HydrophobicContact CG-CB 4.45Å; M215-V220 PolarHBondContact O-N 3.19Å; M215-V222 HydrophobicContact SD-CG2 3.66Å
216	K	98.4	Very high	98.5	Very high	148 Å²	148	56.5 Å²	56.5	64%	0.643	31%	0.305	S	S	*	.	H	α-helix	trans	-67.5	-44.4	174.7	-68	-62.6	-178.1	-172.1	0	112.1	H212 Y213 I214 L218 A219	H212-K216 WeakPolarHBondContact NE2-CE 3.32Å; H212-K216 WeakPolarHBondContact O-CG 3.3Å; H212-K216 PolarHBondContact O-N 3.44Å; H212-K216 VanDerWaalsContact O-N 3.07Å; Y213-K216 PolarHBondContact O-N 3.05Å; I214-K216 VanDerWaalsContact C-N 3.32Å; I214-K216 PolarHBondContact O-N 3.16Å; K216-L218 VanDerWaalsContact C-N 3.32Å; K216-L218 PolarHBondContact O-N 3.14Å; K216-A219 PolarHBondContact O-N 3.13Å
217	L	98.1	Very high	98.5	Very high	112 Å²	112	55 Å²	55	59%	0.586	30%	0.296	S	S	*	.	H	α-helix	trans	-60.1	-42.7	179.2	178.2	66.1	0	0	0	111.7	Y213 I214 A219	Y213-L217 HydrophobicContact CE1-CB 4.46Å; Y213-L217 HydrophobicContact CE1-CD2 3.99Å; Y213-L217 VanDerWaalsContact O-CB 3.32Å; Y213-L217 WeakPolarHBondContact O-CB 3.43Å; Y213-L217 PolarHBondContact O-N 3.44Å; I214-L217 PolarHBondContact O-N 3.27Å; L217-A219 VanDerWaalsContact C-N 3.34Å
218	L	98.1	Very high	98.5	Very high	27 Å²	27	53 Å²	53	14%	0.141	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-0.3	-177.1	-59.6	-174.7	0	0	0	113.8	L174 E176 L177 S196 I214 K216 V220	L174-L218 HydrophobicContact CD1-CD1 4.07Å; E176-L218 HydrophobicContact CB-CD1 4.15Å; E176-L218 HydrophobicContact CB-CD2 3.65Å; E176-L218 HydrophobicContact CG-CD2 4.29Å; L177-L218 HydrophobicContact CD1-CD1 4.22Å; L177-L218 HydrophobicContact CD2-CD1 4.04Å; L177-L218 HydrophobicContact CG-CD1 3.92Å; S196-L218 PolarHBondContact OG-O 3.05Å; S196-L218 VanDerWaalsContact OG-O 3.05Å; I214-L218 HydrophobicContact CG2-CD1 3.81Å; I214-L218 HydrophobicContact CG2-CG 4.31Å; I214-L218 WeakPolarHBondContact O-CB 3.16Å; I214-L218 WeakPolarHBondContact O-CG 3.11Å; I214-L218 PolarHBondContact O-N 3.38Å; K216-L218 VanDerWaalsContact C-N 3.32Å; K216-L218 PolarHBondContact O-N 3.14Å; L218-V220 VanDerWaalsContact C-N 3.26Å; L218-V220 HydrophobicContact CB-CG2 4.03Å; L218-V220 PolarHBondContact O-N 3.31Å
219	A	97.4	Very high	98.5	Very high	74 Å²	74	56.6 Å²	56.6	61%	0.612	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	43.4	-176.3	0	0	0	0	0	113.3	M215 K216 L217	M215-A219 PolarHBondContact O-N 3.07Å; M215-A219 VanDerWaalsContact O-N 3.09Å; K216-A219 PolarHBondContact O-N 3.13Å; L217-A219 VanDerWaalsContact C-N 3.34Å
220	V	97.3	Very high	98.5	Very high	13 Å²	13	58.2 Å²	58.2	8%	0.079	30%	0.301	C	S	.	.			trans	-64.8	137.9	176.8	-177.3	0	0	0	0	109.5	L199 Y201 M215 L218 V222	L199-V220 HydrophobicContact CB-CG1 4.43Å; L199-V220 HydrophobicContact CD2-CG1 4.03Å; L199-V220 HydrophobicContact CG-CG1 4.02Å; Y201-V220 HydrophobicContact CD2-CG1 3.66Å; Y201-V220 HydrophobicContact CE2-CG1 3.81Å; M215-V220 HydrophobicContact CB-CB 4.38Å; M215-V220 HydrophobicContact CG-CB 4.45Å; M215-V220 PolarHBondContact O-N 3.19Å; L218-V220 VanDerWaalsContact C-N 3.26Å; L218-V220 HydrophobicContact CB-CG2 4.03Å; L218-V220 PolarHBondContact O-N 3.31Å; V220-V222 HydrophobicContact CB-CG2 4.48Å; V220-V222 HydrophobicContact CG1-CG2 4.3Å; V220-V222 PolarHBondContact O-N 3.39Å
221	K	98.2	Very high	98.5	Very high	55 Å²	55	60 Å²	60	24%	0.239	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	123.9	174	-178.1	76.3	178.3	-174.4	0	109.2	V200 Y201 F223 E239 Y243	V200-K221 WeakPolarHBondContact CA-O 3.28Å; V200-K221 HydrophobicContact CG1-CG 4.18Å; V200-K221 HydrophobicContact CG2-CB 4.14Å; V200-K221 HydrophobicContact CG2-CG 4.15Å; Y201-K221 PolarHBondContact N-O 2.94Å; K221-F223 HydrophobicContact CD-CE2 4.38Å; K221-F223 HydrophobicContact CD-CZ 4.37Å; K221-F223 VanDerWaalsContact CE-CE2 3.48Å; K221-F223 HydrophobicContact CG-CE2 4.02Å; K221-F223 HydrophobicContact CG-CZ 4.49Å; K221-E239 IonicContact NZ-OE2 3.24Å; K221-E239 PolarHBondContact NZ-OE2 2.91Å; K221-Y243 HydrophobicContact CB-CD1 3.89Å; K221-Y243 HydrophobicContact CB-CD2 4.15Å; K221-Y243 HydrophobicContact CB-CE1 3.61Å; K221-Y243 HydrophobicContact CB-CE2 3.87Å; K221-Y243 HydrophobicContact CB-CG 4.15Å; K221-Y243 HydrophobicContact CD-CD2 4.04Å; K221-Y243 HydrophobicContact CD-CE2 4.35Å; K221-Y243 HydrophobicContact CD-CG 4.3Å; K221-Y243 HydrophobicContact CG-CD1 4.09Å; K221-Y243 HydrophobicContact CG-CD2 4.11Å; K221-Y243 HydrophobicContact CG-CE1 4.32Å; K221-Y243 HydrophobicContact CG-CE2 4.33Å; K221-Y243 HydrophobicContact CG-CG 3.98Å
222	V	98.7	Very high	98.5	Very high	38 Å²	38	61.1 Å²	61.1	23%	0.23	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	133.5	-174.2	173.9	0	0	0	0	109.7	Y201 L204 M215 V220	Y201-V222 HydrophobicContact CD2-CG2 4.18Å; L204-V222 HydrophobicContact CD1-CG1 3.58Å; L204-V222 HydrophobicContact CD1-CG2 4.33Å; L204-V222 HydrophobicContact CG-CG1 4.14Å; M215-V222 HydrophobicContact SD-CG2 3.66Å; V220-V222 HydrophobicContact CB-CG2 4.48Å; V220-V222 HydrophobicContact CG1-CG2 4.3Å; V220-V222 PolarHBondContact O-N 3.39Å
223	F	98.9	Very high	98.5	Very high	3 Å²	3	57 Å²	57	1%	0.013	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	85.4	164.4	-59.2	-83.9	0	0	0	108.5	V200 Y201 I202 G203 K221 Q227 L231 V236 E239 T240	V200-F223 HydrophobicContact CG1-CD2 3.76Å; V200-F223 HydrophobicContact CG1-CE2 3.79Å; Y201-F223 PolarHBondContact O-N 2.89Å; I202-F223 CarbonylContact C-O 3.45Å; I202-F223 WeakPolarHBondContact CA-O 3.45Å; I202-F223 HydrophobicContact CG1-CB 4.5Å; I202-F223 HydrophobicContact CG1-CD2 4.27Å; G203-F223 PolarHBondContact N-O 3.42Å; K221-F223 HydrophobicContact CD-CE2 4.38Å; K221-F223 HydrophobicContact CD-CZ 4.37Å; K221-F223 VanDerWaalsContact CE-CE2 3.48Å; K221-F223 HydrophobicContact CG-CE2 4.02Å; K221-F223 HydrophobicContact CG-CZ 4.49Å; F223-Q227 HydrophobicContact CB-CB 4.22Å; F223-Q227 HydrophobicContact CD1-CB 4Å; F223-Q227 HydrophobicContact CD1-CG 4.46Å; F223-L231 HydrophobicContact CD1-CD1 4.14Å; F223-L231 HydrophobicContact CE1-CD1 3.99Å; F223-V236 HydrophobicContact CB-CG1 3.9Å; F223-V236 HydrophobicContact CB-CG2 4.47Å; F223-V236 HydrophobicContact CD1-CB 4.37Å; F223-V236 HydrophobicContact CD1-CG1 4.03Å; F223-V236 HydrophobicContact CD1-CG2 3.95Å; F223-V236 HydrophobicContact CD2-CG1 3.93Å; F223-V236 HydrophobicContact CE1-CG2 4.47Å; F223-V236 HydrophobicContact CE2-CG1 4.41Å; F223-V236 HydrophobicContact CG-CG1 3.7Å; F223-V236 HydrophobicContact CG-CG2 4.35Å; F223-E239 HydrophobicContact CE1-CB 4.17Å; F223-E239 HydrophobicContact CZ-CB 3.62Å; F223-T240 VanDerWaalsContact CE2-OG1 3.28Å; F223-T240 WeakPolarHBondContact CE2-OG1 3.34Å
224	S	98.9	Very high	98.5	Very high	25 Å²	25	52.1 Å²	52.1	18%	0.175	29%	0.291	C	S	.	.			trans	-63.8	169.4	168.5	71.8	0	0	0	0	110.2	L204 T226 Q227 V228	L204-S224 CarbonylContact O-C 3.56Å; L204-S224 VanDerWaalsContact O-CA 3.23Å; L204-S224 WeakPolarHBondContact O-CA 3.28Å; L204-S224 WeakPolarHBondContact O-CB 3.23Å; S224-T226 PolarHBondContact O-N 3.47Å; S224-T226 VanDerWaalsContact O-N 3.07Å; S224-T226 PolarHBondContact OG-N 2.91Å; S224-Q227 PolarHBondContact O-N 2.97Å; S224-Q227 PolarHBondContact OG-OE1 3.29Å; S224-V228 PolarHBondContact O-N 3.37Å; S224-V228 VanDerWaalsContact O-N 3.08Å
225	M	98.9	Very high	98.5	Very high	18 Å²	18	56.4 Å²	56.4	9%	0.089	31%	0.306	C	S	.	.	H	α-helix	trans	-54.6	-30.3	175	-68.6	-54.6	-57.6	0	0	112.7	L204 R205 Q227 V228 D229 G275 G276 L277	L204-M225 PolarHBondContact O-N 3.31Å; R205-M225 HydrophobicContact CB-CB 4.47Å; R205-M225 HydrophobicContact CB-CG 3.99Å; R205-M225 HydrophobicContact CG-CG 4.37Å; M225-Q227 PolarHBondContact O-N 3.14Å; M225-V228 HydrophobicContact CE-CB 4.37Å; M225-V228 HydrophobicContact CE-CG1 4.32Å; M225-V228 WeakPolarHBondContact O-CB 3.38Å; M225-V228 PolarHBondContact O-N 3.19Å; M225-V228 HydrophobicContact SD-CG2 4.38Å; M225-D229 VanDerWaalsContact O-CG 3.23Å; M225-D229 PolarHBondContact O-N 2.91Å; M225-G275 WeakPolarHBondContact CE-O 3.45Å; M225-G275 WeakPolarHBondContact CG-O 3.45Å; M225-G276 WeakPolarHBondContact CE-O 3.46Å; M225-L277 HydrophobicContact CE-CD2 4.12Å; M225-L277 HydrophobicContact SD-CD2 3.68Å; M225-L277 HydrophobicContact SD-CG 4.06Å
226	T	98.8	Very high	98.5	Very high	76 Å²	76	55.8 Å²	55.8	47%	0.466	30%	0.303	S	S	.	.	H	α-helix	trans	-60.4	-40.5	172.5	-56.1	0	0	0	0	113.1	S224 Q230	S224-T226 PolarHBondContact O-N 3.47Å; S224-T226 VanDerWaalsContact O-N 3.07Å; S224-T226 PolarHBondContact OG-N 2.91Å; T226-Q230 WeakPolarHBondContact O-CB 3.14Å; T226-Q230 WeakPolarHBondContact O-CG 3.44Å; T226-Q230 PolarHBondContact O-N 2.76Å
227	Q	98.8	Very high	98.5	Very high	57 Å²	57	48.8 Å²	48.8	27%	0.266	27%	0.273	S	S	.	.	H	α-helix	trans	-73.6	-34.4	175.8	-76.2	76.9	46.7	0	0	111.5	F223 S224 M225 D229 Q230 L231	F223-Q227 HydrophobicContact CB-CB 4.22Å; F223-Q227 HydrophobicContact CD1-CB 4Å; F223-Q227 HydrophobicContact CD1-CG 4.46Å; S224-Q227 PolarHBondContact O-N 2.97Å; S224-Q227 PolarHBondContact OG-OE1 3.29Å; M225-Q227 PolarHBondContact O-N 3.14Å; Q227-D229 VanDerWaalsContact C-N 3.34Å; Q227-Q230 PolarHBondContact O-N 3.47Å; Q227-L231 HydrophobicContact CB-CD1 4.34Å; Q227-L231 VanDerWaalsContact O-CB 3.28Å; Q227-L231 WeakPolarHBondContact O-CB 2.98Å; Q227-L231 WeakPolarHBondContact O-CG 3.32Å; Q227-L231 PolarHBondContact O-N 3.32Å
228	V	98.8	Very high	98.4	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.006	26%	0.259	C	S	.	.	H	α-helix	trans	-60.8	-45.9	174.6	179.4	0	0	0	0	110.3	S224 M225 Q230 G232 M233 V236 L277 E281	S224-V228 PolarHBondContact O-N 3.37Å; S224-V228 VanDerWaalsContact O-N 3.08Å; M225-V228 HydrophobicContact CE-CB 4.37Å; M225-V228 HydrophobicContact CE-CG1 4.32Å; M225-V228 WeakPolarHBondContact O-CB 3.38Å; M225-V228 PolarHBondContact O-N 3.19Å; M225-V228 HydrophobicContact SD-CG2 4.38Å; V228-Q230 VanDerWaalsContact C-N 3.34Å; V228-Q230 PolarHBondContact O-N 3.07Å; V228-G232 VanDerWaalsContact O-CA 3.23Å; V228-G232 WeakPolarHBondContact O-CA 3.5Å; V228-G232 PolarHBondContact O-N 3.06Å; V228-M233 HydrophobicContact CG1-CE 3.78Å; V228-M233 HydrophobicContact CG2-CE 4.01Å; V228-V236 HydrophobicContact CG2-CG2 4.38Å; V228-L277 HydrophobicContact CG1-CD2 4.21Å; V228-L277 HydrophobicContact CG2-CD2 4.26Å; V228-E281 WeakPolarHBondContact CG1-OE1 3.11Å
229	D	98.7	Very high	98.4	Very high	127 Å²	127	47.2 Å²	47.2	68%	0.679	26%	0.262	S	S	*	.	H	α-helix	trans	-60.5	-41.1	176.8	-68.9	-24.3	0	0	0	112.6	M225 Q227	M225-D229 VanDerWaalsContact O-CG 3.23Å; M225-D229 PolarHBondContact O-N 2.91Å; Q227-D229 VanDerWaalsContact C-N 3.34Å
230	Q	98.6	Very high	98.4	Very high	142 Å²	142	43.7 Å²	43.7	66%	0.664	23%	0.232	S	C	*	.	H	α-helix	trans	-76.3	-41.8	-175.6	-74	172.5	-1.8	0	0	113.3	T226 Q227 V228	T226-Q230 WeakPolarHBondContact O-CB 3.14Å; T226-Q230 WeakPolarHBondContact O-CG 3.44Å; T226-Q230 PolarHBondContact O-N 2.76Å; Q227-Q230 PolarHBondContact O-N 3.47Å; V228-Q230 VanDerWaalsContact C-N 3.34Å; V228-Q230 PolarHBondContact O-N 3.07Å
231	L	98.6	Very high	98.3	Very high	67 Å²	67	43.1 Å²	43.1	35%	0.351	23%	0.229	S	C	.	.	H	α-helix	trans	-96.8	-27.4	-171	-59.4	176.1	0	0	0	112.1	F223 Q227 R235 V236	F223-L231 HydrophobicContact CD1-CD1 4.14Å; F223-L231 HydrophobicContact CE1-CD1 3.99Å; Q227-L231 HydrophobicContact CB-CD1 4.34Å; Q227-L231 VanDerWaalsContact O-CB 3.28Å; Q227-L231 WeakPolarHBondContact O-CB 2.98Å; Q227-L231 WeakPolarHBondContact O-CG 3.32Å; Q227-L231 PolarHBondContact O-N 3.32Å; L231-R235 HydrophobicContact CB-CB 4.05Å; L231-R235 HydrophobicContact CB-CG 4.1Å; L231-R235 HydrophobicContact CD2-CG 4.39Å; L231-R235 WeakPolarHBondContact O-CB 3.2Å; L231-V236 HydrophobicContact CB-CG2 4.16Å; L231-V236 HydrophobicContact CD1-CG2 4.32Å
232	G	98.7	Very high	98.1	Very high	30 Å²	30	43.8 Å²	43.8	31%	0.309	24%	0.235	S	C	.	.	H	α-helix	trans	71.8	149.6	-163.6	0	0	0	0	0	112.2	V228 A234 R235 V236	V228-G232 VanDerWaalsContact O-CA 3.23Å; V228-G232 WeakPolarHBondContact O-CA 3.5Å; V228-G232 PolarHBondContact O-N 3.06Å; G232-A234 PolarHBondContact O-N 3.07Å; G232-A234 VanDerWaalsContact O-N 3.12Å; G232-R235 PolarHBondContact O-N 3.03Å; G232-R235 VanDerWaalsContact O-N 3.09Å; G232-V236 PolarHBondContact O-N 3.25Å
233	M	98.7	Very high	97.9	Very high	11 Å²	11	45.4 Å²	45.4	5%	0.054	24%	0.238	C	C	.	.	H	α-helix	trans	-58.6	-31.1	-173.5	-173.6	51.4	63.7	0	0	114.4	I202 V228 R235 V236 M237 L277 E281 Y284 I285	I202-M233 HydrophobicContact CG2-CE 4.11Å; V228-M233 HydrophobicContact CG1-CE 3.78Å; V228-M233 HydrophobicContact CG2-CE 4.01Å; M233-R235 PolarHBondContact O-N 3.47Å; M233-V236 PolarHBondContact O-N 2.8Å; M233-V236 HydrophobicContact SD-CB 4.18Å; M233-V236 HydrophobicContact SD-CG1 4.1Å; M233-M237 WeakPolarHBondContact O-CG 3.48Å; M233-M237 PolarHBondContact O-N 3.08Å; M233-M237 HydrophobicContact SD-CG 4.1Å; M233-M237 HydrophobicContact SD-SD 4.36Å; M233-L277 HydrophobicContact CE-CD2 3.47Å; M233-L277 VanDerWaalsContact CE-CD2 3.47Å; M233-E281 HydrophobicContact CB-CB 4.24Å; M233-E281 HydrophobicContact CB-CG 3.82Å; M233-E281 HydrophobicContact CE-CB 4Å; M233-E281 HydrophobicContact CE-CG 4.44Å; M233-E281 HydrophobicContact CG-CB 4.02Å; M233-E281 HydrophobicContact CG-CG 4.16Å; M233-Y284 HydrophobicContact CB-CD1 4.47Å; M233-Y284 HydrophobicContact CG-CD1 3.69Å; M233-Y284 HydrophobicContact CG-CE1 4.44Å; M233-Y284 HydrophobicContact CG-CG 4.3Å; M233-I285 HydrophobicContact CE-CD1 4.03Å; M233-I285 HydrophobicContact CE-CG1 4.3Å; M233-I285 HydrophobicContact CG-CG1 4.3Å; M233-I285 HydrophobicContact SD-CD1 3.94Å; M233-I285 HydrophobicContact SD-CG1 3.55Å; M233-I285 VanDerWaalsContact SD-CG1 3.55Å
234	A	98.1	Very high	97.5	Very high	46 Å²	46	45.7 Å²	45.7	38%	0.38	24%	0.239	S	C	.	.	H	α-helix	trans	-58.9	-48.2	176.1	0	0	0	0	0	112.1	G232 M237 E238 Y284	G232-A234 PolarHBondContact O-N 3.07Å; G232-A234 VanDerWaalsContact O-N 3.12Å; A234-M237 PolarHBondContact O-N 3.41Å; A234-E238 WeakPolarHBondContact O-CG 3.32Å; A234-E238 PolarHBondContact O-N 2.72Å; A234-E238 VanDerWaalsContact O-N 3.14Å; A234-Y284 WeakPolarHBondContact CA-OH 3.47Å; A234-Y284 HydrophobicContact CB-CE1 4.32Å; A234-Y284 WeakPolarHBondContact CB-OH 3.41Å
235	R	98.5	Very high	96.8	Very high	102 Å²	102	46.1 Å²	46.1	39%	0.385	24%	0.237	S	C	.	.	H	α-helix	trans	-71.8	-35.2	-179.7	-178.2	60.9	-172.5	168.6	5.6	112.1	L231 G232 M233 M237 E238 E239	L231-R235 HydrophobicContact CB-CB 4.05Å; L231-R235 HydrophobicContact CB-CG 4.1Å; L231-R235 HydrophobicContact CD2-CG 4.39Å; L231-R235 WeakPolarHBondContact O-CB 3.2Å; G232-R235 PolarHBondContact O-N 3.03Å; G232-R235 VanDerWaalsContact O-N 3.09Å; M233-R235 PolarHBondContact O-N 3.47Å; R235-M237 VanDerWaalsContact C-N 3.31Å; R235-M237 PolarHBondContact O-N 3.43Å; R235-E238 WeakPolarHBondContact CD-OE2 3.15Å; R235-E238 IonicContact CZ-OE2 3.07Å; R235-E238 IonicContact NH1-OE2 3.84Å; R235-E238 PolarHBondContact NH1-OE2 2.77Å; R235-E238 PolarHBondContact O-N 3.32Å; R235-E239 IonicContact CZ-OE1 2.63Å; R235-E239 IonicContact NE-OE1 3.65Å; R235-E239 PolarHBondContact NE-OE1 3.02Å; R235-E239 IonicContact NH2-OE1 3.68Å; R235-E239 PolarHBondContact NH2-OE1 3.22Å; R235-E239 PolarHBondContact O-N 3.31Å
236	V	98.8	Very high	95.7	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-56.3	-45.9	172.7	168.9	0	0	0	0	111	I202 F223 V228 L231 G232 M233 E239 T240	I202-V236 HydrophobicContact CD1-CG1 4.19Å; I202-V236 HydrophobicContact CG1-CG1 4.33Å; I202-V236 HydrophobicContact CG2-CG1 4.16Å; F223-V236 HydrophobicContact CB-CG1 3.9Å; F223-V236 HydrophobicContact CB-CG2 4.47Å; F223-V236 HydrophobicContact CD1-CB 4.37Å; F223-V236 HydrophobicContact CD1-CG1 4.03Å; F223-V236 HydrophobicContact CD1-CG2 3.95Å; F223-V236 HydrophobicContact CD2-CG1 3.93Å; F223-V236 HydrophobicContact CE1-CG2 4.47Å; F223-V236 HydrophobicContact CE2-CG1 4.41Å; F223-V236 HydrophobicContact CG-CG1 3.7Å; F223-V236 HydrophobicContact CG-CG2 4.35Å; V228-V236 HydrophobicContact CG2-CG2 4.38Å; L231-V236 HydrophobicContact CB-CG2 4.16Å; L231-V236 HydrophobicContact CD1-CG2 4.32Å; G232-V236 PolarHBondContact O-N 3.25Å; M233-V236 PolarHBondContact O-N 2.8Å; M233-V236 HydrophobicContact SD-CB 4.18Å; M233-V236 HydrophobicContact SD-CG1 4.1Å; V236-E239 PolarHBondContact O-N 2.96Å; V236-T240 WeakPolarHBondContact O-CB 3.15Å; V236-T240 PolarHBondContact O-N 3.41Å; V236-T240 PolarHBondContact O-OG1 3.3Å
237	M	98.6	Very high	94.4	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-71	-37.4	-179.9	-69.3	-50.2	-58.5	0	0	113.5	I202 M233 A234 R235 T240 C241 Y284 I285 Y288 L289	I202-M237 HydrophobicContact CD1-SD 3.81Å; M233-M237 WeakPolarHBondContact O-CG 3.48Å; M233-M237 PolarHBondContact O-N 3.08Å; M233-M237 HydrophobicContact SD-CG 4.1Å; M233-M237 HydrophobicContact SD-SD 4.36Å; A234-M237 PolarHBondContact O-N 3.41Å; R235-M237 VanDerWaalsContact C-N 3.31Å; R235-M237 PolarHBondContact O-N 3.43Å; M237-T240 PolarHBondContact O-N 2.87Å; M237-C241 PolarHBondContact O-N 3.21Å; M237-C241 PolarHBondContact O-SG 3.48Å; M237-Y284 HydrophobicContact CB-CE1 4.06Å; M237-Y284 HydrophobicContact CG-CD1 3.95Å; M237-Y284 HydrophobicContact CG-CE1 3.86Å; M237-I285 HydrophobicContact CE-CG2 4.15Å; M237-I285 HydrophobicContact CG-CG1 4.44Å; M237-I285 HydrophobicContact SD-CB 4.15Å; M237-I285 HydrophobicContact SD-CG1 3.79Å; M237-I285 HydrophobicContact SD-CG2 4Å; M237-Y288 HydrophobicContact CB-CD1 3.94Å; M237-Y288 HydrophobicContact CB-CD2 3.72Å; M237-Y288 HydrophobicContact CB-CE1 4.21Å; M237-Y288 HydrophobicContact CB-CE2 3.98Å; M237-Y288 HydrophobicContact CB-CG 3.7Å; M237-Y288 HydrophobicContact CE-CD1 4.19Å; M237-Y288 HydrophobicContact CE-CG 4.35Å; M237-Y288 HydrophobicContact CG-CD2 4.44Å; M237-Y288 HydrophobicContact CG-CG 4.22Å; M237-L289 HydrophobicContact CE-CD2 3.77Å; M237-L289 HydrophobicContact CE-CG 3.81Å
238	E	97.3	Very high	93.7	Very high	63 Å²	63	57.3 Å²	57.3	29%	0.294	29%	0.287	S	S	.	.	H	α-helix	trans	-56.6	-53.5	170.9	-72.6	173.8	-177.5	0	0	110.6	A234 R235 T240 C241 D242 Y288	A234-E238 WeakPolarHBondContact O-CG 3.32Å; A234-E238 PolarHBondContact O-N 2.72Å; A234-E238 VanDerWaalsContact O-N 3.14Å; R235-E238 WeakPolarHBondContact CD-OE2 3.15Å; R235-E238 IonicContact CZ-OE2 3.07Å; R235-E238 IonicContact NH1-OE2 3.84Å; R235-E238 PolarHBondContact NH1-OE2 2.77Å; R235-E238 PolarHBondContact O-N 3.32Å; E238-T240 VanDerWaalsContact C-N 3.32Å; E238-T240 PolarHBondContact O-N 2.93Å; E238-C241 PolarHBondContact O-N 2.95Å; E238-D242 PolarHBondContact O-N 2.61Å; E238-Y288 WeakPolarHBondContact CG-OH 3.43Å
239	E	98	Very high	93.2	Very high	43 Å²	43	62.9 Å²	62.9	20%	0.201	31%	0.312	C	S	.	.	H	α-helix	trans	-68.4	-30.5	-178.3	-71.8	-168.3	-160.7	0	0	113.6	K221 F223 R235 V236 Y243	K221-E239 IonicContact NZ-OE2 3.24Å; K221-E239 PolarHBondContact NZ-OE2 2.91Å; F223-E239 HydrophobicContact CE1-CB 4.17Å; F223-E239 HydrophobicContact CZ-CB 3.62Å; R235-E239 IonicContact CZ-OE1 2.63Å; R235-E239 IonicContact NE-OE1 3.65Å; R235-E239 PolarHBondContact NE-OE1 3.02Å; R235-E239 IonicContact NH2-OE1 3.68Å; R235-E239 PolarHBondContact NH2-OE1 3.22Å; R235-E239 PolarHBondContact O-N 3.31Å; V236-E239 PolarHBondContact O-N 2.96Å; E239-Y243 WeakPolarHBondContact O-CB 3.2Å; E239-Y243 PolarHBondContact O-N 2.91Å
240	T	97.6	Very high	93	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.9	-47.9	172.3	-65.3	0	0	0	0	110.2	V146 V200 I202 F223 V236 M237 E238 Y243 L244	V146-T240 HydrophobicContact CG2-CG2 4.17Å; V200-T240 HydrophobicContact CB-CG2 4.17Å; V200-T240 HydrophobicContact CG1-CG2 3.94Å; V200-T240 HydrophobicContact CG2-CG2 4.24Å; I202-T240 HydrophobicContact CD1-CG2 4.42Å; F223-T240 VanDerWaalsContact CE2-OG1 3.28Å; F223-T240 WeakPolarHBondContact CE2-OG1 3.34Å; V236-T240 WeakPolarHBondContact O-CB 3.15Å; V236-T240 PolarHBondContact O-N 3.41Å; V236-T240 PolarHBondContact O-OG1 3.3Å; M237-T240 PolarHBondContact O-N 2.87Å; E238-T240 VanDerWaalsContact C-N 3.32Å; E238-T240 PolarHBondContact O-N 2.93Å; T240-Y243 PolarHBondContact O-N 3.38Å; T240-L244 HydrophobicContact CG2-CD1 4.15Å; T240-L244 WeakPolarHBondContact O-CG 3.43Å; T240-L244 PolarHBondContact O-N 3.03Å; T240-L244 VanDerWaalsContact O-N 3.08Å
241	C	93.8	Very high	93	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.014	27%	0.268	C	S	.	.	H	α-helix	trans	-70	-42.5	-179.3	-66.9	0	0	0	0	112.1	M237 E238 Y243 L244 W245 Y288	M237-C241 PolarHBondContact O-N 3.21Å; M237-C241 PolarHBondContact O-SG 3.48Å; E238-C241 PolarHBondContact O-N 2.95Å; C241-Y243 VanDerWaalsContact C-N 3.33Å; C241-Y243 PolarHBondContact O-N 2.53Å; C241-L244 PolarHBondContact O-N 3.16Å; C241-W245 HydrophobicContact CB-CD2 4.12Å; C241-W245 HydrophobicContact CB-CE3 3.75Å; C241-W245 HydrophobicContact CB-CH2 3.51Å; C241-W245 HydrophobicContact CB-CZ2 3.87Å; C241-W245 HydrophobicContact CB-CZ3 3.45Å; C241-W245 VanDerWaalsContact CB-CZ3 3.45Å; C241-W245 VanDerWaalsContact O-CB 3.25Å; C241-W245 WeakPolarHBondContact O-CB 3.25Å; C241-W245 VanDerWaalsContact O-CD2 3.25Å; C241-W245 PolarHBondContact O-N 2.98Å; C241-Y288 HydrophobicContact CB-CE1 4.41Å; C241-Y288 VanDerWaalsContact SG-CE1 3.51Å
242	D	93.7	Very high	93	Very high	69 Å²	69	50.7 Å²	50.7	37%	0.369	25%	0.252	S	S	.	.	H	α-helix	trans	-57.1	-47.3	174.5	-74.1	-18.1	0	0	0	111.1	H22 E238 L244 W245 D246	H22-D242 IonicContact NE2-OD1 3.64Å; E238-D242 PolarHBondContact O-N 2.61Å; D242-L244 PolarHBondContact O-N 2.9Å; D242-W245 PolarHBondContact O-N 3.33Å; D242-D246 PolarHBondContact O-N 3.07Å
243	Y	94.8	Very high	93	Very high	72 Å²	72	49.3 Å²	49.3	28%	0.282	24%	0.237	S	C	.	.	H	α-helix	trans	-60.1	-45.6	178.4	179.6	-95.9	0	0	0	112.3	R197 V200 K221 E239 T240 C241 W245	R197-Y243 VanDerWaalsContact O-CE1 3.32Å; R197-Y243 WeakPolarHBondContact O-CE1 3.34Å; V200-Y243 HydrophobicContact CG2-CD1 3.54Å; V200-Y243 HydrophobicContact CG2-CE1 4Å; V200-Y243 HydrophobicContact CG2-CG 4.49Å; K221-Y243 HydrophobicContact CB-CD1 3.89Å; K221-Y243 HydrophobicContact CB-CD2 4.15Å; K221-Y243 HydrophobicContact CB-CE1 3.61Å; K221-Y243 HydrophobicContact CB-CE2 3.87Å; K221-Y243 HydrophobicContact CB-CG 4.15Å; K221-Y243 HydrophobicContact CD-CD2 4.04Å; K221-Y243 HydrophobicContact CD-CE2 4.35Å; K221-Y243 HydrophobicContact CD-CG 4.3Å; K221-Y243 HydrophobicContact CG-CD1 4.09Å; K221-Y243 HydrophobicContact CG-CD2 4.11Å; K221-Y243 HydrophobicContact CG-CE1 4.32Å; K221-Y243 HydrophobicContact CG-CE2 4.33Å; K221-Y243 HydrophobicContact CG-CG 3.98Å; E239-Y243 WeakPolarHBondContact O-CB 3.2Å; E239-Y243 PolarHBondContact O-N 2.91Å; T240-Y243 PolarHBondContact O-N 3.38Å; C241-Y243 VanDerWaalsContact C-N 3.33Å; C241-Y243 PolarHBondContact O-N 2.53Å; Y243-W245 VanDerWaalsContact C-N 3.34Å
244	L	90.7	Very high	93	Very high	8 Å²	8	48.8 Å²	48.8	4%	0.042	23%	0.234	C	C	.	.	H	α-helix	trans	-73.1	-24.5	-179.6	-68.5	177.2	0	0	0	113	V146 V200 T240 C241 D242	V146-L244 HydrophobicContact CG2-CD1 3.8Å; V200-L244 HydrophobicContact CG2-CD1 4.28Å; V200-L244 HydrophobicContact CG2-CD2 3.88Å; V200-L244 HydrophobicContact CG2-CG 3.93Å; T240-L244 HydrophobicContact CG2-CD1 4.15Å; T240-L244 WeakPolarHBondContact O-CG 3.43Å; T240-L244 PolarHBondContact O-N 3.03Å; T240-L244 VanDerWaalsContact O-N 3.08Å; C241-L244 PolarHBondContact O-N 3.16Å; D242-L244 PolarHBondContact O-N 2.9Å
245	W	84.9	Confident	93	Very high	35 Å²	35	46.6 Å²	46.6	13%	0.133	22%	0.216	C	C	.	.	H	α-helix	trans	-98.7	-13	-176.5	-65.2	-21.9	0	0	0	115.8	H24 C241 D242 Y243 R247 K249 T292 L294	H24-W245 AromaticContact CE1-CH2 3.35Å; H24-W245 WeakPolarHBondContact CE1-CH2 3.38Å; H24-W245 AromaticContact CE1-CZ2 3.78Å; H24-W245 AromaticContact CE1-CZ3 3.96Å; H24-W245 AromaticContact NE2-CH2 3.43Å; H24-W245 WeakPolarHBondContact NE2-CH2 3.4Å; H24-W245 AromaticContact NE2-CZ3 3.91Å; C241-W245 HydrophobicContact CB-CD2 4.12Å; C241-W245 HydrophobicContact CB-CE3 3.75Å; C241-W245 HydrophobicContact CB-CH2 3.51Å; C241-W245 HydrophobicContact CB-CZ2 3.87Å; C241-W245 HydrophobicContact CB-CZ3 3.45Å; C241-W245 VanDerWaalsContact CB-CZ3 3.45Å; C241-W245 VanDerWaalsContact O-CB 3.25Å; C241-W245 WeakPolarHBondContact O-CB 3.25Å; C241-W245 VanDerWaalsContact O-CD2 3.25Å; C241-W245 PolarHBondContact O-N 2.98Å; D242-W245 PolarHBondContact O-N 3.33Å; Y243-W245 VanDerWaalsContact C-N 3.34Å; W245-R247 PolarHBondContact O-N 3.26Å; W245-K249 HydrophobicContact CG-CG 4.18Å; W245-T292 HydrophobicContact CH2-CG2 3.95Å; W245-T292 HydrophobicContact CZ2-CG2 3.63Å; W245-L294 HydrophobicContact CZ2-CD1 4.32Å
246	D	76.1	Confident	93	Very high	132 Å²	132	41.8 Å²	41.8	71%	0.706	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.1	-17.9	-179.7	-172.9	50.5	0	0	0	113.9	D242	D242-D246 PolarHBondContact O-N 3.07Å
247	R	70.1	Confident	93	Very high	164 Å²	164	41.9 Å²	41.9	62%	0.619	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117.6	-61.1	-178.2	-59	172.4	-176.7	-93.3	-7.7	113	W245	W245-R247 PolarHBondContact O-N 3.26Å
248	T	83.9	Confident	93.1	Very high	89 Å²	89	41.9 Å²	41.9	55%	0.546	20%	0.199	S	C	.	.			trans	-158.9	130.6	-172.7	-55.2	0	0	0	0	109	K250	T248-K250 PolarHBondContact O-N 2.86Å; T248-K250 VanDerWaalsContact O-N 3.16Å
249	K	89.3	Confident	93.1	Very high	119 Å²	119	38.9 Å²	38.9	52%	0.517	19%	0.185	S	C	.	.			trans	-67.9	112.8	173.4	-67.6	-174.3	175.3	-175.5	0	109.5	W245 L294	W245-K249 HydrophobicContact CG-CG 4.18Å; K249-L294 HydrophobicContact CB-CD1 4.13Å; K249-L294 HydrophobicContact CD-CD1 4.45Å; K249-L294 HydrophobicContact CG-CD1 4.4Å
250	K	95.1	Very high	93.2	Very high	37 Å²	37	36.9 Å²	36.9	16%	0.161	18%	0.175	C	C	.	.			trans	-106.9	157.2	176.1	-65.8	169.9	-175.7	172.9	0	110	P142 D198 T248	P142-K250 HydrophobicContact CB-CD 4.24Å; D198-K250 IonicContact OD1-NZ 3.51Å; D198-K250 PolarHBondContact OD1-NZ 3.32Å; D198-K250 IonicContact OD2-NZ 2.81Å; D198-K250 PolarHBondContact OD2-NZ 3.47Å; T248-K250 PolarHBondContact O-N 2.86Å; T248-K250 VanDerWaalsContact O-N 3.16Å
251	P	97.3	Very high	93.2	Very high	40 Å²	40	36.9 Å²	36.9	26%	0.26	18%	0.175	S	C	.	.	P	Polyproline II helix	trans	-54.9	139.1	165	-21.6	33.3	0	0	0	110.5	V140 V143 S144	V140-P251 HydrophobicContact CG2-CB 4.3Å; V140-P251 HydrophobicContact CG2-CG 4.05Å; V143-P251 WeakPolarHBondContact CA-O 3.32Å; V143-P251 WeakPolarHBondContact CB-O 3.46Å; V143-P251 HydrophobicContact CG1-CB 4.42Å; S144-P251 PolarHBondContact N-O 2.95Å
252	I	98.5	Very high	93.5	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.015	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	129.1	178.9	-62.6	173.5	0	0	0	109.1	S144 V146 L289 T292 L294 L295 S296 A297	S144-I252 CarbonylContact O-C 3.44Å; S144-I252 WeakPolarHBondContact O-CA 3.41Å; V146-I252 HydrophobicContact CG2-CG2 4.14Å; I252-L289 HydrophobicContact CD1-CD2 4.13Å; I252-L289 HydrophobicContact CG2-CD2 4.45Å; I252-T292 HydrophobicContact CD1-CG2 4.36Å; I252-L294 HydrophobicContact CD1-CB 3.96Å; I252-L294 HydrophobicContact CG1-CB 3.99Å; I252-L294 PolarHBondContact N-O 3.21Å; I252-L295 HydrophobicContact CB-CD1 4.43Å; I252-L295 HydrophobicContact CG2-CD1 4.07Å; I252-S296 PolarHBondContact O-N 3.03Å; I252-A297 PolarHBondContact O-N 3.4Å
253	H	98.9	Very high	93.7	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	116.3	163.5	-170.5	107.6	0	0	0	107.9	I133 H136 V143 S144 V145 V146 A297 D299	I133-H253 WeakPolarHBondContact CG1-NE2 3.35Å; H136-H253 AromaticContact CG-ND1 3.85Å; H136-H253 AromaticContact ND1-CG 3.71Å; H136-H253 AromaticContact ND1-ND1 3.19Å; H136-H253 PolarHBondContact ND1-ND1 2.99Å; H136-H253 VanDerWaalsContact ND1-ND1 3.19Å; V143-H253 HydrophobicContact CG2-CB 4.21Å; S144-H253 PolarHBondContact O-N 3.09Å; V145-H253 WeakPolarHBondContact CA-O 3.25Å; V146-H253 PolarHBondContact N-O 3.15Å; H253-A297 WeakPolarHBondContact ND1-CB 3.35Å; H253-D299 IonicContact CE1-OD1 3.18Å; H253-D299 IonicContact CE1-OD2 3.89Å; H253-D299 IonicContact NE2-OD1 2.68Å; H253-D299 IonicContact NE2-OD2 2.91Å; H253-D299 PolarHBondContact NE2-OD2 3.32Å; H253-D299 VanDerWaalsContact NE2-OD2 3.11Å
254	L	98.9	Very high	93.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	112.9	173.9	172	60.7	0	0	0	108.6	V146 V148 Y256 L289 L295 A297 V298 D299	V146-L254 HydrophobicContact CB-CD1 4.24Å; V146-L254 HydrophobicContact CG1-CD1 4.16Å; V146-L254 WeakPolarHBondContact O-CA 3.18Å; V148-L254 HydrophobicContact CG2-CD1 3.68Å; L254-Y256 HydrophobicContact CD1-CD2 4.19Å; L254-Y256 HydrophobicContact CD2-CD2 4.24Å; L254-Y256 HydrophobicContact CG-CD2 4.42Å; L254-L289 HydrophobicContact CB-CD1 4.41Å; L254-L289 HydrophobicContact CD1-CD1 3.82Å; L254-L289 HydrophobicContact CD2-CD1 3.87Å; L254-L289 HydrophobicContact CG-CD1 4.25Å; L254-L295 HydrophobicContact CB-CD1 3.8Å; L254-A297 PolarHBondContact N-O 3.14Å; L254-V298 HydrophobicContact CB-CG1 4.44Å; L254-V298 HydrophobicContact CB-CG2 4.43Å; L254-V298 HydrophobicContact CD2-CG1 4.09Å; L254-V298 HydrophobicContact CG-CG1 4.29Å; L254-V298 CarbonylContact O-C 3.56Å; L254-V298 VanDerWaalsContact O-CA 3.26Å; L254-V298 WeakPolarHBondContact O-CA 3.45Å; L254-D299 PolarHBondContact O-N 3.43Å
255	S	98.9	Very high	94.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	112.4	167	-151	0	0	0	0	107.9	H126 V146 V148	H126-S255 PolarHBondContact NE2-OG 2.88Å; V146-S255 PolarHBondContact O-N 3.1Å; V148-S255 PolarHBondContact N-O 2.83Å
256	Y	98.9	Very high	94.9	Very high	1 Å²	1	37.2 Å²	37.2	0%	0.004	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	106.9	-175.1	-155.8	-59	0	0	0	110	V148 L254 A260 I261 G282 T286 D299 M300 V301 L324	V148-Y256 HydrophobicContact CB-CD2 3.91Å; V148-Y256 HydrophobicContact CB-CE2 4.03Å; V148-Y256 HydrophobicContact CB-CG 4.16Å; V148-Y256 HydrophobicContact CG1-CD1 4.46Å; V148-Y256 HydrophobicContact CG1-CD2 4.1Å; V148-Y256 HydrophobicContact CG1-CE1 4.06Å; V148-Y256 HydrophobicContact CG1-CE2 3.68Å; V148-Y256 HydrophobicContact CG1-CG 4.46Å; V148-Y256 HydrophobicContact CG2-CD2 4.16Å; V148-Y256 HydrophobicContact CG2-CE2 4.29Å; L254-Y256 HydrophobicContact CD1-CD2 4.19Å; L254-Y256 HydrophobicContact CD2-CD2 4.24Å; L254-Y256 HydrophobicContact CG-CD2 4.42Å; Y256-A260 HydrophobicContact CE1-CB 4.22Å; Y256-I261 HydrophobicContact CE1-CG1 4.34Å; Y256-I261 WeakPolarHBondContact OH-CD1 3.36Å; Y256-G282 VanDerWaalsContact OH-CA 3.25Å; Y256-G282 WeakPolarHBondContact OH-CA 3.4Å; Y256-T286 HydrophobicContact CE2-CG2 4.27Å; Y256-D299 WeakPolarHBondContact CB-O 3.39Å; Y256-D299 PolarHBondContact N-O 3.15Å; Y256-M300 HydrophobicContact CD1-CE 4.07Å; Y256-M300 HydrophobicContact CG-CE 4.06Å; Y256-V301 PolarHBondContact O-N 3.39Å; Y256-V301 VanDerWaalsContact O-N 3.14Å; Y256-L324 HydrophobicContact CD1-CD1 4.18Å; Y256-L324 HydrophobicContact CE1-CD1 3.59Å; Y256-L324 HydrophobicContact CE2-CD1 4.26Å; Y256-L324 HydrophobicContact CE2-CD2 4.28Å
257	D	98.9	Very high	96	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.011	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	127.8	166.5	-158.7	-50.8	0	0	0	110	H126 V148 D149 D259 A260 V301 E302	H126-D257 IonicContact CE1-OD2 3.09Å; H126-D257 IonicContact CG-OD2 3.15Å; H126-D257 IonicContact ND1-OD2 3.46Å; H126-D257 PolarHBondContact ND1-OD2 3.41Å; V148-D257 PolarHBondContact O-N 3.06Å; D149-D257 HydrophobicContact CB-CB 4.05Å; D149-D257 VanDerWaalsContact CG-CB 3.5Å; D149-D257 WeakPolarHBondContact OD2-CB 3.36Å; D257-D259 PolarHBondContact O-N 3.04Å; D257-D259 WeakPolarHBondContact OD1-CB 3.4Å; D257-D259 PolarHBondContact OD1-N 3.08Å; D257-A260 WeakPolarHBondContact O-CB 3.35Å; D257-A260 PolarHBondContact O-N 3.32Å; D257-V301 HydrophobicContact CB-CG2 4.13Å; D257-E302 WeakPolarHBondContact OD1-CB 3.41Å; D257-E302 WeakPolarHBondContact OD2-CG 3.49Å
258	I	98.8	Very high	97.3	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-65.5	-20.8	179.3	-160.2	57.8	0	0	0	112.4	A260 I261 T266 M300 V301 E302 V303 T317 T320 A321 L324	I258-A260 PolarHBondContact O-N 3.03Å; I258-I261 PolarHBondContact O-N 3.44Å; I258-T266 HydrophobicContact CD1-CG2 3.68Å; I258-T266 HydrophobicContact CG1-CG2 3.66Å; I258-T266 PolarHBondContact O-OG1 2.81Å; I258-M300 HydrophobicContact CB-SD 4.49Å; I258-M300 HydrophobicContact CD1-SD 4.11Å; I258-V301 PolarHBondContact N-O 2.76Å; I258-E302 HydrophobicContact CG2-CB 4.38Å; I258-V303 HydrophobicContact CB-CG2 3.94Å; I258-V303 HydrophobicContact CG1-CG2 4.02Å; I258-V303 HydrophobicContact CG2-CG2 3.95Å; I258-T317 HydrophobicContact CG1-CG2 3.74Å; I258-T317 HydrophobicContact CG2-CG2 4.36Å; I258-T320 HydrophobicContact CD1-CG2 4.37Å; I258-A321 HydrophobicContact CD1-CB 3.91Å; I258-L324 HydrophobicContact CD1-CD1 3.96Å
259	D	98.7	Very high	98	Very high	1 Å²	1	20 Å²	20	1%	0.005	11%	0.111	C	C	.	.	G	3₁₀ helix	trans	-74.7	-7	175	81.7	16.7	0	0	0	113.4	A150 H151 R205 D257 I261 T269 T271	A150-D259 WeakPolarHBondContact CB-OD1 3.41Å; A150-D259 PolarHBondContact N-OD1 3.43Å; H151-D259 IonicContact CE1-OD1 3.92Å; H151-D259 IonicContact CE1-OD2 3.28Å; H151-D259 PolarHBondContact CE1-OD2 3.31Å; H151-D259 IonicContact ND1-OD1 2.92Å; H151-D259 IonicContact ND1-OD2 3.8Å; H151-D259 PolarHBondContact ND1-OD2 3.44Å; R205-D259 PolarHBondContact NH2-O 3.01Å; D257-D259 PolarHBondContact O-N 3.04Å; D257-D259 WeakPolarHBondContact OD1-CB 3.4Å; D257-D259 PolarHBondContact OD1-N 3.08Å; D259-I261 PolarHBondContact O-N 2.92Å; D259-T269 HydrophobicContact CB-CG2 3.73Å; D259-T271 PolarHBondContact OD2-OG1 3.45Å
260	A	98.9	Very high	98.4	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.087	C	C	.	.	G	3₁₀ helix	trans	-60.9	-35.8	168.9	0	0	0	0	0	111.9	V148 R205 Y256 D257 I258 L277	V148-A260 HydrophobicContact CG1-CB 3.73Å; R205-A260 PolarHBondContact NH1-O 3.05Å; R205-A260 PolarHBondContact NH2-O 3.08Å; Y256-A260 HydrophobicContact CE1-CB 4.22Å; D257-A260 WeakPolarHBondContact O-CB 3.35Å; D257-A260 PolarHBondContact O-N 3.32Å; I258-A260 PolarHBondContact O-N 3.03Å; A260-L277 HydrophobicContact CB-CD1 4.22Å; A260-L277 WeakPolarHBondContact O-CB 3.38Å; A260-L277 PolarHBondContact O-N 2.76Å
261	I	98.9	Very high	98.4	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	9%	0.092	C	C	.	.	B	Isolated β-bridge	trans	-75.2	144.3	174.2	-62.6	-63.8	0	0	0	109.4	Y256 I258 D259 I265 T266 L277 L324	Y256-I261 HydrophobicContact CE1-CG1 4.34Å; Y256-I261 WeakPolarHBondContact OH-CD1 3.36Å; I258-I261 PolarHBondContact O-N 3.44Å; D259-I261 PolarHBondContact O-N 2.92Å; I261-I265 HydrophobicContact CG2-CB 3.76Å; I261-I265 HydrophobicContact CG2-CG1 4.44Å; I261-I265 HydrophobicContact CG2-CG2 4.01Å; I261-T266 HydrophobicContact CB-CG2 3.85Å; I261-T266 WeakPolarHBondContact CB-OG1 3.29Å; I261-T266 HydrophobicContact CG2-CG2 3.68Å; I261-T266 PolarHBondContact O-OG1 3.03Å; I261-T266 VanDerWaalsContact O-OG1 3.1Å; I261-L277 WeakPolarHBondContact CA-O 3.32Å; I261-L277 HydrophobicContact CD1-CB 3.74Å; I261-L324 HydrophobicContact CG1-CD1 4.47Å
262	D	98.9	Very high	98.4	Very high	30 Å²	30	16.3 Å²	16.3	16%	0.16	10%	0.102	C	C	.	.			trans	-57.6	138.3	-179.3	-171.8	-94	0	0	0	112	S264 I265 T266 G275 G276 L277	D262-S264 PolarHBondContact O-N 2.96Å; D262-S264 WeakPolarHBondContact OD1-CB 3.38Å; D262-S264 PolarHBondContact OD1-N 3.07Å; D262-S264 PolarHBondContact OD1-OG 2.64Å; D262-I265 PolarHBondContact O-N 3.04Å; D262-T266 PolarHBondContact O-N 2.89Å; D262-T266 VanDerWaalsContact O-N 3.12Å; D262-T266 PolarHBondContact O-OG1 3.4Å; D262-G275 WeakPolarHBondContact OD2-CA 3.36Å; D262-G275 PolarHBondContact OD2-N 2.98Å; D262-G276 PolarHBondContact OD2-N 3.46Å; D262-L277 PolarHBondContact N-O 3.04Å
263	P	98.6	Very high	98.3	Very high	24 Å²	24	16.7 Å²	16.7	16%	0.156	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-15.5	-180	-26.2	34.6	0	0	0	115	I265 P267 P272 A273	P263-I265 PolarHBondContact O-N 3.38Å; P263-P267 WeakPolarHBondContact O-CA 3.31Å; P263-P267 WeakPolarHBondContact O-CB 3.5Å; P263-P267 WeakPolarHBondContact O-CD 3.22Å; P263-P272 HydrophobicContact CB-CB 3.91Å; P263-P272 HydrophobicContact CG-CB 3.58Å; P263-A273 WeakPolarHBondContact CD-O 3.43Å
264	S	98.4	Very high	98.3	Very high	90 Å²	90	22.7 Å²	22.7	63%	0.629	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-19.4	169.2	61.2	0	0	0	0	113.5	D262	D262-S264 PolarHBondContact O-N 2.96Å; D262-S264 WeakPolarHBondContact OD1-CB 3.38Å; D262-S264 PolarHBondContact OD1-N 3.07Å; D262-S264 PolarHBondContact OD1-OG 2.64Å
265	I	98.7	Very high	98.3	Very high	50 Å²	50	25 Å²	25	26%	0.256	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-41.5	178.6	-53.4	-59.9	0	0	0	111.3	I261 D262 P263 P267 Y279 S316 T320	I261-I265 HydrophobicContact CG2-CB 3.76Å; I261-I265 HydrophobicContact CG2-CG1 4.44Å; I261-I265 HydrophobicContact CG2-CG2 4.01Å; D262-I265 PolarHBondContact O-N 3.04Å; P263-I265 PolarHBondContact O-N 3.38Å; I265-P267 WeakPolarHBondContact O-CD 3.45Å; I265-Y279 HydrophobicContact CG2-CD2 4.3Å; I265-S316 WeakPolarHBondContact O-CB 3.5Å; I265-S316 PolarHBondContact O-OG 2.93Å; I265-T320 HydrophobicContact CG2-CG2 4.29Å; I265-T320 WeakPolarHBondContact CG2-OG1 3.07Å
266	T	98.5	Very high	98.3	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	17%	0.171	C	C	.	.			trans	-116.7	55.7	-177.3	51.2	0	0	0	0	113.2	I258 I261 D262 A268 T317 T320	I258-T266 HydrophobicContact CD1-CG2 3.68Å; I258-T266 HydrophobicContact CG1-CG2 3.66Å; I258-T266 PolarHBondContact O-OG1 2.81Å; I261-T266 HydrophobicContact CB-CG2 3.85Å; I261-T266 WeakPolarHBondContact CB-OG1 3.29Å; I261-T266 HydrophobicContact CG2-CG2 3.68Å; I261-T266 PolarHBondContact O-OG1 3.03Å; I261-T266 VanDerWaalsContact O-OG1 3.1Å; D262-T266 PolarHBondContact O-N 2.89Å; D262-T266 VanDerWaalsContact O-N 3.12Å; D262-T266 PolarHBondContact O-OG1 3.4Å; T266-A268 VanDerWaalsContact C-N 3.3Å; T266-A268 PolarHBondContact O-N 3.47Å; T266-T317 VanDerWaalsContact CA-OG1 3.25Å; T266-T317 WeakPolarHBondContact CA-OG1 3.42Å; T266-T317 HydrophobicContact CG2-CG2 4.37Å; T266-T320 HydrophobicContact CG2-CG2 3.73Å
267	P	98.4	Very high	98.3	Very high	19 Å²	19	25.4 Å²	25.4	12%	0.123	17%	0.171	C	C	.	.			trans	-65.6	-27	-173.9	27.1	-35.8	0	0	0	114.6	P263 I265 T269 D313 T317	P263-P267 WeakPolarHBondContact O-CA 3.31Å; P263-P267 WeakPolarHBondContact O-CB 3.5Å; P263-P267 WeakPolarHBondContact O-CD 3.22Å; I265-P267 WeakPolarHBondContact O-CD 3.45Å; P267-T269 VanDerWaalsContact C-N 3.25Å; P267-T269 PolarHBondContact O-N 3.12Å; P267-D313 HydrophobicContact CB-CB 4.29Å; P267-D313 HydrophobicContact CG-CB 3.55Å; P267-T317 WeakPolarHBondContact CD-OG1 3.25Å
268	A	98.5	Very high	98.3	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.008	19%	0.19	C	C	.	.	S	Bend	trans	-80.3	65.4	-177.9	0	0	0	0	0	112.4	T266 N304 V314 T317	T266-A268 VanDerWaalsContact C-N 3.3Å; T266-A268 PolarHBondContact O-N 3.47Å; A268-N304 CarbonylContact C-O 3.57Å; A268-N304 WeakPolarHBondContact CB-O 3.44Å; A268-N304 CarbonylContact O-C 3.58Å; A268-N304 PolarHBondContact O-N 2.66Å; A268-V314 HydrophobicContact CB-CG2 4.5Å; A268-T317 HydrophobicContact CB-CG2 4.2Å; A268-T317 WeakPolarHBondContact CB-OG1 3.49Å; A268-T317 PolarHBondContact N-OG1 2.89Å
269	T	98.3	Very high	98.3	Very high	3 Å²	3	32 Å²	32	2%	0.018	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-136	164.2	176.5	-176	0	0	0	0	111.8	D259 P267 P272 E302 R307	D259-T269 HydrophobicContact CB-CG2 3.73Å; P267-T269 VanDerWaalsContact C-N 3.25Å; P267-T269 PolarHBondContact O-N 3.12Å; T269-P272 HydrophobicContact CG2-CB 4.02Å; T269-E302 WeakPolarHBondContact CA-O 3.39Å; T269-E302 PolarHBondContact OG1-O 3.37Å; T269-E302 VanDerWaalsContact OG1-O 3.12Å; T269-R307 WeakPolarHBondContact O-CB 3.23Å; T269-R307 WeakPolarHBondContact O-CG 3.5Å
270	G	96.6	Very high	98.3	Very high	2 Å²	2	40.8 Å²	40.8	2%	0.021	24%	0.237	C	C	.	.	S	Bend	trans	-67.1	-45.6	178.8	0	0	0	0	0	113.5	K46 P272	K46-G270 PolarHBondContact NZ-O 3.09Å; G270-P272 VanDerWaalsContact C-CD 3.5Å; G270-P272 WeakPolarHBondContact O-CD 3.44Å
271	T	96	Very high	98.3	Very high	42 Å²	42	42.8 Å²	42.8	26%	0.258	25%	0.246	S	C	.	.	S	Bend	trans	-127.9	62.4	-166.2	32.7	0	0	0	0	111.8	H151 D259 A273	H151-T271 PolarHBondContact CE1-O 3.17Å; D259-T271 PolarHBondContact OD2-OG1 3.45Å; T271-A273 PolarHBondContact O-N 2.92Å
272	P	96.9	Very high	98.3	Very high	74 Å²	74	42.8 Å²	42.8	48%	0.481	25%	0.246	S	C	.	.			trans	-66.1	124.5	-176	28.2	-34.8	0	0	0	111.9	P263 T269 G270	P263-P272 HydrophobicContact CB-CB 3.91Å; P263-P272 HydrophobicContact CG-CB 3.58Å; T269-P272 HydrophobicContact CG2-CB 4.02Å; G270-P272 VanDerWaalsContact C-CD 3.5Å; G270-P272 WeakPolarHBondContact O-CD 3.44Å
273	A	97.2	Very high	98.3	Very high	12 Å²	12	41.8 Å²	41.8	10%	0.099	24%	0.241	C	C	.	.			trans	-116.3	123	173	0	0	0	0	0	110.9	A150 R205 D206 P263 T271	A150-A273 HydrophobicContact CB-CB 4.02Å; R205-A273 HydrophobicContact CG-CB 4.12Å; R205-A273 PolarHBondContact NE-O 3.22Å; R205-A273 PolarHBondContact NH2-O 3.37Å; D206-A273 HydrophobicContact CB-CB 4.27Å; P263-A273 WeakPolarHBondContact CD-O 3.43Å; T271-A273 PolarHBondContact O-N 2.92Å
274	V	98.3	Very high	98.3	Very high	126 Å²	126	43.5 Å²	43.5	76%	0.764	25%	0.245	S	C	*	.	S	Bend	trans	-69.7	158.8	-178.3	-62.5	0	0	0	0	112.9	R205	R205-V274 WeakPolarHBondContact CD-O 3.38Å
275	G	98.4	Very high	98.3	Very high	48 Å²	48	39.2 Å²	39.2	50%	0.495	22%	0.215	S	C	.	.	S	Bend	trans	75.5	34.3	-178.7	0	0	0	0	0	111.9	R205 M225 D262	R205-G275 WeakPolarHBondContact CD-O 3.14Å; M225-G275 WeakPolarHBondContact CE-O 3.45Å; M225-G275 WeakPolarHBondContact CG-O 3.45Å; D262-G275 WeakPolarHBondContact OD2-CA 3.36Å; D262-G275 PolarHBondContact OD2-N 2.98Å
276	G	98.8	Very high	98.3	Very high	10 Å²	10	36.9 Å²	36.9	10%	0.103	20%	0.203	C	C	.	.			trans	-84.9	-174.2	-177.7	0	0	0	0	0	114.4	M225 D262	M225-G276 WeakPolarHBondContact CE-O 3.46Å; D262-G276 PolarHBondContact OD2-N 3.46Å
277	L	98.9	Very high	98.2	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-60.8	139.7	174.3	-63.7	176.1	0	0	0	110.2	V148 M225 V228 M233 A260 I261 D262 E281 I285	V148-L277 HydrophobicContact CG1-CD1 3.78Å; M225-L277 HydrophobicContact CE-CD2 4.12Å; M225-L277 HydrophobicContact SD-CD2 3.68Å; M225-L277 HydrophobicContact SD-CG 4.06Å; V228-L277 HydrophobicContact CG1-CD2 4.21Å; V228-L277 HydrophobicContact CG2-CD2 4.26Å; M233-L277 HydrophobicContact CE-CD2 3.47Å; M233-L277 VanDerWaalsContact CE-CD2 3.47Å; A260-L277 HydrophobicContact CB-CD1 4.22Å; A260-L277 WeakPolarHBondContact O-CB 3.38Å; A260-L277 PolarHBondContact O-N 2.76Å; I261-L277 WeakPolarHBondContact CA-O 3.32Å; I261-L277 HydrophobicContact CD1-CB 3.74Å; D262-L277 PolarHBondContact N-O 3.04Å; L277-E281 HydrophobicContact CB-CB 4.48Å; L277-E281 HydrophobicContact CD2-CB 4.39Å; L277-I285 HydrophobicContact CD1-CD1 3.82Å
278	T	98.9	Very high	98.1	Very high	68 Å²	68	38 Å²	38	42%	0.417	21%	0.205	S	C	.	.			trans	-71.6	157.8	169.2	65.8	0	0	0	0	110.4	R280 E281 G282	T278-R280 PolarHBondContact O-N 3.3Å; T278-R280 VanDerWaalsContact O-N 3.13Å; T278-E281 WeakPolarHBondContact CB-OE2 3.25Å; T278-E281 WeakPolarHBondContact CG2-OE2 3.5Å; T278-E281 PolarHBondContact N-OE2 3.09Å; T278-E281 PolarHBondContact O-N 2.81Å; T278-E281 VanDerWaalsContact OG1-CD 3.31Å; T278-E281 VanDerWaalsContact OG1-CG 3.26Å; T278-E281 WeakPolarHBondContact OG1-CG 3.41Å; T278-E281 PolarHBondContact OG1-N 3.33Å; T278-E281 PolarHBondContact OG1-OE2 3.25Å; T278-G282 PolarHBondContact O-N 3.44Å
279	Y	98.8	Very high	98.1	Very high	73 Å²	73	38 Å²	38	29%	0.286	21%	0.205	S	C	.	.	H	α-helix	trans	-49.4	-41.7	171.4	176.2	-87.5	0	0	0	112.4	I265 E281 G282 V283 T320 D323	I265-Y279 HydrophobicContact CG2-CD2 4.3Å; Y279-E281 VanDerWaalsContact C-N 3.34Å; Y279-E281 PolarHBondContact O-N 2.97Å; Y279-G282 PolarHBondContact O-N 2.98Å; Y279-V283 HydrophobicContact CD1-CG2 4.18Å; Y279-V283 HydrophobicContact CE1-CG2 3.7Å; Y279-V283 HydrophobicContact CE2-CG2 4.31Å; Y279-V283 WeakPolarHBondContact O-CG2 3.11Å; Y279-V283 PolarHBondContact O-N 3.04Å; Y279-T320 HydrophobicContact CD2-CG2 3.94Å; Y279-T320 HydrophobicContact CE2-CG2 4.24Å; Y279-D323 HydrophobicContact CE2-CB 4.3Å; Y279-D323 PolarHBondContact OH-OD2 3.32Å
280	R	98.8	Very high	97.9	Very high	185 Å²	185	39.3 Å²	39.3	70%	0.698	21%	0.21	S	C	*	.	H	α-helix	trans	-66	-35.3	-178.2	-75.5	170.1	57.9	-156.8	-3.4	112.9	T278 Y284 R333	T278-R280 PolarHBondContact O-N 3.3Å; T278-R280 VanDerWaalsContact O-N 3.13Å; R280-Y284 VanDerWaalsContact O-CB 3.32Å; R280-Y284 WeakPolarHBondContact O-CB 3.19Å; R280-Y284 PolarHBondContact O-N 2.9Å; R280-R333 PolarHBondContact O-NH1 2.97Å; R280-R333 VanDerWaalsContact O-NH1 3.08Å
281	E	98.9	Very high	97.7	Very high	42 Å²	42	42.8 Å²	42.8	20%	0.196	23%	0.226	C	C	.	.	H	α-helix	trans	-74.7	-43.6	178.1	-70.2	166.1	135.5	0	0	110.8	V228 M233 L277 T278 Y279 V283 Y284 I285	V228-E281 WeakPolarHBondContact CG1-OE1 3.11Å; M233-E281 HydrophobicContact CB-CB 4.24Å; M233-E281 HydrophobicContact CB-CG 3.82Å; M233-E281 HydrophobicContact CE-CB 4Å; M233-E281 HydrophobicContact CE-CG 4.44Å; M233-E281 HydrophobicContact CG-CB 4.02Å; M233-E281 HydrophobicContact CG-CG 4.16Å; L277-E281 HydrophobicContact CB-CB 4.48Å; L277-E281 HydrophobicContact CD2-CB 4.39Å; T278-E281 WeakPolarHBondContact CB-OE2 3.25Å; T278-E281 WeakPolarHBondContact CG2-OE2 3.5Å; T278-E281 PolarHBondContact N-OE2 3.09Å; T278-E281 PolarHBondContact O-N 2.81Å; T278-E281 VanDerWaalsContact OG1-CD 3.31Å; T278-E281 VanDerWaalsContact OG1-CG 3.26Å; T278-E281 WeakPolarHBondContact OG1-CG 3.41Å; T278-E281 PolarHBondContact OG1-N 3.33Å; T278-E281 PolarHBondContact OG1-OE2 3.25Å; Y279-E281 VanDerWaalsContact C-N 3.34Å; Y279-E281 PolarHBondContact O-N 2.97Å; E281-V283 PolarHBondContact O-N 3.05Å; E281-Y284 WeakPolarHBondContact O-CB 3.39Å; E281-Y284 PolarHBondContact O-N 3.45Å; E281-Y284 VanDerWaalsContact O-N 3.08Å; E281-I285 WeakPolarHBondContact O-CG1 3.38Å; E281-I285 PolarHBondContact O-N 3.48Å
282	G	98.8	Very high	97.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-56.4	-48.9	173.3	0	0	0	0	0	112.3	Y256 T278 Y279 Y284 I285 T286 L324	Y256-G282 VanDerWaalsContact OH-CA 3.25Å; Y256-G282 WeakPolarHBondContact OH-CA 3.4Å; T278-G282 PolarHBondContact O-N 3.44Å; Y279-G282 PolarHBondContact O-N 2.98Å; G282-Y284 VanDerWaalsContact C-N 3.32Å; G282-Y284 PolarHBondContact O-N 3.04Å; G282-I285 PolarHBondContact O-N 2.7Å; G282-T286 PolarHBondContact O-N 2.8Å; G282-L324 WeakPolarHBondContact O-CD2 3.43Å
283	V	98.6	Very high	97.5	Very high	8 Å²	8	39.8 Å²	39.8	5%	0.048	22%	0.216	C	C	.	.	H	α-helix	trans	-61.4	-40.8	174.8	172.5	0	0	0	0	111.3	Y279 E281 I285 T286 E287 L324 R333	Y279-V283 HydrophobicContact CD1-CG2 4.18Å; Y279-V283 HydrophobicContact CE1-CG2 3.7Å; Y279-V283 HydrophobicContact CE2-CG2 4.31Å; Y279-V283 WeakPolarHBondContact O-CG2 3.11Å; Y279-V283 PolarHBondContact O-N 3.04Å; E281-V283 PolarHBondContact O-N 3.05Å; V283-I285 PolarHBondContact O-N 3.37Å; V283-T286 PolarHBondContact O-N 2.87Å; V283-T286 PolarHBondContact O-OG1 3.13Å; V283-E287 HydrophobicContact CG1-CG 4.12Å; V283-E287 WeakPolarHBondContact O-CG 3.34Å; V283-E287 PolarHBondContact O-N 3.22Å; V283-L324 HydrophobicContact CG2-CD2 4.28Å; V283-R333 HydrophobicContact CG1-CG 4.14Å
284	Y	98.7	Very high	97.4	Very high	61 Å²	61	41.2 Å²	41.2	24%	0.239	22%	0.222	C	C	.	.	H	α-helix	trans	-60.7	-42	178.8	-174.1	-85.6	0	0	0	112.5	M233 A234 M237 R280 E281 G282 T286 E287 Y288	M233-Y284 HydrophobicContact CB-CD1 4.47Å; M233-Y284 HydrophobicContact CG-CD1 3.69Å; M233-Y284 HydrophobicContact CG-CE1 4.44Å; M233-Y284 HydrophobicContact CG-CG 4.3Å; A234-Y284 WeakPolarHBondContact CA-OH 3.47Å; A234-Y284 HydrophobicContact CB-CE1 4.32Å; A234-Y284 WeakPolarHBondContact CB-OH 3.41Å; M237-Y284 HydrophobicContact CB-CE1 4.06Å; M237-Y284 HydrophobicContact CG-CD1 3.95Å; M237-Y284 HydrophobicContact CG-CE1 3.86Å; R280-Y284 VanDerWaalsContact O-CB 3.32Å; R280-Y284 WeakPolarHBondContact O-CB 3.19Å; R280-Y284 PolarHBondContact O-N 2.9Å; E281-Y284 WeakPolarHBondContact O-CB 3.39Å; E281-Y284 PolarHBondContact O-N 3.45Å; E281-Y284 VanDerWaalsContact O-N 3.08Å; G282-Y284 VanDerWaalsContact C-N 3.32Å; G282-Y284 PolarHBondContact O-N 3.04Å; Y284-T286 VanDerWaalsContact C-N 3.32Å; Y284-T286 PolarHBondContact O-N 3.32Å; Y284-E287 PolarHBondContact O-N 2.99Å; Y284-Y288 AromaticContact CE1-CD2 3.72Å; Y284-Y288 HydrophobicContact CE1-CD2 3.72Å; Y284-Y288 HydrophobicContact CE1-CE2 4.48Å; Y284-Y288 HydrophobicContact CE1-CG 4.47Å; Y284-Y288 AromaticContact CZ-CD2 3.87Å; Y284-Y288 WeakPolarHBondContact O-CB 3.42Å; Y284-Y288 PolarHBondContact O-N 2.99Å
285	I	98.8	Very high	97.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-55.2	-50.4	175	-65.7	165.3	0	0	0	109.9	V148 I202 M233 M237 L277 E281 G282 V283 Y288 L289	V148-I285 HydrophobicContact CG1-CD1 4.01Å; V148-I285 HydrophobicContact CG2-CD1 4.43Å; V148-I285 HydrophobicContact CG2-CG2 4.17Å; I202-I285 HydrophobicContact CG2-CD1 4.1Å; M233-I285 HydrophobicContact CE-CD1 4.03Å; M233-I285 HydrophobicContact CE-CG1 4.3Å; M233-I285 HydrophobicContact CG-CG1 4.3Å; M233-I285 HydrophobicContact SD-CD1 3.94Å; M233-I285 HydrophobicContact SD-CG1 3.55Å; M233-I285 VanDerWaalsContact SD-CG1 3.55Å; M237-I285 HydrophobicContact CE-CG2 4.15Å; M237-I285 HydrophobicContact CG-CG1 4.44Å; M237-I285 HydrophobicContact SD-CB 4.15Å; M237-I285 HydrophobicContact SD-CG1 3.79Å; M237-I285 HydrophobicContact SD-CG2 4Å; L277-I285 HydrophobicContact CD1-CD1 3.82Å; E281-I285 WeakPolarHBondContact O-CG1 3.38Å; E281-I285 PolarHBondContact O-N 3.48Å; G282-I285 PolarHBondContact O-N 2.7Å; V283-I285 PolarHBondContact O-N 3.37Å; I285-Y288 PolarHBondContact O-N 2.78Å; I285-L289 HydrophobicContact CG2-CD1 3.87Å; I285-L289 HydrophobicContact CG2-CG 4.37Å; I285-L289 WeakPolarHBondContact O-CB 3.39Å; I285-L289 WeakPolarHBondContact O-CG 3.42Å; I285-L289 PolarHBondContact O-N 2.87Å
286	T	98.5	Very high	97.4	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-66.8	-40.3	-177.3	64.6	0	0	0	0	112.9	Y256 G282 V283 Y284 Y288 Y290 L324 C328	Y256-T286 HydrophobicContact CE2-CG2 4.27Å; G282-T286 PolarHBondContact O-N 2.8Å; V283-T286 PolarHBondContact O-N 2.87Å; V283-T286 PolarHBondContact O-OG1 3.13Å; Y284-T286 VanDerWaalsContact C-N 3.32Å; Y284-T286 PolarHBondContact O-N 3.32Å; T286-Y288 PolarHBondContact O-N 3.45Å; T286-Y290 WeakPolarHBondContact O-CB 3.49Å; T286-Y290 PolarHBondContact O-N 2.94Å; T286-L324 HydrophobicContact CG2-CB 4.19Å; T286-L324 HydrophobicContact CG2-CD2 4.09Å; T286-L324 WeakPolarHBondContact CG2-O 3.39Å; T286-C328 VanDerWaalsContact CG2-SG 3.6Å
287	E	97.1	Very high	97.4	Very high	25 Å²	25	34.1 Å²	34.1	12%	0.117	17%	0.166	C	C	.	.	H	α-helix	trans	-62.3	-42.1	174.4	-74.9	178	160.6	0	0	111.3	V283 Y284 Q291 R333	V283-E287 HydrophobicContact CG1-CG 4.12Å; V283-E287 WeakPolarHBondContact O-CG 3.34Å; V283-E287 PolarHBondContact O-N 3.22Å; Y284-E287 PolarHBondContact O-N 2.99Å; E287-Q291 VanDerWaalsContact O-CG 3.3Å; E287-Q291 WeakPolarHBondContact O-CG 3.49Å; E287-Q291 PolarHBondContact O-N 3.01Å; E287-R333 WeakPolarHBondContact OE1-CG 3.34Å; E287-R333 PolarHBondContact OE1-N 2.77Å; E287-R333 IonicContact OE1-NE 3.76Å; E287-R333 PolarHBondContact OE1-NE 2.81Å; E287-R333 IonicContact OE2-CZ 3.69Å; E287-R333 VanDerWaalsContact OE2-CZ 3.3Å; E287-R333 IonicContact OE2-NE 2.72Å; E287-R333 PolarHBondContact OE2-NE 3.12Å; E287-R333 VanDerWaalsContact OE2-NE 3.15Å; E287-R333 IonicContact OE2-NH2 2.98Å; E287-R333 PolarHBondContact OE2-NH2 2.95Å
288	Y	97.4	Very high	97.4	Very high	17 Å²	17	34.1 Å²	34.1	7%	0.067	17%	0.167	C	C	.	.	H	α-helix	trans	-68.5	-46.9	-179.9	-158.3	-71.5	0	0	0	111.2	M237 E238 C241 Y284 I285 T286 Y290 Q291 T292	M237-Y288 HydrophobicContact CB-CD1 3.94Å; M237-Y288 HydrophobicContact CB-CD2 3.72Å; M237-Y288 HydrophobicContact CB-CE1 4.21Å; M237-Y288 HydrophobicContact CB-CE2 3.98Å; M237-Y288 HydrophobicContact CB-CG 3.7Å; M237-Y288 HydrophobicContact CE-CD1 4.19Å; M237-Y288 HydrophobicContact CE-CG 4.35Å; M237-Y288 HydrophobicContact CG-CD2 4.44Å; M237-Y288 HydrophobicContact CG-CG 4.22Å; E238-Y288 WeakPolarHBondContact CG-OH 3.43Å; C241-Y288 HydrophobicContact CB-CE1 4.41Å; C241-Y288 VanDerWaalsContact SG-CE1 3.51Å; Y284-Y288 AromaticContact CE1-CD2 3.72Å; Y284-Y288 HydrophobicContact CE1-CD2 3.72Å; Y284-Y288 HydrophobicContact CE1-CE2 4.48Å; Y284-Y288 HydrophobicContact CE1-CG 4.47Å; Y284-Y288 AromaticContact CZ-CD2 3.87Å; Y284-Y288 WeakPolarHBondContact O-CB 3.42Å; Y284-Y288 PolarHBondContact O-N 2.99Å; I285-Y288 PolarHBondContact O-N 2.78Å; T286-Y288 PolarHBondContact O-N 3.45Å; Y288-Y290 VanDerWaalsContact C-N 3.31Å; Y288-Y290 PolarHBondContact O-N 3.23Å; Y288-Q291 WeakPolarHBondContact O-CB 3.41Å; Y288-Q291 PolarHBondContact O-N 2.66Å; Y288-Q291 VanDerWaalsContact O-N 3.1Å; Y288-T292 WeakPolarHBondContact O-CG2 3.39Å; Y288-T292 PolarHBondContact O-N 2.82Å
289	L	96.7	Very high	97.4	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-61.9	-38	177.3	-70.4	178.1	0	0	0	112	V146 M237 I252 L254 I285 Q291 T292	V146-L289 HydrophobicContact CG1-CD1 4.4Å; V146-L289 HydrophobicContact CG2-CD2 4.3Å; M237-L289 HydrophobicContact CE-CD2 3.77Å; M237-L289 HydrophobicContact CE-CG 3.81Å; I252-L289 HydrophobicContact CD1-CD2 4.13Å; I252-L289 HydrophobicContact CG2-CD2 4.45Å; L254-L289 HydrophobicContact CB-CD1 4.41Å; L254-L289 HydrophobicContact CD1-CD1 3.82Å; L254-L289 HydrophobicContact CD2-CD1 3.87Å; L254-L289 HydrophobicContact CG-CD1 4.25Å; I285-L289 HydrophobicContact CG2-CD1 3.87Å; I285-L289 HydrophobicContact CG2-CG 4.37Å; I285-L289 WeakPolarHBondContact O-CB 3.39Å; I285-L289 WeakPolarHBondContact O-CG 3.42Å; I285-L289 PolarHBondContact O-N 2.87Å; L289-Q291 VanDerWaalsContact C-N 3.35Å; L289-Q291 PolarHBondContact O-N 2.82Å; L289-T292 WeakPolarHBondContact O-CB 3.41Å; L289-T292 PolarHBondContact O-N 3.15Å; L289-T292 PolarHBondContact O-OG1 2.85Å
290	Y	95.1	Very high	97.4	Very high	32 Å²	32	27.6 Å²	27.6	13%	0.125	13%	0.134	C	C	.	.	H	α-helix	trans	-58.8	-44.6	172	169.5	-103.3	0	0	0	112.2	P27 T286 Y288 T292 G293 C328 G330	P27-Y290 HydrophobicContact CG-CE1 4.5Å; P27-Y290 WeakPolarHBondContact CG-OH 3.31Å; T286-Y290 WeakPolarHBondContact O-CB 3.49Å; T286-Y290 PolarHBondContact O-N 2.94Å; Y288-Y290 VanDerWaalsContact C-N 3.31Å; Y288-Y290 PolarHBondContact O-N 3.23Å; Y290-T292 PolarHBondContact O-N 3.31Å; Y290-T292 VanDerWaalsContact O-N 3.17Å; Y290-G293 PolarHBondContact O-N 3.06Å; Y290-G293 VanDerWaalsContact O-N 3.09Å; Y290-C328 WeakPolarHBondContact CD2-O 3.39Å; Y290-G330 VanDerWaalsContact CZ-CA 3.4Å
291	Q	93.3	Very high	97.4	Very high	75 Å²	75	18.8 Å²	18.8	35%	0.35	10%	0.101	S	C	.	.	H	α-helix	trans	-62.9	-22.3	-178.7	-72.7	173.7	8.5	0	0	113.6	E287 Y288 L289 G293	E287-Q291 VanDerWaalsContact O-CG 3.3Å; E287-Q291 WeakPolarHBondContact O-CG 3.49Å; E287-Q291 PolarHBondContact O-N 3.01Å; Y288-Q291 WeakPolarHBondContact O-CB 3.41Å; Y288-Q291 PolarHBondContact O-N 2.66Å; Y288-Q291 VanDerWaalsContact O-N 3.1Å; L289-Q291 VanDerWaalsContact C-N 3.35Å; L289-Q291 PolarHBondContact O-N 2.82Å; Q291-G293 PolarHBondContact O-N 3.24Å
292	T	93.9	Very high	97.4	Very high	6 Å²	6	16.9 Å²	16.9	4%	0.037	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-27.7	175.6	72.4	0	0	0	0	113	H24 W245 I252 Y288 L289 Y290 L294	H24-T292 PolarHBondContact ND1-O 3.15Å; H24-T292 VanDerWaalsContact ND1-O 3.17Å; W245-T292 HydrophobicContact CH2-CG2 3.95Å; W245-T292 HydrophobicContact CZ2-CG2 3.63Å; I252-T292 HydrophobicContact CD1-CG2 4.36Å; Y288-T292 WeakPolarHBondContact O-CG2 3.39Å; Y288-T292 PolarHBondContact O-N 2.82Å; L289-T292 WeakPolarHBondContact O-CB 3.41Å; L289-T292 PolarHBondContact O-N 3.15Å; L289-T292 PolarHBondContact O-OG1 2.85Å; Y290-T292 PolarHBondContact O-N 3.31Å; Y290-T292 VanDerWaalsContact O-N 3.17Å; T292-L294 PolarHBondContact O-N 2.84Å; T292-L294 PolarHBondContact OG1-N 3.22Å
293	G	93.6	Very high	97.4	Very high	47 Å²	47	16.9 Å²	16.9	49%	0.485	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	71	8.4	-170.6	0	0	0	0	0	114.5	Y290 Q291	Y290-G293 PolarHBondContact O-N 3.06Å; Y290-G293 VanDerWaalsContact O-N 3.09Å; Q291-G293 PolarHBondContact O-N 3.24Å
294	L	95.9	Very high	97.4	Very high	42 Å²	42	16.5 Å²	16.5	22%	0.22	9%	0.09	C	C	.	.			trans	-108.2	-4.4	-173.7	-63	174.2	0	0	0	114	W245 K249 I252 T292 S296	W245-L294 HydrophobicContact CZ2-CD1 4.32Å; K249-L294 HydrophobicContact CB-CD1 4.13Å; K249-L294 HydrophobicContact CD-CD1 4.45Å; K249-L294 HydrophobicContact CG-CD1 4.4Å; I252-L294 HydrophobicContact CD1-CB 3.96Å; I252-L294 HydrophobicContact CG1-CB 3.99Å; I252-L294 PolarHBondContact N-O 3.21Å; T292-L294 PolarHBondContact O-N 2.84Å; T292-L294 PolarHBondContact OG1-N 3.22Å; L294-S296 PolarHBondContact O-N 3.1Å; L294-S296 VanDerWaalsContact O-N 3.17Å
295	L	97.2	Very high	97.3	Very high	20 Å²	20	14.2 Å²	14.2	11%	0.105	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	116	-179.5	-169.5	66.1	0	0	0	111.3	T118 I252 L254 V298 C328	T118-L295 PolarHBondContact OG1-O 2.9Å; I252-L295 HydrophobicContact CB-CD1 4.43Å; I252-L295 HydrophobicContact CG2-CD1 4.07Å; L254-L295 HydrophobicContact CB-CD1 3.8Å; L295-V298 HydrophobicContact CD1-CG2 4.03Å; L295-V298 HydrophobicContact CD2-CG2 3.71Å; L295-V298 HydrophobicContact CG-CG2 3.97Å; L295-C328 HydrophobicContact CD2-CB 3.55Å
296	S	98.3	Very high	97.3	Very high	14 Å²	14	18.9 Å²	18.9	10%	0.098	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	-20.8	-168.1	178.6	0	0	0	0	113.5	K113 T118 A119 H136 I252 L294	K113-S296 WeakPolarHBondContact CE-OG 3.38Å; K113-S296 PolarHBondContact NZ-O 3.45Å; K113-S296 PolarHBondContact NZ-OG 3.45Å; T118-S296 WeakPolarHBondContact CA-O 3.35Å; A119-S296 PolarHBondContact N-O 3.24Å; A119-S296 VanDerWaalsContact N-O 3.16Å; H136-S296 WeakPolarHBondContact NE2-CB 3.26Å; H136-S296 PolarHBondContact NE2-OG 3.41Å; I252-S296 PolarHBondContact O-N 3.03Å; L294-S296 PolarHBondContact O-N 3.1Å; L294-S296 VanDerWaalsContact O-N 3.17Å
297	A	98.8	Very high	97.3	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	151	167.8	0	0	0	0	0	111.1	A119 I252 H253 L254	A119-A297 HydrophobicContact CB-CB 4.23Å; A119-A297 CarbonylContact O-C 3.54Å; A119-A297 WeakPolarHBondContact O-CA 3.14Å; I252-A297 PolarHBondContact O-N 3.4Å; H253-A297 WeakPolarHBondContact ND1-CB 3.35Å; L254-A297 PolarHBondContact N-O 3.14Å
298	V	98.9	Very high	97.3	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.006	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	126.5	175.1	-172.6	0	0	0	0	109.7	A119 V120 I121 L254 L295 L325 C328	A119-V298 PolarHBondContact O-N 3.19Å; V120-V298 CarbonylContact C-O 3.17Å; V120-V298 WeakPolarHBondContact CA-O 3.49Å; I121-V298 PolarHBondContact N-O 3.39Å; L254-V298 HydrophobicContact CB-CG1 4.44Å; L254-V298 HydrophobicContact CB-CG2 4.43Å; L254-V298 HydrophobicContact CD2-CG1 4.09Å; L254-V298 HydrophobicContact CG-CG1 4.29Å; L254-V298 CarbonylContact O-C 3.56Å; L254-V298 VanDerWaalsContact O-CA 3.26Å; L254-V298 WeakPolarHBondContact O-CA 3.45Å; L295-V298 HydrophobicContact CD1-CG2 4.03Å; L295-V298 HydrophobicContact CD2-CG2 3.71Å; L295-V298 HydrophobicContact CG-CG2 3.97Å; V298-L325 HydrophobicContact CG1-CD2 3.9Å; V298-C328 HydrophobicContact CG2-CB 4.25Å
299	D	98.9	Very high	97.2	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	134.3	164.4	-58.7	-21.5	0	0	0	108.9	I121 S132 H253 L254 Y256 V301	I121-D299 VanDerWaalsContact CB-OD1 3.32Å; I121-D299 WeakPolarHBondContact CB-OD1 3.08Å; I121-D299 VanDerWaalsContact CD1-OD1 3.27Å; I121-D299 WeakPolarHBondContact CD1-OD1 3.49Å; I121-D299 WeakPolarHBondContact CG1-OD1 3.28Å; S132-D299 VanDerWaalsContact CB-OD1 3.26Å; S132-D299 WeakPolarHBondContact CB-OD1 3.29Å; S132-D299 WeakPolarHBondContact CB-OD2 3.33Å; S132-D299 PolarHBondContact OG-OD1 3.46Å; S132-D299 PolarHBondContact OG-OD2 3.49Å; H253-D299 IonicContact CE1-OD1 3.18Å; H253-D299 IonicContact CE1-OD2 3.89Å; H253-D299 IonicContact NE2-OD1 2.68Å; H253-D299 IonicContact NE2-OD2 2.91Å; H253-D299 PolarHBondContact NE2-OD2 3.32Å; H253-D299 VanDerWaalsContact NE2-OD2 3.11Å; L254-D299 PolarHBondContact O-N 3.43Å; Y256-D299 WeakPolarHBondContact CB-O 3.39Å; Y256-D299 PolarHBondContact N-O 3.15Å; D299-V301 HydrophobicContact CB-CG1 4.12Å
300	M	98.9	Very high	97.3	Very high	3 Å²	3	36.8 Å²	36.8	2%	0.015	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	103.6	171.1	175.7	58.8	58.8	0	0	107.9	L56 I121 G123 Y256 I258 A321 L324 L325	L56-M300 HydrophobicContact CD1-CG 4.36Å; I121-M300 PolarHBondContact O-N 3.03Å; G123-M300 WeakPolarHBondContact CA-O 3.37Å; G123-M300 PolarHBondContact N-O 3.28Å; Y256-M300 HydrophobicContact CD1-CE 4.07Å; Y256-M300 HydrophobicContact CG-CE 4.06Å; I258-M300 HydrophobicContact CB-SD 4.49Å; I258-M300 HydrophobicContact CD1-SD 4.11Å; M300-A321 HydrophobicContact CG-CB 4.05Å; M300-A321 HydrophobicContact SD-CB 3.76Å; M300-L324 HydrophobicContact CE-CB 3.92Å; M300-L324 HydrophobicContact CE-CD1 4.03Å; M300-L325 HydrophobicContact CB-CD1 4.19Å; M300-L325 HydrophobicContact CB-CD2 4.09Å; M300-L325 HydrophobicContact CB-CG 4.31Å; M300-L325 HydrophobicContact CE-CG 4.26Å; M300-L325 HydrophobicContact CG-CD1 4.18Å; M300-L325 HydrophobicContact CG-CG 4.42Å
301	V	98.9	Very high	97.4	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	171.9	-165.6	-59.1	0	0	0	0	112.6	G124 H126 Y256 D257 I258 D299 V303	G124-V301 WeakPolarHBondContact O-CB 3.36Å; H126-V301 HydrophobicContact CB-CG2 4.08Å; Y256-V301 PolarHBondContact O-N 3.39Å; Y256-V301 VanDerWaalsContact O-N 3.14Å; D257-V301 HydrophobicContact CB-CG2 4.13Å; I258-V301 PolarHBondContact N-O 2.76Å; D299-V301 HydrophobicContact CB-CG1 4.12Å; V301-V303 PolarHBondContact O-N 3Å
302	E	98.8	Very high	97.7	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	23%	0.229	C	C	.	.			trans	59.2	7.4	173	-61.6	-65.3	175.1	0	0	116.8	V49 G124 D125 H126 H166 D257 I258 T269 N304	V49-E302 WeakPolarHBondContact CG1-OE2 3.27Å; G124-E302 PolarHBondContact O-N 3.09Å; D125-E302 VanDerWaalsContact CA-OE1 3.26Å; D125-E302 WeakPolarHBondContact CA-OE1 3.27Å; D125-E302 VanDerWaalsContact CB-OE1 3.31Å; D125-E302 WeakPolarHBondContact CB-OE1 3.39Å; H126-E302 HydrophobicContact CB-CG 4.26Å; H126-E302 PolarHBondContact N-OE1 2.98Å; H166-E302 IonicContact CG-OE1 3.96Å; H166-E302 IonicContact ND1-OE1 3.88Å; H166-E302 PolarHBondContact ND1-OE1 3.36Å; D257-E302 WeakPolarHBondContact OD1-CB 3.41Å; D257-E302 WeakPolarHBondContact OD2-CG 3.49Å; I258-E302 HydrophobicContact CG2-CB 4.38Å; T269-E302 WeakPolarHBondContact CA-O 3.39Å; T269-E302 PolarHBondContact OG1-O 3.37Å; T269-E302 VanDerWaalsContact OG1-O 3.12Å; E302-N304 PolarHBondContact O-N 3.01Å
303	V	98.9	Very high	97.9	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.006	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-58	113	162.3	178.5	0	0	0	0	107.7	A52 I258 V301 P305 T317 V318 A321	A52-V303 HydrophobicContact CB-CB 3.8Å; A52-V303 HydrophobicContact CB-CG1 4.05Å; A52-V303 WeakPolarHBondContact CB-O 3.22Å; I258-V303 HydrophobicContact CB-CG2 3.94Å; I258-V303 HydrophobicContact CG1-CG2 4.02Å; I258-V303 HydrophobicContact CG2-CG2 3.95Å; V301-V303 PolarHBondContact O-N 3Å; V303-P305 WeakPolarHBondContact O-CD 3.18Å; V303-T317 HydrophobicContact CG1-CG2 4.18Å; V303-T317 HydrophobicContact CG2-CG2 4.38Å; V303-V318 HydrophobicContact CG1-CG2 4.11Å; V303-A321 HydrophobicContact CG2-CB 3.92Å
304	N	98.7	Very high	98.1	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.215	C	C	.	.			trans	-124.1	92.1	179.6	-166.3	-28.6	0	0	0	110.5	D47 G48 V49 A268 E302 L306 R307	D47-N304 PolarHBondContact O-ND2 2.82Å; G48-N304 VanDerWaalsContact CA-OD1 3.31Å; G48-N304 WeakPolarHBondContact CA-OD1 3.46Å; V49-N304 HydrophobicContact CG1-CB 3.68Å; V49-N304 PolarHBondContact N-ND2 2.89Å; A268-N304 CarbonylContact C-O 3.57Å; A268-N304 WeakPolarHBondContact CB-O 3.44Å; A268-N304 CarbonylContact O-C 3.58Å; A268-N304 PolarHBondContact O-N 2.66Å; E302-N304 PolarHBondContact O-N 3.01Å; N304-L306 PolarHBondContact O-N 3.21Å; N304-L306 WeakPolarHBondContact OD1-CB 3.23Å; N304-L306 PolarHBondContact OD1-N 3.02Å; N304-R307 HydrophobicContact CB-CB 4.24Å; N304-R307 HydrophobicContact CB-CG 3.73Å; N304-R307 VanDerWaalsContact CG-CG 3.47Å; N304-R307 WeakPolarHBondContact O-CB 3.5Å; N304-R307 PolarHBondContact O-N 3.13Å
305	P	97.6	Very high	98.3	Very high	13 Å²	13	48.2 Å²	48.2	8%	0.084	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-54.5	-26.8	178	-25.2	33.4	0	0	0	114.2	C51 K55 V303 R307 V314	C51-P305 HydrophobicContact CB-CG 4.14Å; K55-P305 HydrophobicContact CB-CG 4.28Å; K55-P305 HydrophobicContact CG-CB 4.38Å; K55-P305 HydrophobicContact CG-CG 3.76Å; V303-P305 WeakPolarHBondContact O-CD 3.18Å; P305-R307 PolarHBondContact O-N 2.76Å; P305-V314 HydrophobicContact CB-CG1 3.94Å; P305-V314 WeakPolarHBondContact O-CG2 3.48Å
306	L	97.9	Very high	98.4	Very high	97 Å²	97	49.2 Å²	49.2	51%	0.508	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-78.5	-3.9	178.4	-58.8	-172.2	0	0	0	113.3	G48 N304	G48-L306 VanDerWaalsContact CA-CD1 3.49Å; N304-L306 PolarHBondContact O-N 3.21Å; N304-L306 WeakPolarHBondContact OD1-CB 3.23Å; N304-L306 PolarHBondContact OD1-N 3.02Å
307	R	98	Very high	98.4	Very high	116 Å²	116	48.5 Å²	48.5	44%	0.438	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-101.1	-10.8	177.1	-59.3	-60.7	80.5	166	3.3	113.5	T269 N304 P305	T269-R307 WeakPolarHBondContact O-CB 3.23Å; T269-R307 WeakPolarHBondContact O-CG 3.5Å; N304-R307 HydrophobicContact CB-CB 4.24Å; N304-R307 HydrophobicContact CB-CG 3.73Å; N304-R307 VanDerWaalsContact CG-CG 3.47Å; N304-R307 WeakPolarHBondContact O-CB 3.5Å; N304-R307 PolarHBondContact O-N 3.13Å; P305-R307 PolarHBondContact O-N 2.76Å
308	G	96.9	Very high	98.4	Very high	19 Å²	19	49 Å²	49	20%	0.196	24%	0.24	C	C	.	.			trans	-65.1	134.8	168.5	0	0	0	0	0	110.5	T310	G308-T310 VanDerWaalsContact C-N 3.34Å
309	R	96.9	Very high	98.4	Very high	214 Å²	214	50.1 Å²	50.1	81%	0.808	25%	0.247	S	C	*	.	S	Bend	trans	-81.3	-23.1	178.2	-61.6	171.8	-68.9	-174.5	-3.4	111.7	D313	R309-D313 WeakPolarHBondContact CB-OD2 3.28Å; R309-D313 PolarHBondContact N-OD2 3.35Å; R309-D313 IonicContact NE-OD2 3.42Å; R309-D313 PolarHBondContact NE-OD2 3.2Å
310	T	98.2	Very high	98.4	Very high	70 Å²	70	50.4 Å²	50.4	43%	0.429	25%	0.249	S	C	.	.	S	Bend	trans	-133.4	165.2	178.6	64.4	0	0	0	0	109.5	G308 D312 D313 V314	G308-T310 VanDerWaalsContact C-N 3.34Å; T310-D312 PolarHBondContact O-N 3.02Å; T310-D312 PolarHBondContact OG1-N 2.89Å; T310-D313 WeakPolarHBondContact O-CB 3.34Å; T310-D313 PolarHBondContact O-N 3.2Å; T310-D313 PolarHBondContact OG1-N 3.43Å; T310-V314 PolarHBondContact O-N 3.07Å
311	E	97.8	Very high	98.4	Very high	149 Å²	149	50.2 Å²	50.2	70%	0.696	25%	0.248	S	C	*	.	H	α-helix	trans	-62.7	-30.4	170.3	-70.4	-64.3	151.5	0	0	111.8	V314 H315	E311-V314 PolarHBondContact O-N 3.29Å; E311-H315 VanDerWaalsContact O-CB 3.29Å; E311-H315 WeakPolarHBondContact O-CB 3.23Å; E311-H315 PolarHBondContact O-N 2.86Å
312	D	98.3	Very high	98.4	Very high	126 Å²	126	50.2 Å²	50.2	67%	0.674	25%	0.248	S	C	*	.	H	α-helix	trans	-66.1	-39.8	175.6	-67.7	-22.3	0	0	0	111.8	T310 V314 H315 S316	T310-D312 PolarHBondContact O-N 3.02Å; T310-D312 PolarHBondContact OG1-N 2.89Å; D312-V314 VanDerWaalsContact C-N 3.32Å; D312-V314 PolarHBondContact O-N 3.16Å; D312-H315 PolarHBondContact O-N 3.03Å; D312-S316 VanDerWaalsContact O-CB 3.25Å; D312-S316 WeakPolarHBondContact O-CB 3.34Å; D312-S316 PolarHBondContact O-N 3.4Å
313	D	98.5	Very high	98.4	Very high	27 Å²	27	51.2 Å²	51.2	14%	0.144	25%	0.254	C	S	.	.	H	α-helix	trans	-58.3	-46.5	174.1	-78.6	-3	0	0	0	110.3	P267 R309 T310 T317	P267-D313 HydrophobicContact CB-CB 4.29Å; P267-D313 HydrophobicContact CG-CB 3.55Å; R309-D313 WeakPolarHBondContact CB-OD2 3.28Å; R309-D313 PolarHBondContact N-OD2 3.35Å; R309-D313 IonicContact NE-OD2 3.42Å; R309-D313 PolarHBondContact NE-OD2 3.2Å; T310-D313 WeakPolarHBondContact O-CB 3.34Å; T310-D313 PolarHBondContact O-N 3.2Å; T310-D313 PolarHBondContact OG1-N 3.43Å; D313-T317 PolarHBondContact O-N 3.13Å; D313-T317 VanDerWaalsContact O-N 3.13Å; D313-T317 PolarHBondContact O-OG1 3.23Å
314	V	98.7	Very high	98.4	Very high	14 Å²	14	51.2 Å²	51.2	9%	0.085	25%	0.254	C	S	.	.	H	α-helix	trans	-65.5	-46.2	178	180	0	0	0	0	110.8	A268 P305 T310 E311 D312 S316 T317 V318	A268-V314 HydrophobicContact CB-CG2 4.5Å; P305-V314 HydrophobicContact CB-CG1 3.94Å; P305-V314 WeakPolarHBondContact O-CG2 3.48Å; T310-V314 PolarHBondContact O-N 3.07Å; E311-V314 PolarHBondContact O-N 3.29Å; D312-V314 VanDerWaalsContact C-N 3.32Å; D312-V314 PolarHBondContact O-N 3.16Å; V314-S316 VanDerWaalsContact C-N 3.34Å; V314-S316 PolarHBondContact O-N 2.87Å; V314-T317 PolarHBondContact O-N 2.87Å; V314-V318 HydrophobicContact CG1-CG2 4.16Å; V314-V318 WeakPolarHBondContact O-CB 3.4Å; V314-V318 VanDerWaalsContact O-CG2 3.24Å; V314-V318 WeakPolarHBondContact O-CG2 3.36Å; V314-V318 PolarHBondContact O-N 3.22Å
315	H	98.7	Very high	98.4	Very high	126 Å²	126	51.3 Å²	51.3	58%	0.583	25%	0.254	S	S	*	.	H	α-helix	trans	-61.3	-43.2	179.5	-179.8	71.3	0	0	0	111.7	E311 D312 S319	E311-H315 VanDerWaalsContact O-CB 3.29Å; E311-H315 WeakPolarHBondContact O-CB 3.23Å; E311-H315 PolarHBondContact O-N 2.86Å; D312-H315 PolarHBondContact O-N 3.03Å; H315-S319 PolarHBondContact CE1-OG 3.08Å; H315-S319 VanDerWaalsContact CE1-OG 3.25Å; H315-S319 PolarHBondContact NE2-OG 2.92Å; H315-S319 WeakPolarHBondContact O-CB 3.44Å; H315-S319 PolarHBondContact O-N 2.86Å; H315-S319 PolarHBondContact O-OG 3.37Å
316	S	98.8	Very high	98.4	Very high	41 Å²	41	50.9 Å²	50.9	29%	0.287	25%	0.251	S	S	.	.	H	α-helix	trans	-62.1	-49.5	178.6	-171.9	0	0	0	0	111.3	I265 D312 V314 T320	I265-S316 WeakPolarHBondContact O-CB 3.5Å; I265-S316 PolarHBondContact O-OG 2.93Å; D312-S316 VanDerWaalsContact O-CB 3.25Å; D312-S316 WeakPolarHBondContact O-CB 3.34Å; D312-S316 PolarHBondContact O-N 3.4Å; V314-S316 VanDerWaalsContact C-N 3.34Å; V314-S316 PolarHBondContact O-N 2.87Å; S316-T320 VanDerWaalsContact O-CB 3.3Å; S316-T320 WeakPolarHBondContact O-CB 3.43Å; S316-T320 PolarHBondContact O-N 3.32Å; S316-T320 PolarHBondContact O-OG1 2.87Å
317	T	98.9	Very high	98.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.3	-49.7	177.5	-60.1	0	0	0	0	112	I258 T266 P267 A268 V303 D313 V314 S319 T320 A321	I258-T317 HydrophobicContact CG1-CG2 3.74Å; I258-T317 HydrophobicContact CG2-CG2 4.36Å; T266-T317 VanDerWaalsContact CA-OG1 3.25Å; T266-T317 WeakPolarHBondContact CA-OG1 3.42Å; T266-T317 HydrophobicContact CG2-CG2 4.37Å; P267-T317 WeakPolarHBondContact CD-OG1 3.25Å; A268-T317 HydrophobicContact CB-CG2 4.2Å; A268-T317 WeakPolarHBondContact CB-OG1 3.49Å; A268-T317 PolarHBondContact N-OG1 2.89Å; V303-T317 HydrophobicContact CG1-CG2 4.18Å; V303-T317 HydrophobicContact CG2-CG2 4.38Å; D313-T317 PolarHBondContact O-N 3.13Å; D313-T317 VanDerWaalsContact O-N 3.13Å; D313-T317 PolarHBondContact O-OG1 3.23Å; V314-T317 PolarHBondContact O-N 2.87Å; T317-S319 PolarHBondContact O-N 3.17Å; T317-T320 PolarHBondContact O-N 3.07Å; T317-A321 PolarHBondContact O-N 3.08Å
318	V	98.8	Very high	98.4	Very high	11 Å²	11	41 Å²	41	7%	0.067	21%	0.208	C	C	.	.	H	α-helix	trans	-64	-43	-177.5	170.8	0	0	0	0	111.1	K55 L56 A59 V303 V314 A321 V322	K55-V318 HydrophobicContact CB-CG2 4.35Å; L56-V318 HydrophobicContact CD2-CG1 4.2Å; A59-V318 HydrophobicContact CB-CG1 3.59Å; V303-V318 HydrophobicContact CG1-CG2 4.11Å; V314-V318 HydrophobicContact CG1-CG2 4.16Å; V314-V318 WeakPolarHBondContact O-CB 3.4Å; V314-V318 VanDerWaalsContact O-CG2 3.24Å; V314-V318 WeakPolarHBondContact O-CG2 3.36Å; V314-V318 PolarHBondContact O-N 3.22Å; V318-A321 PolarHBondContact O-N 3.41Å; V318-V322 WeakPolarHBondContact O-CG2 3.47Å; V318-V322 PolarHBondContact O-N 3.17Å
319	S	98.7	Very high	98.4	Very high	23 Å²	23	40.5 Å²	40.5	16%	0.161	20%	0.2	C	C	.	.	H	α-helix	trans	-66.6	-38.8	178.2	-60.8	0	0	0	0	111.6	H315 T317 V322 D323	H315-S319 PolarHBondContact CE1-OG 3.08Å; H315-S319 VanDerWaalsContact CE1-OG 3.25Å; H315-S319 PolarHBondContact NE2-OG 2.92Å; H315-S319 WeakPolarHBondContact O-CB 3.44Å; H315-S319 PolarHBondContact O-N 2.86Å; H315-S319 PolarHBondContact O-OG 3.37Å; T317-S319 PolarHBondContact O-N 3.17Å; S319-V322 PolarHBondContact O-N 2.87Å; S319-D323 WeakPolarHBondContact O-CB 3.33Å; S319-D323 VanDerWaalsContact O-CG 3.27Å; S319-D323 PolarHBondContact O-N 2.93Å
320	T	98.9	Very high	98.1	Very high	6 Å²	6	30.3 Å²	30.3	4%	0.037	16%	0.162	C	C	.	.	H	α-helix	trans	-62.3	-48.3	174.4	-60.5	0	0	0	0	111.1	I258 I265 T266 Y279 S316 T317 V322 D323 L324	I258-T320 HydrophobicContact CD1-CG2 4.37Å; I265-T320 HydrophobicContact CG2-CG2 4.29Å; I265-T320 WeakPolarHBondContact CG2-OG1 3.07Å; T266-T320 HydrophobicContact CG2-CG2 3.73Å; Y279-T320 HydrophobicContact CD2-CG2 3.94Å; Y279-T320 HydrophobicContact CE2-CG2 4.24Å; S316-T320 VanDerWaalsContact O-CB 3.3Å; S316-T320 WeakPolarHBondContact O-CB 3.43Å; S316-T320 PolarHBondContact O-N 3.32Å; S316-T320 PolarHBondContact O-OG1 2.87Å; T317-T320 PolarHBondContact O-N 3.07Å; T320-V322 VanDerWaalsContact C-N 3.31Å; T320-V322 PolarHBondContact O-N 3.31Å; T320-D323 PolarHBondContact O-N 3.35Å; T320-D323 VanDerWaalsContact O-N 3.1Å; T320-L324 HydrophobicContact CG2-CD1 4.11Å; T320-L324 HydrophobicContact CG2-CG 4.36Å; T320-L324 VanDerWaalsContact O-CG 3.28Å; T320-L324 WeakPolarHBondContact O-CG 3.38Å; T320-L324 PolarHBondContact O-N 3.28Å
321	A	98.9	Very high	97.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-58	-41.7	176.4	0	0	0	0	0	112.4	L56 I258 M300 V303 T317 V318 L325	L56-A321 HydrophobicContact CD2-CB 3.64Å; I258-A321 HydrophobicContact CD1-CB 3.91Å; M300-A321 HydrophobicContact CG-CB 4.05Å; M300-A321 HydrophobicContact SD-CB 3.76Å; V303-A321 HydrophobicContact CG2-CB 3.92Å; T317-A321 PolarHBondContact O-N 3.08Å; V318-A321 PolarHBondContact O-N 3.41Å; A321-L325 WeakPolarHBondContact O-CG 3.19Å; A321-L325 PolarHBondContact O-N 2.85Å; A321-L325 VanDerWaalsContact O-N 3.08Å
322	V	98.9	Very high	97.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-62.9	-45.9	173.9	170	0	0	0	0	111	L56 A59 L61 V318 S319 T320 L324 L325 L326	L56-V322 HydrophobicContact CD2-CG2 3.97Å; A59-V322 HydrophobicContact CB-CG2 4Å; L61-V322 HydrophobicContact CB-CG2 4.31Å; L61-V322 HydrophobicContact CD1-CG1 4.28Å; V318-V322 WeakPolarHBondContact O-CG2 3.47Å; V318-V322 PolarHBondContact O-N 3.17Å; S319-V322 PolarHBondContact O-N 2.87Å; T320-V322 VanDerWaalsContact C-N 3.31Å; T320-V322 PolarHBondContact O-N 3.31Å; V322-L324 VanDerWaalsContact C-N 3.35Å; V322-L324 PolarHBondContact O-N 3.07Å; V322-L325 PolarHBondContact O-N 3.48Å; V322-L326 HydrophobicContact CG1-CD1 3.8Å; V322-L326 HydrophobicContact CG1-CG 4.2Å; V322-L326 VanDerWaalsContact O-CG 3.22Å; V322-L326 WeakPolarHBondContact O-CG 3.43Å; V322-L326 PolarHBondContact O-N 3.45Å
323	D	98.7	Very high	97.5	Very high	23 Å²	23	28.6 Å²	28.6	12%	0.123	13%	0.132	C	C	.	.	H	α-helix	trans	-62.5	-41	-179.2	-74.8	-9.1	0	0	0	112.5	Y279 S319 T320 L326 G327 R331	Y279-D323 HydrophobicContact CE2-CB 4.3Å; Y279-D323 PolarHBondContact OH-OD2 3.32Å; S319-D323 WeakPolarHBondContact O-CB 3.33Å; S319-D323 VanDerWaalsContact O-CG 3.27Å; S319-D323 PolarHBondContact O-N 2.93Å; T320-D323 PolarHBondContact O-N 3.35Å; T320-D323 VanDerWaalsContact O-N 3.1Å; D323-L326 PolarHBondContact O-N 2.58Å; D323-G327 PolarHBondContact O-N 3.35Å; D323-R331 VanDerWaalsContact CG-NH1 3.34Å; D323-R331 IonicContact OD1-CZ 3.55Å; D323-R331 IonicContact OD1-NH1 3.89Å; D323-R331 PolarHBondContact OD1-NH1 3.41Å; D323-R331 IonicContact OD1-NH2 3.29Å; D323-R331 IonicContact OD2-NH1 2.71Å
324	L	98.8	Very high	97.3	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-60	-48.2	173.7	-66.6	172.1	0	0	0	111.1	Y256 I258 I261 G282 V283 T286 M300 T320 V322 L326 G327 C328	Y256-L324 HydrophobicContact CD1-CD1 4.18Å; Y256-L324 HydrophobicContact CE1-CD1 3.59Å; Y256-L324 HydrophobicContact CE2-CD1 4.26Å; Y256-L324 HydrophobicContact CE2-CD2 4.28Å; I258-L324 HydrophobicContact CD1-CD1 3.96Å; I261-L324 HydrophobicContact CG1-CD1 4.47Å; G282-L324 WeakPolarHBondContact O-CD2 3.43Å; V283-L324 HydrophobicContact CG2-CD2 4.28Å; T286-L324 HydrophobicContact CG2-CB 4.19Å; T286-L324 HydrophobicContact CG2-CD2 4.09Å; T286-L324 WeakPolarHBondContact CG2-O 3.39Å; M300-L324 HydrophobicContact CE-CB 3.92Å; M300-L324 HydrophobicContact CE-CD1 4.03Å; T320-L324 HydrophobicContact CG2-CD1 4.11Å; T320-L324 HydrophobicContact CG2-CG 4.36Å; T320-L324 VanDerWaalsContact O-CG 3.28Å; T320-L324 WeakPolarHBondContact O-CG 3.38Å; T320-L324 PolarHBondContact O-N 3.28Å; V322-L324 VanDerWaalsContact C-N 3.35Å; V322-L324 PolarHBondContact O-N 3.07Å; L324-L326 VanDerWaalsContact C-N 3.34Å; L324-L326 PolarHBondContact O-N 3.25Å; L324-G327 PolarHBondContact O-N 3.32Å; L324-G327 VanDerWaalsContact O-N 3.14Å; L324-C328 PolarHBondContact O-N 3.38Å; L324-C328 VanDerWaalsContact O-N 3.09Å; L324-C328 PolarHBondContact O-SG 3.41Å
325	L	98.8	Very high	96.8	Very high	1 Å²	1	36 Å²	36	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-59.9	-42.4	175.6	-73.4	170.5	0	0	0	111.8	L61 V120 L122 V298 M300 A321 V322 G327 C328 F329	L61-L325 HydrophobicContact CD1-CB 3.88Å; L61-L325 HydrophobicContact CD1-CD1 3.96Å; L61-L325 HydrophobicContact CD2-CD1 3.7Å; V120-L325 HydrophobicContact CG1-CD2 3.83Å; L122-L325 HydrophobicContact CD2-CD1 3.73Å; V298-L325 HydrophobicContact CG1-CD2 3.9Å; M300-L325 HydrophobicContact CB-CD1 4.19Å; M300-L325 HydrophobicContact CB-CD2 4.09Å; M300-L325 HydrophobicContact CB-CG 4.31Å; M300-L325 HydrophobicContact CE-CG 4.26Å; M300-L325 HydrophobicContact CG-CD1 4.18Å; M300-L325 HydrophobicContact CG-CG 4.42Å; A321-L325 WeakPolarHBondContact O-CG 3.19Å; A321-L325 PolarHBondContact O-N 2.85Å; A321-L325 VanDerWaalsContact O-N 3.08Å; V322-L325 PolarHBondContact O-N 3.48Å; L325-G327 VanDerWaalsContact C-N 3.29Å; L325-G327 PolarHBondContact O-N 2.91Å; L325-C328 VanDerWaalsContact O-CB 3.32Å; L325-C328 WeakPolarHBondContact O-CB 3.5Å; L325-C328 PolarHBondContact O-N 3.03Å; L325-F329 WeakPolarHBondContact O-CD2 3.47Å; L325-F329 PolarHBondContact O-N 3.12Å
326	L	98.4	Very high	96.3	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.021	17%	0.172	C	C	.	.	H	α-helix	trans	-65.2	-33.5	177	-64.2	169.7	0	0	0	112.3	R64 L65 Q68 V322 D323 L324 F329 G330 R331	R64-L326 HydrophobicContact CB-CD1 3.99Å; R64-L326 HydrophobicContact CB-CD2 3.57Å; R64-L326 HydrophobicContact CB-CG 4.43Å; R64-L326 HydrophobicContact CG-CD1 4.5Å; L65-L326 HydrophobicContact CD2-CD2 3.95Å; L65-L326 HydrophobicContact CG-CD2 3.97Å; Q68-L326 PolarHBondContact NE2-O 2.78Å; V322-L326 HydrophobicContact CG1-CD1 3.8Å; V322-L326 HydrophobicContact CG1-CG 4.2Å; V322-L326 VanDerWaalsContact O-CG 3.22Å; V322-L326 WeakPolarHBondContact O-CG 3.43Å; V322-L326 PolarHBondContact O-N 3.45Å; D323-L326 PolarHBondContact O-N 2.58Å; L324-L326 VanDerWaalsContact C-N 3.34Å; L324-L326 PolarHBondContact O-N 3.25Å; L326-F329 CarbonylContact O-C 3.57Å; L326-F329 PolarHBondContact O-N 2.86Å; L326-G330 PolarHBondContact O-N 3.25Å; L326-R331 HydrophobicContact CB-CB 4Å; L326-R331 VanDerWaalsContact O-CB 3.28Å; L326-R331 WeakPolarHBondContact O-CB 3.21Å; L326-R331 PolarHBondContact O-N 3.36Å
327	G	97.6	Very high	95.6	Very high	2 Å²	2	39.9 Å²	39.9	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-61.2	-43.3	172.7	0	0	0	0	0	112.2	D323 L324 L325 F329 G330	D323-G327 PolarHBondContact O-N 3.35Å; L324-G327 PolarHBondContact O-N 3.32Å; L324-G327 VanDerWaalsContact O-N 3.14Å; L325-G327 VanDerWaalsContact C-N 3.29Å; L325-G327 PolarHBondContact O-N 2.91Å; G327-F329 PolarHBondContact O-N 2.59Å; G327-F329 VanDerWaalsContact O-N 3.07Å; G327-G330 PolarHBondContact O-N 2.91Å
328	C	97.9	Very high	94.7	Very high	3 Å²	3	44.9 Å²	44.9	2%	0.02	22%	0.218	C	C	.	.	H	α-helix	trans	-57.5	-23.6	174.4	-70	0	0	0	0	113.5	T286 Y290 L295 V298 L324 L325	T286-C328 VanDerWaalsContact CG2-SG 3.6Å; Y290-C328 WeakPolarHBondContact CD2-O 3.39Å; L295-C328 HydrophobicContact CD2-CB 3.55Å; V298-C328 HydrophobicContact CG2-CB 4.25Å; L324-C328 PolarHBondContact O-N 3.38Å; L324-C328 VanDerWaalsContact O-N 3.09Å; L324-C328 PolarHBondContact O-SG 3.41Å; L325-C328 VanDerWaalsContact O-CB 3.32Å; L325-C328 WeakPolarHBondContact O-CB 3.5Å; L325-C328 PolarHBondContact O-N 3.03Å
329	F	96.4	Very high	93.6	Very high	9 Å²	9	50.7 Å²	50.7	4%	0.039	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112	18.9	-179.8	-62.8	-72.3	0	0	0	113.8	R31 V33 L65 T118 V120 L325 L326 G327	R31-F329 PolarHBondContact NH1-O 3Å; V33-F329 HydrophobicContact CB-CE1 4.41Å; V33-F329 HydrophobicContact CG1-CE1 4.17Å; V33-F329 HydrophobicContact CG1-CE2 4.19Å; V33-F329 HydrophobicContact CG1-CZ 3.86Å; V33-F329 HydrophobicContact CG2-CD1 3.52Å; V33-F329 HydrophobicContact CG2-CE1 3.46Å; V33-F329 VanDerWaalsContact CG2-CE1 3.46Å; V33-F329 HydrophobicContact CG2-CE2 4.48Å; V33-F329 HydrophobicContact CG2-CG 4.08Å; V33-F329 HydrophobicContact CG2-CZ 3.99Å; L65-F329 HydrophobicContact CD2-CB 3.81Å; L65-F329 HydrophobicContact CD2-CD2 3.49Å; L65-F329 VanDerWaalsContact CD2-CD2 3.49Å; L65-F329 HydrophobicContact CD2-CE2 4.4Å; L65-F329 HydrophobicContact CD2-CG 3.84Å; T118-F329 HydrophobicContact CG2-CE1 3.64Å; T118-F329 HydrophobicContact CG2-CZ 3.77Å; V120-F329 HydrophobicContact CG2-CE2 3.48Å; V120-F329 VanDerWaalsContact CG2-CE2 3.48Å; V120-F329 HydrophobicContact CG2-CZ 3.34Å; L325-F329 WeakPolarHBondContact O-CD2 3.47Å; L325-F329 PolarHBondContact O-N 3.12Å; L326-F329 CarbonylContact O-C 3.57Å; L326-F329 PolarHBondContact O-N 2.86Å; G327-F329 PolarHBondContact O-N 2.59Å; G327-F329 VanDerWaalsContact O-N 3.07Å
330	G	92.3	Very high	92.8	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	98.4	15.1	164.8	0	0	0	0	0	115.7	Y290 L326 G327 R332 N336	Y290-G330 VanDerWaalsContact CZ-CA 3.4Å; L326-G330 PolarHBondContact O-N 3.25Å; G327-G330 PolarHBondContact O-N 2.91Å; G330-R332 PolarHBondContact O-N 2.99Å; G330-N336 PolarHBondContact O-ND2 2.59Å; G330-N336 PolarHBondContact O-OD1 3.38Å
331	R	93.6	Very high	92.2	Very high	95 Å²	95	62.5 Å²	62.5	36%	0.358	31%	0.307	S	S	.	.			trans	-61.8	128.4	163.5	-171.1	172.8	170.8	-172.4	-8.9	107.2	Q68 D323 L326	Q68-R331 VanDerWaalsContact NE2-CA 3.27Å; D323-R331 VanDerWaalsContact CG-NH1 3.34Å; D323-R331 IonicContact OD1-CZ 3.55Å; D323-R331 IonicContact OD1-NH1 3.89Å; D323-R331 PolarHBondContact OD1-NH1 3.41Å; D323-R331 IonicContact OD1-NH2 3.29Å; D323-R331 IonicContact OD2-NH1 2.71Å; L326-R331 HydrophobicContact CB-CB 4Å; L326-R331 VanDerWaalsContact O-CB 3.28Å; L326-R331 WeakPolarHBondContact O-CB 3.21Å; L326-R331 PolarHBondContact O-N 3.36Å
332	R	91.8	Very high	91.8	Very high	92 Å²	92	67 Å²	67	35%	0.347	34%	0.338	S	S	.	.			trans	-116.5	144.1	171.9	-60	-173.9	177.8	-174.3	-0.6	110.3	G330 E334 G335 N336	G330-R332 PolarHBondContact O-N 2.99Å; R332-E334 HydrophobicContact CB-CG 3.94Å; R332-E334 VanDerWaalsContact CD-OE1 3.3Å; R332-E334 WeakPolarHBondContact CD-OE1 3.5Å; R332-E334 IonicContact CZ-OE1 3.59Å; R332-E334 IonicContact NH1-OE1 3.67Å; R332-E334 PolarHBondContact NH1-OE1 2.9Å; R332-E334 PolarHBondContact O-N 2.83Å; R332-G335 PolarHBondContact O-N 3.17Å; R332-G335 VanDerWaalsContact O-N 3.08Å; R332-N336 PolarHBondContact N-OD1 2.95Å
333	R	94.7	Very high	91.5	Very high	123 Å²	123	73.4 Å²	73.4	46%	0.464	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-27.3	173.1	-71.2	172.1	-70.6	-174.1	-0.8	113.4	R280 V283 E287 G335	R280-R333 PolarHBondContact O-NH1 2.97Å; R280-R333 VanDerWaalsContact O-NH1 3.08Å; V283-R333 HydrophobicContact CG1-CG 4.14Å; E287-R333 WeakPolarHBondContact OE1-CG 3.34Å; E287-R333 PolarHBondContact OE1-N 2.77Å; E287-R333 IonicContact OE1-NE 3.76Å; E287-R333 PolarHBondContact OE1-NE 2.81Å; E287-R333 IonicContact OE2-CZ 3.69Å; E287-R333 VanDerWaalsContact OE2-CZ 3.3Å; E287-R333 IonicContact OE2-NE 2.72Å; E287-R333 PolarHBondContact OE2-NE 3.12Å; E287-R333 VanDerWaalsContact OE2-NE 3.15Å; E287-R333 IonicContact OE2-NH2 2.98Å; E287-R333 PolarHBondContact OE2-NH2 2.95Å; R333-G335 PolarHBondContact O-N 3.02Å
334	E	94.3	Very high	91.1	Very high	155 Å²	155	77.5 Å²	77.5	72%	0.724	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-7.5	174.4	72.9	-171.5	-179.9	0	0	113.6	R332	R332-E334 HydrophobicContact CB-CG 3.94Å; R332-E334 VanDerWaalsContact CD-OE1 3.3Å; R332-E334 WeakPolarHBondContact CD-OE1 3.5Å; R332-E334 IonicContact CZ-OE1 3.59Å; R332-E334 IonicContact NH1-OE1 3.67Å; R332-E334 PolarHBondContact NH1-OE1 2.9Å; R332-E334 PolarHBondContact O-N 2.83Å
335	G	90.1	Very high	90.6	Very high	41 Å²	41	85.6 Å²	85.6	42%	0.423	44%	0.438	S	S	.	.			trans	95.8	168.1	-173.8	0	0	0	0	0	113.2	R332 R333	R332-G335 PolarHBondContact O-N 3.17Å; R332-G335 VanDerWaalsContact O-N 3.08Å; R333-G335 PolarHBondContact O-N 3.02Å
336	N	87.6	Confident	89.9	Confident	96 Å²	96	94.7 Å²	94.7	51%	0.513	50%	0.497	S	S	.	.			trans	-134.6	145	177.7	-67.2	87.8	0	0	0	108.7	G330 R332	G330-N336 PolarHBondContact O-ND2 2.59Å; G330-N336 PolarHBondContact O-OD1 3.38Å; R332-N336 PolarHBondContact N-OD1 2.95Å
337	H	83.6	Confident	89.5	Confident	153 Å²	153	99.3 Å²	99.3	71%	0.708	52%	0.521	S	S	*	.			trans	-130.3	155.5	165.9	55.6	-86.8	0	0	0	108.8
338	L	79.6	Confident	89.1	Confident	104 Å²	104	104.4 Å²	104.4	55%	0.545	55%	0.547	S	S	.	.			trans	-68.7	144.7	172.7	-64.2	175.6	0	0	0	109.6	D340 Y341	L338-D340 WeakPolarHBondContact CB-OD1 3.48Å; L338-D340 PolarHBondContact O-N 2.86Å; L338-D340 VanDerWaalsContact O-N 3.1Å; L338-Y341 WeakPolarHBondContact O-CB 3.17Å; L338-Y341 PolarHBondContact O-N 3.39Å
339	P	76.6	Confident	88.6	Confident	133 Å²	133	110 Å²	110	86%	0.864	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.1	-24.4	-179.8	-25.6	34.8	0	0	0	114.4
340	D	82.2	Confident	88.1	Confident	128 Å²	128	115.9 Å²	115.9	68%	0.684	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	9.7	178.6	64	-22.6	0	0	0	113.3	L338 S342	L338-D340 WeakPolarHBondContact CB-OD1 3.48Å; L338-D340 PolarHBondContact O-N 2.86Å; L338-D340 VanDerWaalsContact O-N 3.1Å; D340-S342 PolarHBondContact O-N 3.21Å; D340-S342 VanDerWaalsContact O-N 3.09Å
341	Y	85.4	Confident	87.9	Confident	150 Å²	150	123.2 Å²	123.2	59%	0.588	65%	0.646	S	S	*	*			trans	-63.6	114.1	178.9	-175.4	-92.2	0	0	0	110.9	L338 L343	L338-Y341 WeakPolarHBondContact O-CB 3.17Å; L338-Y341 PolarHBondContact O-N 3.39Å; Y341-L343 HydrophobicContact CE1-CD2 4.18Å
342	S	90.9	Very high	87.5	Confident	93 Å²	93	125.1 Å²	125.1	65%	0.65	67%	0.665	S	S	*	*			trans	-104.7	141.9	169.9	58.2	0	0	0	0	110.3	D340	D340-S342 PolarHBondContact O-N 3.21Å; D340-S342 VanDerWaalsContact O-N 3.09Å
343	L	92.6	Very high	87.2	Confident	135 Å²	135	127.4 Å²	127.4	71%	0.707	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-61.8	134.7	168.2	-69.5	171.7	0	0	0	109.1	Y341 E345	Y341-L343 HydrophobicContact CE1-CD2 4.18Å; L343-E345 PolarHBondContact O-N 3.42Å
344	P	90.4	Very high	86.6	Confident	110 Å²	110	127.8 Å²	127.8	71%	0.714	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-58.7	137.2	172.3	-22.7	33.2	0	0	0	110.8
345	E	89.1	Confident	86	Confident	171 Å²	171	125.5 Å²	125.5	80%	0.799	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-77.8	150	171.1	-66.9	-64.3	158.9	0	0	110.4	L343	L343-E345 PolarHBondContact O-N 3.42Å
346	P	83.6	Confident	85.6	Confident	192 Å²	192	133.2 Å²	133.2	100%	1.247	73%	0.729	S	S	*	*			trans	-57.3	0	-178.7	-25.5	34.9	0	0	0	116.3

Retrieved 346 of 346 residues in 602.6 ms (Link to these results)

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