A0A087YR94_POEFO Loading...

Fucosyltransferase

AlphaFold DB , UniProt , Accession A0A087YR94, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 371 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.9	Very low	47	Very low	243 Å²	243	135.6 Å²	135.6	100%	1.197	81%	0.809	S	S	*	*				0	130.3	0	-86.2	170.2	165	0	0	107.9
2	L	44	Very low	48.1	Very low	169 Å²	169	131.8 Å²	131.8	89%	0.885	79%	0.787	S	S	*	*			trans	-50.2	149.1	-168.7	-76.3	115	0	0	0	115
3	P	48.1	Very low	49.2	Very low	123 Å²	123	132.5 Å²	132.5	80%	0.799	77%	0.774	S	S	*	*			trans	-109.5	133.9	138.8	11.4	8.3	0	0	0	110.8
4	T	42	Very low	50.3	Low	129 Å²	129	131.6 Å²	131.6	79%	0.791	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-61.2	135	178.6	37.9	0	0	0	0	112.8
5	G	39.6	Very low	51.3	Low	82 Å²	82	133.2 Å²	133.2	85%	0.845	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-72.5	128.2	170.1	0	0	0	0	0	111.3
6	Q	43.6	Very low	52.7	Low	190 Å²	190	130.8 Å²	130.8	89%	0.888	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-101.7	122.3	160.7	-80.1	-175.2	-14.7	0	0	109.1
7	S	47.1	Very low	54	Low	117 Å²	117	127.7 Å²	127.7	82%	0.818	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-68.8	127	177	45.5	0	0	0	0	111.1
8	K	53.8	Low	55.1	Low	200 Å²	200	131.1 Å²	131.1	87%	0.87	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-68.4	131.3	168.4	-77.7	-179.6	176.5	176.6	0	109.3	S10	K8-S10 PolarHBondContact O-N 3.24Å
9	P	49.8	Very low	56.3	Low	109 Å²	109	130.8 Å²	130.8	71%	0.708	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-69.7	134.9	174.8	26.2	-29.9	0	0	0	110.8
10	S	53.8	Low	57.5	Low	74 Å²	74	128.9 Å²	128.9	52%	0.517	70%	0.702	S	S	.	*	P	Polyproline II helix	trans	-51	131.7	-178.8	134.4	0	0	0	0	112.9	K8 T12 F13	K8-S10 PolarHBondContact O-N 3.24Å; S10-T12 PolarHBondContact O-N 3.39Å; S10-T12 PolarHBondContact OG-N 2.96Å; S10-T12 PolarHBondContact OG-OG1 3.39Å; S10-F13 PolarHBondContact O-N 3.39Å; S10-F13 VanDerWaalsContact O-N 3.09Å
11	G	55.7	Low	58.6	Low	56 Å²	56	127.8 Å²	127.8	58%	0.577	70%	0.695	S	S	*	*	H	α-helix	trans	-61.2	-7.3	-179.8	0	0	0	0	0	115.3
12	T	59.9	Low	60.7	Low	90 Å²	90	121.4 Å²	121.4	55%	0.552	67%	0.665	S	S	*	*	H	α-helix	trans	-77.6	-34.9	175	-41.3	0	0	0	0	111.5	S10 K15 I16	S10-T12 PolarHBondContact O-N 3.39Å; S10-T12 PolarHBondContact OG-N 2.96Å; S10-T12 PolarHBondContact OG-OG1 3.39Å; T12-K15 PolarHBondContact O-N 3.36Å; T12-I16 HydrophobicContact CG2-CD1 4.24Å; T12-I16 WeakPolarHBondContact O-CG1 3.25Å; T12-I16 PolarHBondContact O-N 3.2Å
13	F	62.9	Low	62.4	Low	140 Å²	140	116.2 Å²	116.2	61%	0.614	64%	0.643	S	S	*	*	H	α-helix	trans	-67.8	-39	-179.6	-164.7	-97.7	0	0	0	112	S10 K15 I16 L17	S10-F13 PolarHBondContact O-N 3.39Å; S10-F13 VanDerWaalsContact O-N 3.09Å; F13-K15 PolarHBondContact O-N 2.8Å; F13-I16 PolarHBondContact O-N 3.11Å; F13-L17 WeakPolarHBondContact O-CB 3.4Å; F13-L17 PolarHBondContact O-N 2.67Å
14	H	63.8	Low	64.3	Low	121 Å²	121	115.6 Å²	115.6	56%	0.56	63%	0.632	S	S	*	*	H	α-helix	trans	-66.4	-33.6	176.6	-100.6	52.5	0	0	0	113.5	R18	H14-R18 WeakPolarHBondContact O-CB 3.41Å; H14-R18 PolarHBondContact O-N 3.12Å; H14-R18 VanDerWaalsContact O-N 3.07Å
15	K	66.1	Low	66.4	Low	155 Å²	155	116.4 Å²	116.4	67%	0.674	63%	0.625	S	S	*	*	H	α-helix	trans	-71.3	-41.7	176.3	-75.9	-177.5	178.2	-179.6	0	111.8	T12 F13 R18 L19	T12-K15 PolarHBondContact O-N 3.36Å; F13-K15 PolarHBondContact O-N 2.8Å; K15-R18 PolarHBondContact O-N 3.49Å; K15-L19 WeakPolarHBondContact O-CG 3.49Å; K15-L19 PolarHBondContact O-N 3.4Å; K15-L19 VanDerWaalsContact O-N 3.08Å
16	I	73.3	Confident	68.6	Low	94 Å²	94	116.8 Å²	116.8	48%	0.482	61%	0.607	S	S	.	*	H	α-helix	trans	-65.8	-43.2	176.9	-65.6	168.5	0	0	0	110.4	T12 F13 R18 L19 L20	T12-I16 HydrophobicContact CG2-CD1 4.24Å; T12-I16 WeakPolarHBondContact O-CG1 3.25Å; T12-I16 PolarHBondContact O-N 3.2Å; F13-I16 PolarHBondContact O-N 3.11Å; I16-R18 PolarHBondContact O-N 3.13Å; I16-L19 PolarHBondContact O-N 3.23Å; I16-L20 HydrophobicContact CG2-CD1 4.02Å; I16-L20 PolarHBondContact O-N 3.03Å
17	L	74.4	Confident	70.6	Confident	79 Å²	79	113.3 Å²	113.3	41%	0.414	59%	0.594	S	S	.	*	H	α-helix	trans	-62.9	-40.1	177	-172.4	64.9	0	0	0	112.1	F13 L20 L21	F13-L17 WeakPolarHBondContact O-CB 3.4Å; F13-L17 PolarHBondContact O-N 2.67Å; L17-L20 PolarHBondContact O-N 3.34Å; L17-L21 HydrophobicContact CG-CD1 4.15Å; L17-L21 WeakPolarHBondContact O-CB 3.49Å; L17-L21 VanDerWaalsContact O-CG 3.28Å; L17-L21 WeakPolarHBondContact O-CG 3.39Å; L17-L21 PolarHBondContact O-N 3.39Å
18	R	74.4	Confident	72.4	Confident	189 Å²	189	109.5 Å²	109.5	71%	0.713	57%	0.573	S	S	*	*	H	α-helix	trans	-63.8	-41	174.6	-87.4	-174	174	-173	-0.8	112.9	H14 K15 I16 L21 L22	H14-R18 WeakPolarHBondContact O-CB 3.41Å; H14-R18 PolarHBondContact O-N 3.12Å; H14-R18 VanDerWaalsContact O-N 3.07Å; K15-R18 PolarHBondContact O-N 3.49Å; I16-R18 PolarHBondContact O-N 3.13Å; R18-L21 PolarHBondContact O-N 3.2Å; R18-L22 PolarHBondContact O-N 2.83Å
19	L	78.1	Confident	73.9	Confident	125 Å²	125	102.8 Å²	102.8	65%	0.654	55%	0.55	S	S	*	*	H	α-helix	trans	-66.4	-39.1	177.7	-75.6	163.4	0	0	0	111.8	K15 I16 L22 S23	K15-L19 WeakPolarHBondContact O-CG 3.49Å; K15-L19 PolarHBondContact O-N 3.4Å; K15-L19 VanDerWaalsContact O-N 3.08Å; I16-L19 PolarHBondContact O-N 3.23Å; L19-L22 PolarHBondContact O-N 2.86Å; L19-S23 PolarHBondContact O-N 2.73Å; L19-S23 PolarHBondContact O-OG 3.05Å
20	L	79.1	Confident	75.4	Confident	93 Å²	93	104.8 Å²	104.8	49%	0.487	55%	0.548	S	S	.	.	H	α-helix	trans	-65.1	-42.4	174	-85.2	160.4	0	0	0	112.6	I16 L17 L22 S23 I24	I16-L20 HydrophobicContact CG2-CD1 4.02Å; I16-L20 PolarHBondContact O-N 3.03Å; L17-L20 PolarHBondContact O-N 3.34Å; L20-L22 VanDerWaalsContact C-N 3.33Å; L20-L22 PolarHBondContact O-N 3.45Å; L20-S23 WeakPolarHBondContact CA-OG 3.43Å; L20-S23 PolarHBondContact O-N 3Å; L20-S23 PolarHBondContact O-OG 3.38Å; L20-I24 WeakPolarHBondContact O-CD1 3.47Å; L20-I24 VanDerWaalsContact O-CG1 3.23Å; L20-I24 WeakPolarHBondContact O-CG1 3.33Å; L20-I24 PolarHBondContact O-N 3.42Å
21	L	81	Confident	76.6	Confident	105 Å²	105	104.8 Å²	104.8	55%	0.55	55%	0.545	S	S	.	.	H	α-helix	trans	-66.5	-37.2	177.4	-71.5	168.8	0	0	0	111.7	L17 R18 F25	L17-L21 HydrophobicContact CG-CD1 4.15Å; L17-L21 WeakPolarHBondContact O-CB 3.49Å; L17-L21 VanDerWaalsContact O-CG 3.28Å; L17-L21 WeakPolarHBondContact O-CG 3.39Å; L17-L21 PolarHBondContact O-N 3.39Å; R18-L21 PolarHBondContact O-N 3.2Å; L21-F25 WeakPolarHBondContact O-CB 3.44Å; L21-F25 PolarHBondContact O-N 2.98Å
22	L	83.2	Confident	77.5	Confident	109 Å²	109	105.8 Å²	105.8	57%	0.571	54%	0.54	S	S	*	.	H	α-helix	trans	-66.6	-41.7	176.2	-127.4	99.8	0	0	0	112	R18 L19 L20 F25 I26	R18-L22 PolarHBondContact O-N 2.83Å; L19-L22 PolarHBondContact O-N 2.86Å; L20-L22 VanDerWaalsContact C-N 3.33Å; L20-L22 PolarHBondContact O-N 3.45Å; L22-F25 PolarHBondContact O-N 3.39Å; L22-I26 HydrophobicContact CD2-CD1 4.38Å; L22-I26 VanDerWaalsContact O-CG1 3.28Å; L22-I26 WeakPolarHBondContact O-CG1 3.49Å; L22-I26 PolarHBondContact O-N 3.12Å
23	S	81.8	Confident	78.1	Confident	61 Å²	61	104.1 Å²	104.1	43%	0.427	54%	0.535	S	S	.	.	H	α-helix	trans	-68.8	-38.2	179.6	58.3	0	0	0	0	112.3	L19 L20 F25 I26 L27	L19-S23 PolarHBondContact O-N 2.73Å; L19-S23 PolarHBondContact O-OG 3.05Å; L20-S23 WeakPolarHBondContact CA-OG 3.43Å; L20-S23 PolarHBondContact O-N 3Å; L20-S23 PolarHBondContact O-OG 3.38Å; S23-F25 VanDerWaalsContact C-N 3.34Å; S23-I26 PolarHBondContact O-N 3.31Å; S23-L27 WeakPolarHBondContact O-CB 3.49Å; S23-L27 PolarHBondContact O-N 3.46Å
24	I	85.9	Confident	78.6	Confident	109 Å²	109	103.3 Å²	103.3	56%	0.559	53%	0.532	S	S	*	.	H	α-helix	trans	-62.3	-42.6	172.6	-68.1	165.6	0	0	0	110.7	L20 L27 G28	L20-I24 WeakPolarHBondContact O-CD1 3.47Å; L20-I24 VanDerWaalsContact O-CG1 3.23Å; L20-I24 WeakPolarHBondContact O-CG1 3.33Å; L20-I24 PolarHBondContact O-N 3.42Å; I24-L27 PolarHBondContact O-N 3.4Å; I24-G28 PolarHBondContact O-N 3.32Å
25	F	86.6	Confident	78.9	Confident	146 Å²	146	102.9 Å²	102.9	64%	0.64	53%	0.533	S	S	*	.	H	α-helix	trans	-63.5	-46	178.2	-174.1	-98.4	0	0	0	111.8	L21 L22 S23 L27 G28 C29	L21-F25 WeakPolarHBondContact O-CB 3.44Å; L21-F25 PolarHBondContact O-N 2.98Å; L22-F25 PolarHBondContact O-N 3.39Å; S23-F25 VanDerWaalsContact C-N 3.34Å; F25-L27 PolarHBondContact O-N 3.15Å; F25-G28 PolarHBondContact O-N 3.21Å; F25-C29 PolarHBondContact O-N 2.71Å; F25-C29 PolarHBondContact O-SG 2.97Å; F25-C29 VanDerWaalsContact O-SG 3.38Å
26	I	85.4	Confident	79	Confident	90 Å²	90	102.2 Å²	102.2	46%	0.462	54%	0.535	S	S	.	.	H	α-helix	trans	-62.2	-42.7	177.6	-67.8	166.3	0	0	0	111.1	L22 S23 C29 F30	L22-I26 HydrophobicContact CD2-CD1 4.38Å; L22-I26 VanDerWaalsContact O-CG1 3.28Å; L22-I26 WeakPolarHBondContact O-CG1 3.49Å; L22-I26 PolarHBondContact O-N 3.12Å; S23-I26 PolarHBondContact O-N 3.31Å; I26-C29 PolarHBondContact O-N 3.49Å; I26-F30 HydrophobicContact CG2-CD2 4.22Å; I26-F30 PolarHBondContact O-N 3.19Å
27	L	86.2	Confident	78.2	Confident	118 Å²	118	107.6 Å²	107.6	62%	0.618	55%	0.551	S	S	*	*	H	α-helix	trans	-64.2	-40.9	176.7	-171	66.5	0	0	0	111.5	S23 I24 F25 F30 V31	S23-L27 WeakPolarHBondContact O-CB 3.49Å; S23-L27 PolarHBondContact O-N 3.46Å; I24-L27 PolarHBondContact O-N 3.4Å; F25-L27 PolarHBondContact O-N 3.15Å; L27-F30 PolarHBondContact O-N 2.93Å; L27-V31 WeakPolarHBondContact O-CG2 3.29Å; L27-V31 PolarHBondContact O-N 2.99Å
28	G	84.9	Confident	77	Confident	37 Å²	37	109.3 Å²	109.3	38%	0.381	56%	0.557	S	S	.	*	H	α-helix	trans	-61.2	-42.5	174.8	0	0	0	0	0	113	I24 F25 V31 T32	I24-G28 PolarHBondContact O-N 3.32Å; F25-G28 PolarHBondContact O-N 3.21Å; G28-V31 PolarHBondContact O-N 3.4Å; G28-T32 PolarHBondContact O-N 3.14Å; G28-T32 PolarHBondContact O-OG1 3.43Å
29	C	85	Confident	75.4	Confident	59 Å²	59	109.4 Å²	109.4	40%	0.399	56%	0.562	S	S	.	*	H	α-helix	trans	-63.8	-39.2	174.1	-69.6	0	0	0	0	112.3	F25 I26 T32 A33	F25-C29 PolarHBondContact O-N 2.71Å; F25-C29 PolarHBondContact O-SG 2.97Å; F25-C29 VanDerWaalsContact O-SG 3.38Å; I26-C29 PolarHBondContact O-N 3.49Å; C29-T32 WeakPolarHBondContact CA-OG1 3.39Å; C29-T32 PolarHBondContact O-OG1 3.41Å; C29-T32 VanDerWaalsContact O-OG1 3.07Å; C29-A33 VanDerWaalsContact O-CB 3.28Å; C29-A33 WeakPolarHBondContact O-CB 3.31Å; C29-A33 PolarHBondContact O-N 3.14Å
30	F	82.5	Confident	73.3	Confident	150 Å²	150	107.8 Å²	107.8	66%	0.658	56%	0.561	S	S	*	*	H	α-helix	trans	-67.2	-43.1	176.1	-105	-82.9	0	0	0	112.5	I26 L27 A33 F34	I26-F30 HydrophobicContact CG2-CD2 4.22Å; I26-F30 PolarHBondContact O-N 3.19Å; L27-F30 PolarHBondContact O-N 2.93Å; F30-A33 PolarHBondContact O-N 3.26Å; F30-F34 VanDerWaalsContact O-CB 3.23Å; F30-F34 WeakPolarHBondContact O-CB 3.5Å; F30-F34 PolarHBondContact O-N 3.06Å
31	V	78.6	Confident	71.3	Confident	74 Å²	74	108.3 Å²	108.3	45%	0.448	57%	0.573	S	S	.	*	H	α-helix	trans	-65.6	-41.7	177.9	172.2	0	0	0	0	111	L27 G28 F34 L35	L27-V31 WeakPolarHBondContact O-CG2 3.29Å; L27-V31 PolarHBondContact O-N 2.99Å; G28-V31 PolarHBondContact O-N 3.4Å; V31-F34 PolarHBondContact O-N 3.4Å; V31-L35 HydrophobicContact CG1-CD1 3.96Å; V31-L35 HydrophobicContact CG1-CG 4.36Å; V31-L35 WeakPolarHBondContact O-CB 3.35Å; V31-L35 VanDerWaalsContact O-CG 3.26Å; V31-L35 WeakPolarHBondContact O-CG 3.34Å; V31-L35 PolarHBondContact O-N 2.94Å
32	T	75.1	Confident	69	Low	77 Å²	77	109 Å²	109	47%	0.472	58%	0.582	S	S	.	*	H	α-helix	trans	-66.5	-43.4	176	39.1	0	0	0	0	112.1	G28 C29 F34 L35 I36	G28-T32 PolarHBondContact O-N 3.14Å; G28-T32 PolarHBondContact O-OG1 3.43Å; C29-T32 WeakPolarHBondContact CA-OG1 3.39Å; C29-T32 PolarHBondContact O-OG1 3.41Å; C29-T32 VanDerWaalsContact O-OG1 3.07Å; T32-F34 VanDerWaalsContact C-N 3.31Å; T32-F34 PolarHBondContact O-N 3.39Å; T32-L35 PolarHBondContact O-N 3.34Å; T32-I36 WeakPolarHBondContact O-CB 3.44Å; T32-I36 WeakPolarHBondContact O-CD1 3.14Å; T32-I36 WeakPolarHBondContact O-CG1 3.38Å; T32-I36 PolarHBondContact O-N 3.22Å
33	A	71.9	Confident	66.5	Low	55 Å²	55	110.7 Å²	110.7	46%	0.455	59%	0.591	S	S	.	*	H	α-helix	trans	-61.3	-40.1	173.2	0	0	0	0	0	111.9	C29 F30 I36 Y37	C29-A33 VanDerWaalsContact O-CB 3.28Å; C29-A33 WeakPolarHBondContact O-CB 3.31Å; C29-A33 PolarHBondContact O-N 3.14Å; F30-A33 PolarHBondContact O-N 3.26Å; A33-I36 PolarHBondContact O-N 3.23Å; A33-Y37 WeakPolarHBondContact O-CB 3.46Å; A33-Y37 PolarHBondContact O-N 3.46Å
34	F	73.9	Confident	63.9	Low	124 Å²	124	119 Å²	119	54%	0.544	61%	0.613	S	S	.	*	H	α-helix	trans	-63.5	-43.8	174.4	-177.6	-95.9	0	0	0	111.8	F30 V31 T32 I36 Y37 H38	F30-F34 VanDerWaalsContact O-CB 3.23Å; F30-F34 WeakPolarHBondContact O-CB 3.5Å; F30-F34 PolarHBondContact O-N 3.06Å; V31-F34 PolarHBondContact O-N 3.4Å; T32-F34 VanDerWaalsContact C-N 3.31Å; T32-F34 PolarHBondContact O-N 3.39Å; F34-I36 PolarHBondContact O-N 3.19Å; F34-Y37 PolarHBondContact O-N 2.99Å; F34-H38 AromaticContact CD2-CD2 3.92Å; F34-H38 HydrophobicContact CE1-CB 4.3Å; F34-H38 HydrophobicContact CE2-CB 4.32Å; F34-H38 AromaticContact CE2-CD2 3.52Å; F34-H38 HydrophobicContact CZ-CB 4.17Å; F34-H38 WeakPolarHBondContact O-CA 3.36Å; F34-H38 VanDerWaalsContact O-CB 3.27Å; F34-H38 WeakPolarHBondContact O-CB 3.32Å; F34-H38 PolarHBondContact O-N 3.27Å
35	L	69.1	Low	61.2	Low	111 Å²	111	121.7 Å²	121.7	58%	0.581	63%	0.628	S	S	*	*	H	α-helix	trans	-69.5	-32.1	177.5	-69.6	172.7	0	0	0	113.1	V31 T32	V31-L35 HydrophobicContact CG1-CD1 3.96Å; V31-L35 HydrophobicContact CG1-CG 4.36Å; V31-L35 WeakPolarHBondContact O-CB 3.35Å; V31-L35 VanDerWaalsContact O-CG 3.26Å; V31-L35 WeakPolarHBondContact O-CG 3.34Å; V31-L35 PolarHBondContact O-N 2.94Å; T32-L35 PolarHBondContact O-N 3.34Å
36	I	69.6	Low	58.6	Low	142 Å²	142	122.3 Å²	122.3	73%	0.728	64%	0.638	S	S	*	*	H	α-helix	trans	-71.7	-39.7	174.7	-68.5	165.2	0	0	0	110.6	T32 A33 F34	T32-I36 WeakPolarHBondContact O-CB 3.44Å; T32-I36 WeakPolarHBondContact O-CD1 3.14Å; T32-I36 WeakPolarHBondContact O-CG1 3.38Å; T32-I36 PolarHBondContact O-N 3.22Å; A33-I36 PolarHBondContact O-N 3.23Å; F34-I36 PolarHBondContact O-N 3.19Å
37	Y	55.2	Low	56	Low	206 Å²	206	125.4 Å²	125.4	81%	0.808	66%	0.656	S	S	*	*	H	α-helix	trans	-85.7	-36.7	-175.4	-164.1	-98.4	0	0	0	113.2	A33 F34	A33-Y37 WeakPolarHBondContact O-CB 3.46Å; A33-Y37 PolarHBondContact O-N 3.46Å; F34-Y37 PolarHBondContact O-N 2.99Å
38	H	49.8	Very low	53.6	Low	115 Å²	115	124.9 Å²	124.9	53%	0.532	66%	0.659	S	S	.	*			trans	-101.7	60.7	171.8	-87.9	-82.6	0	0	0	110.6	F34 S40	F34-H38 AromaticContact CD2-CD2 3.92Å; F34-H38 HydrophobicContact CE1-CB 4.3Å; F34-H38 HydrophobicContact CE2-CB 4.32Å; F34-H38 AromaticContact CE2-CD2 3.52Å; F34-H38 HydrophobicContact CZ-CB 4.17Å; F34-H38 WeakPolarHBondContact O-CA 3.36Å; F34-H38 VanDerWaalsContact O-CB 3.27Å; F34-H38 WeakPolarHBondContact O-CB 3.32Å; F34-H38 PolarHBondContact O-N 3.27Å; H38-S40 PolarHBondContact O-N 3.42Å
39	K	39.9	Very low	51.3	Low	191 Å²	191	131.2 Å²	131.2	83%	0.83	68%	0.684	S	S	*	*			trans	-62.5	88.8	162.7	-170.6	175.1	-177.7	176.5	0	108.7	S41	K39-S41 PolarHBondContact O-N 2.86Å
40	S	34.6	Very low	49	Very low	91 Å²	91	136.9 Å²	136.9	64%	0.636	70%	0.701	S	S	*	*			trans	-62.5	129.1	171.3	-173.4	0	0	0	0	108.7	H38 T42	H38-S40 PolarHBondContact O-N 3.42Å; S40-T42 PolarHBondContact O-N 2.98Å
41	S	36.9	Very low	47.4	Very low	104 Å²	104	134.7 Å²	134.7	73%	0.727	70%	0.704	S	S	*	*			trans	-67	89.9	174.6	164.2	0	0	0	0	109.9	K39	K39-S41 PolarHBondContact O-N 2.86Å
42	T	32.6	Very low	45.8	Very low	121 Å²	121	135.5 Å²	135.5	74%	0.742	71%	0.713	S	S	*	*			trans	-98	79.3	164.9	50.7	0	0	0	0	109.9	S40	S40-T42 PolarHBondContact O-N 2.98Å
43	N	30.4	Very low	44.4	Very low	144 Å²	144	139 Å²	139	77%	0.77	72%	0.724	S	S	*	*			trans	-95.7	75.9	162.8	-85.3	-12.3	0	0	0	109.6
44	W	27.3	Very low	43.1	Very low	235 Å²	235	141.2 Å²	141.2	89%	0.89	73%	0.728	S	S	*	*			trans	-147.5	111.2	162	-85.6	73.8	0	0	0	104.7
45	L	30.2	Very low	41.5	Very low	166 Å²	166	137.8 Å²	137.8	87%	0.869	72%	0.722	S	S	*	*				-150.5	127.3	75.7	-79.9	153.2	0	0	0	111.4
46	N	31.9	Very low	40.2	Very low	159 Å²	159	139.4 Å²	139.4	85%	0.85	73%	0.725	S	S	*	*			trans	-80.5	151.6	160.8	-80.9	-28.4	0	0	0	110.1
47	D	29.6	Very low	39	Very low	155 Å²	155	139.9 Å²	139.9	83%	0.829	72%	0.718	S	S	*	*			trans	-40.8	142.9	158.6	-116.4	-37.1	0	0	0	113.3	L49	D47-L49 PolarHBondContact O-N 3.16Å
48	P	35.9	Very low	38.4	Very low	107 Å²	107	133.6 Å²	133.6	70%	0.695	70%	0.698	S	S	*	*			trans	-93.2	100	-177.4	33.7	-27.3	0	0	0	111.7
49	L	36.7	Very low	38.1	Very low	170 Å²	170	134.7 Å²	134.7	89%	0.89	70%	0.703	S	S	*	*			trans	-161.9	129.9	156.5	-107.2	129.3	0	0	0	111.5	D47	D47-L49 PolarHBondContact O-N 3.16Å
50	K	37.9	Very low	38.3	Very low	178 Å²	178	130.6 Å²	130.6	77%	0.774	69%	0.69	S	S	*	*			trans	99.6	55.6	179.1	-58.2	178.8	177.6	179.9	0	117.2
51	S	49.2	Very low	38.8	Very low	103 Å²	103	129.3 Å²	129.3	72%	0.72	68%	0.678	S	S	*	*	H	α-helix	trans	-82.1	-23.4	172.7	-174.2	0	0	0	0	114.6	A55	S51-A55 PolarHBondContact O-N 3.33Å
52	S	43.4	Very low	39.1	Very low	91 Å²	91	130.5 Å²	130.5	64%	0.636	67%	0.671	S	S	*	*	H	α-helix	trans	-79.8	-35.2	-172.3	58.2	0	0	0	0	115.1
53	H	46	Very low	39.3	Very low	151 Å²	151	128.9 Å²	128.9	70%	0.699	67%	0.665	S	S	*	*	H	α-helix	trans	-79.8	-32.6	179.8	-80.3	-78.6	0	0	0	113.2	Y57	H53-Y57 WeakPolarHBondContact O-CB 3.32Å; H53-Y57 PolarHBondContact O-N 3.31Å
54	L	44.1	Very low	39.9	Very low	102 Å²	102	125.4 Å²	125.4	53%	0.534	66%	0.655	S	S	.	*	H	α-helix	trans	-71.7	-38.3	179.4	-171.8	66.2	0	0	0	111.3	Y57 I58	L54-Y57 PolarHBondContact O-N 2.71Å; L54-I58 HydrophobicContact CD1-CD1 4.33Å; L54-I58 HydrophobicContact CD1-CG1 4.49Å; L54-I58 HydrophobicContact CD2-CD1 4.4Å; L54-I58 HydrophobicContact CG-CD1 3.82Å; L54-I58 HydrophobicContact CG-CG1 4.38Å; L54-I58 VanDerWaalsContact O-CB 3.26Å; L54-I58 WeakPolarHBondContact O-CB 3.4Å; L54-I58 WeakPolarHBondContact O-CD1 3.25Å; L54-I58 WeakPolarHBondContact O-CG1 3.48Å; L54-I58 PolarHBondContact O-N 3.19Å
55	A	41.8	Very low	40.5	Very low	51 Å²	51	121.8 Å²	121.8	42%	0.421	65%	0.646	S	S	.	*	H	α-helix	trans	-63.2	-41.5	175.1	0	0	0	0	0	111.9	S51 I58 Q59	S51-A55 PolarHBondContact O-N 3.33Å; A55-I58 PolarHBondContact O-N 3.18Å; A55-Q59 WeakPolarHBondContact O-CB 3.36Å; A55-Q59 PolarHBondContact O-N 3.15Å
56	K	42	Very low	40.9	Very low	146 Å²	146	119 Å²	119	64%	0.635	64%	0.641	S	S	*	*	H	α-helix	trans	-67.8	-42.3	176.7	-154.4	173.8	-174.9	179.8	0	112	Q59 D60	K56-Q59 PolarHBondContact O-N 2.96Å; K56-D60 PolarHBondContact O-N 2.69Å
57	Y	43.1	Very low	41.2	Very low	152 Å²	152	119.8 Å²	119.8	60%	0.596	64%	0.636	S	S	*	*	H	α-helix	trans	-61.8	-42.3	172.8	-179.5	-101.6	0	0	0	112.4	H53 L54 Q59 D60 V61	H53-Y57 WeakPolarHBondContact O-CB 3.32Å; H53-Y57 PolarHBondContact O-N 3.31Å; L54-Y57 PolarHBondContact O-N 2.71Å; Y57-Q59 VanDerWaalsContact C-N 3.32Å; Y57-Q59 PolarHBondContact O-N 3.24Å; Y57-D60 PolarHBondContact O-N 3.12Å; Y57-V61 HydrophobicContact CD1-CG2 4.12Å; Y57-V61 HydrophobicContact CE1-CG2 3.83Å; Y57-V61 HydrophobicContact CE2-CG2 4.25Å; Y57-V61 HydrophobicContact CG-CG2 4.47Å; Y57-V61 WeakPolarHBondContact O-CB 3.22Å; Y57-V61 WeakPolarHBondContact O-CG2 3.32Å; Y57-V61 PolarHBondContact O-N 3.02Å
58	I	43.8	Very low	41.6	Very low	74 Å²	74	119.4 Å²	119.4	38%	0.379	63%	0.634	S	S	.	*	H	α-helix	trans	-63.8	-40.3	176.6	-74.5	170.7	0	0	0	110.4	L54 A55 V61 F62	L54-I58 HydrophobicContact CD1-CD1 4.33Å; L54-I58 HydrophobicContact CD1-CG1 4.49Å; L54-I58 HydrophobicContact CD2-CD1 4.4Å; L54-I58 HydrophobicContact CG-CD1 3.82Å; L54-I58 HydrophobicContact CG-CG1 4.38Å; L54-I58 VanDerWaalsContact O-CB 3.26Å; L54-I58 WeakPolarHBondContact O-CB 3.4Å; L54-I58 WeakPolarHBondContact O-CD1 3.25Å; L54-I58 WeakPolarHBondContact O-CG1 3.48Å; L54-I58 PolarHBondContact O-N 3.19Å; A55-I58 PolarHBondContact O-N 3.18Å; I58-V61 PolarHBondContact O-N 3.18Å; I58-F62 HydrophobicContact CG2-CD2 3.51Å; I58-F62 HydrophobicContact CG2-CE2 3.56Å; I58-F62 WeakPolarHBondContact O-CB 3.35Å; I58-F62 WeakPolarHBondContact O-CD2 3.45Å; I58-F62 PolarHBondContact O-N 3.21Å
59	Q	42.8	Very low	42.1	Very low	137 Å²	137	120.6 Å²	120.6	64%	0.64	63%	0.634	S	S	*	*	H	α-helix	trans	-71.8	-33.4	179.4	-157.1	147.2	2	0	0	113	A55 K56 Y57 S63	A55-Q59 WeakPolarHBondContact O-CB 3.36Å; A55-Q59 PolarHBondContact O-N 3.15Å; K56-Q59 PolarHBondContact O-N 2.96Å; Y57-Q59 VanDerWaalsContact C-N 3.32Å; Y57-Q59 PolarHBondContact O-N 3.24Å; Q59-S63 WeakPolarHBondContact O-CB 3.31Å; Q59-S63 PolarHBondContact O-N 3.29Å; Q59-S63 PolarHBondContact O-OG 2.86Å
60	D	43.7	Very low	42.6	Very low	105 Å²	105	119.5 Å²	119.5	56%	0.561	63%	0.628	S	S	*	*	H	α-helix	trans	-69.3	-38.3	170.1	-71.3	-22	0	0	0	111.5	K56 Y57 S63 A64	K56-D60 PolarHBondContact O-N 2.69Å; Y57-D60 PolarHBondContact O-N 3.12Å; D60-S63 PolarHBondContact O-N 3.27Å; D60-A64 WeakPolarHBondContact O-CB 3.48Å; D60-A64 PolarHBondContact O-N 3.4Å
61	V	46	Very low	43.5	Very low	64 Å²	64	113 Å²	113	39%	0.388	60%	0.601	S	S	.	*	H	α-helix	trans	-68.1	-36.9	175.2	168	0	0	0	0	112.1	Y57 I58 A64	Y57-V61 HydrophobicContact CD1-CG2 4.12Å; Y57-V61 HydrophobicContact CE1-CG2 3.83Å; Y57-V61 HydrophobicContact CE2-CG2 4.25Å; Y57-V61 HydrophobicContact CG-CG2 4.47Å; Y57-V61 WeakPolarHBondContact O-CB 3.22Å; Y57-V61 WeakPolarHBondContact O-CG2 3.32Å; Y57-V61 PolarHBondContact O-N 3.02Å; I58-V61 PolarHBondContact O-N 3.18Å; V61-A64 PolarHBondContact O-N 2.87Å
62	F	42.5	Very low	44	Very low	130 Å²	130	112.5 Å²	112.5	57%	0.57	59%	0.59	S	S	*	*	H	α-helix	trans	-77.1	-30.5	175.9	-82	-70.5	0	0	0	112.7	I58 A64 K65	I58-F62 HydrophobicContact CG2-CD2 3.51Å; I58-F62 HydrophobicContact CG2-CE2 3.56Å; I58-F62 WeakPolarHBondContact O-CB 3.35Å; I58-F62 WeakPolarHBondContact O-CD2 3.45Å; I58-F62 PolarHBondContact O-N 3.21Å; F62-A64 VanDerWaalsContact C-N 3.32Å; F62-K65 HydrophobicContact CD1-CD 4.08Å; F62-K65 HydrophobicContact CE1-CD 4.26Å; F62-K65 WeakPolarHBondContact O-CB 3.14Å; F62-K65 PolarHBondContact O-N 3.46Å
63	S	37.5	Very low	44.9	Very low	87 Å²	87	117.9 Å²	117.9	61%	0.608	60%	0.602	S	S	*	*	H	α-helix	trans	-71.9	-26.2	170.4	-63.9	0	0	0	0	112.7	Q59 D60 K65	Q59-S63 WeakPolarHBondContact O-CB 3.31Å; Q59-S63 PolarHBondContact O-N 3.29Å; Q59-S63 PolarHBondContact O-OG 2.86Å; D60-S63 PolarHBondContact O-N 3.27Å; S63-K65 PolarHBondContact O-N 3.14Å
64	A	42.1	Very low	46.4	Very low	70 Å²	70	117.1 Å²	117.1	58%	0.579	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-74.1	-9.2	170.8	0	0	0	0	0	113.7	D60 V61 F62 S66	D60-A64 WeakPolarHBondContact O-CB 3.48Å; D60-A64 PolarHBondContact O-N 3.4Å; V61-A64 PolarHBondContact O-N 2.87Å; F62-A64 VanDerWaalsContact C-N 3.32Å; A64-S66 PolarHBondContact O-N 3.47Å
65	K	40.9	Very low	48.7	Very low	159 Å²	159	115 Å²	115	69%	0.691	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-89.6	9.3	-171.8	-128.7	177.5	-174.7	179.5	0	115.2	F62 S63	F62-K65 HydrophobicContact CD1-CD 4.08Å; F62-K65 HydrophobicContact CE1-CD 4.26Å; F62-K65 WeakPolarHBondContact O-CB 3.14Å; F62-K65 PolarHBondContact O-N 3.46Å; S63-K65 PolarHBondContact O-N 3.14Å
66	S	37.8	Very low	51.3	Low	108 Å²	108	112.8 Å²	112.8	76%	0.755	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-114	3.7	172.9	70.1	0	0	0	0	114.7	A64	A64-S66 PolarHBondContact O-N 3.47Å
67	K	37.8	Very low	54	Low	175 Å²	175	106.6 Å²	106.6	76%	0.761	55%	0.546	S	S	*	.	S	Bend	trans	-84.7	112.9	159.8	-76.6	-179.1	178.6	177.6	0	106.5	L69	K67-L69 PolarHBondContact O-N 3.44Å; K67-L69 VanDerWaalsContact O-N 3.16Å
68	D	39.4	Very low	56.6	Low	147 Å²	147	99.3 Å²	99.3	79%	0.786	52%	0.518	S	S	*	.			trans	-34.9	127.6	148.8	-76.7	-48.8	0	0	0	107.2	I70	D68-I70 PolarHBondContact O-N 3.35Å
69	L	46.6	Very low	59.2	Low	132 Å²	132	95.8 Å²	95.8	69%	0.691	50%	0.5	S	S	*	.			trans	-57.4	94	169.7	-119.1	110.2	0	0	0	105	K67 I71 F104	K67-L69 PolarHBondContact O-N 3.44Å; K67-L69 VanDerWaalsContact O-N 3.16Å; L69-I71 HydrophobicContact CD2-CG1 4.36Å; L69-I71 PolarHBondContact O-N 3.36Å; L69-F104 HydrophobicContact CD2-CD2 4.27Å; L69-F104 HydrophobicContact CD2-CE2 3.65Å; L69-F104 HydrophobicContact CD2-CZ 4.26Å
70	I	47.1	Very low	61.9	Low	147 Å²	147	89.3 Å²	89.3	75%	0.754	47%	0.469	S	S	*	.			trans	-66.4	86	162.8	-58	174.7	0	0	0	101.5	D68 D72	D68-I70 PolarHBondContact O-N 3.35Å; I70-D72 PolarHBondContact O-N 3.08Å
71	I	55.8	Low	64.5	Low	43 Å²	43	85.8 Å²	85.8	22%	0.221	45%	0.448	C	S	.	.			trans	-55.1	107.5	161.9	-65.5	171.9	0	0	0	102.5	L69 K73 M75 I77 F104 F111	L69-I71 HydrophobicContact CD2-CG1 4.36Å; L69-I71 PolarHBondContact O-N 3.36Å; I71-K73 PolarHBondContact O-N 2.92Å; I71-M75 HydrophobicContact CG2-CB 4.07Å; I71-M75 HydrophobicContact CG2-CG 4.48Å; I71-M75 HydrophobicContact CG2-SD 4.47Å; I71-I77 HydrophobicContact CD1-CD1 4.23Å; I71-I77 HydrophobicContact CG2-CD1 4.09Å; I71-I77 HydrophobicContact CG2-CG1 4.3Å; I71-F104 HydrophobicContact CD1-CD1 3.99Å; I71-F104 HydrophobicContact CD1-CE1 3.81Å; I71-F104 HydrophobicContact CD1-CZ 4.31Å; I71-F104 HydrophobicContact CG1-CD1 4.5Å; I71-F111 HydrophobicContact CD1-CD1 4.27Å; I71-F111 HydrophobicContact CD1-CE1 3.33Å; I71-F111 HydrophobicContact CD1-CZ 3.96Å
72	D	60.2	Low	66.9	Low	92 Å²	92	83.6 Å²	83.6	49%	0.492	43%	0.434	S	S	.	.			trans	-51	133.2	176	-177.5	-3.3	0	0	0	106.3	I70 N74 M75	I70-D72 PolarHBondContact O-N 3.08Å; D72-N74 PolarHBondContact O-N 2.83Å; D72-M75 HydrophobicContact CB-CG 4.06Å; D72-M75 PolarHBondContact O-N 2.75Å
73	K	61.2	Low	69.6	Low	204 Å²	204	80 Å²	80	89%	0.887	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-14.3	-173	-150.8	178	-177.5	-178	0	111.9	I71	I71-K73 PolarHBondContact O-N 2.92Å
74	N	78.5	Confident	72.4	Confident	135 Å²	135	75.8 Å²	75.8	72%	0.722	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-2.6	179.3	-68.3	-15	0	0	0	115.5	D72	D72-N74 PolarHBondContact O-N 2.83Å
75	M	92.8	Very high	75	Confident	58 Å²	58	77.1 Å²	77.1	29%	0.286	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-75.1	136.6	176.9	-60.9	-166.8	97.7	0	0	111.5	I71 D72 C103 F104	I71-M75 HydrophobicContact CG2-CB 4.07Å; I71-M75 HydrophobicContact CG2-CG 4.48Å; I71-M75 HydrophobicContact CG2-SD 4.47Å; D72-M75 HydrophobicContact CB-CG 4.06Å; D72-M75 PolarHBondContact O-N 2.75Å; M75-C103 WeakPolarHBondContact CE-O 3.44Å; M75-F104 HydrophobicContact CB-CB 4.34Å; M75-F104 HydrophobicContact CE-CB 4.4Å; M75-F104 HydrophobicContact SD-CB 4.17Å
76	T	96.5	Very high	77.6	Confident	4 Å²	4	79.7 Å²	79.7	3%	0.025	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	120.9	167.9	-64.3	0	0	0	0	109.1	V78 G102 F104 D116 L353 K354	T76-V78 HydrophobicContact CG2-CG2 4.46Å; T76-G102 PolarHBondContact N-O 3.37Å; T76-F104 PolarHBondContact O-N 3.14Å; T76-D116 WeakPolarHBondContact CA-OD2 3.38Å; T76-D116 HydrophobicContact CG2-CB 3.93Å; T76-L353 HydrophobicContact CG2-CB 3.79Å; T76-K354 WeakPolarHBondContact OG1-CB 3.22Å
77	I	97.4	Very high	80.4	Confident	15 Å²	15	81.8 Å²	81.8	8%	0.077	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	120.9	-177	-58.2	176.2	0	0	0	109.4	I71 F104 F111 K114 S115 D116 G117	I71-I77 HydrophobicContact CD1-CD1 4.23Å; I71-I77 HydrophobicContact CG2-CD1 4.09Å; I71-I77 HydrophobicContact CG2-CG1 4.3Å; I77-F104 WeakPolarHBondContact CA-O 3.45Å; I77-F104 HydrophobicContact CB-CD1 4.46Å; I77-F104 HydrophobicContact CG1-CB 4.37Å; I77-F104 HydrophobicContact CG1-CD1 4.08Å; I77-F104 HydrophobicContact CG2-CD1 3.96Å; I77-F111 HydrophobicContact CD1-CD1 4.49Å; I77-F111 HydrophobicContact CG2-CD1 4.36Å; I77-K114 HydrophobicContact CD1-CB 4.39Å; I77-S115 CarbonylContact O-C 3.51Å; I77-D116 PolarHBondContact N-OD2 3.46Å; I77-D116 PolarHBondContact O-N 3.35Å; I77-G117 PolarHBondContact O-N 3.28Å; I77-G117 VanDerWaalsContact O-N 3.15Å
78	V	98.3	Very high	83.2	Confident	0 Å²	0	77 Å²	77	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	119.4	174.4	-177.2	0	0	0	0	110	T76 F104 I105 T106 G117 V119 C350 L353	T76-V78 HydrophobicContact CG2-CG2 4.46Å; V78-F104 PolarHBondContact N-O 3.32Å; V78-I105 HydrophobicContact CB-CD1 3.63Å; V78-I105 HydrophobicContact CG1-CD1 4.35Å; V78-I105 HydrophobicContact CG2-CD1 3.94Å; V78-I105 WeakPolarHBondContact O-CA 3.37Å; V78-T106 PolarHBondContact O-N 3.32Å; V78-G117 WeakPolarHBondContact CA-O 3.49Å; V78-V119 HydrophobicContact CG1-CG2 3.58Å; V78-C350 HydrophobicContact CG2-CB 3.61Å; V78-L353 HydrophobicContact CG2-CD1 3.82Å
79	L	98.5	Very high	85.9	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	117.3	174.3	178.7	61.7	0	0	0	110.3	W81 T106 D108 Y112 G117 V118 V119	L79-W81 HydrophobicContact CD2-CE3 3.73Å; L79-W81 HydrophobicContact CD2-CZ3 4.15Å; L79-W81 HydrophobicContact CG-CE3 4.46Å; L79-W81 PolarHBondContact O-N 3.22Å; L79-T106 CarbonylContact C-O 3.56Å; L79-T106 WeakPolarHBondContact CA-O 3.5Å; L79-T106 HydrophobicContact CD1-CG2 4.18Å; L79-D108 WeakPolarHBondContact CD1-O 3.45Å; L79-Y112 HydrophobicContact CD2-CD2 4.14Å; L79-G117 PolarHBondContact N-O 3Å; L79-V118 HydrophobicContact CB-CG2 4.37Å; L79-V118 CarbonylContact O-C 3.55Å; L79-V118 WeakPolarHBondContact O-CA 3.49Å; L79-V119 PolarHBondContact O-N 2.9Å
80	V	98.5	Very high	88.1	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	100.3	169	-175	0	0	0	0	108.2	W83 Y89 I105 T106 T346	V80-W83 HydrophobicContact CB-CE3 4.43Å; V80-W83 HydrophobicContact CB-CZ3 4.33Å; V80-W83 HydrophobicContact CG1-CD2 3.89Å; V80-W83 HydrophobicContact CG1-CE3 3.63Å; V80-W83 HydrophobicContact CG1-CG 4.49Å; V80-W83 HydrophobicContact CG1-CZ3 3.97Å; V80-W83 HydrophobicContact CG2-CZ3 4.45Å; V80-Y89 WeakPolarHBondContact CG2-OH 3.3Å; V80-I105 HydrophobicContact CG2-CG2 3.78Å; V80-T106 PolarHBondContact N-O 2.99Å; V80-T346 HydrophobicContact CG2-CG2 4.17Å
81	W	98.4	Very high	90.3	Very high	32 Å²	32	67.3 Å²	67.3	12%	0.121	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-42.3	-175.7	-173.1	-88.8	0	0	0	112.8	L79 R109 Y112 V118 V119 I120 N131 P133	L79-W81 HydrophobicContact CD2-CE3 3.73Å; L79-W81 HydrophobicContact CD2-CZ3 4.15Å; L79-W81 HydrophobicContact CG-CE3 4.46Å; L79-W81 PolarHBondContact O-N 3.22Å; W81-R109 PolarHBondContact O-NH1 3.05Å; W81-R109 PolarHBondContact O-NH2 3.26Å; W81-Y112 HydrophobicContact CE3-CD2 4.11Å; W81-Y112 AromaticContact CZ3-CD2 3.89Å; W81-Y112 HydrophobicContact CZ3-CD2 3.89Å; W81-Y112 HydrophobicContact CZ3-CG 4.23Å; W81-V118 HydrophobicContact CB-CG1 3.49Å; W81-V118 VanDerWaalsContact CB-CG1 3.49Å; W81-V118 HydrophobicContact CD2-CG1 4.47Å; W81-V118 HydrophobicContact CE3-CG1 4.39Å; W81-V118 HydrophobicContact CG-CG1 4.13Å; W81-V119 PolarHBondContact N-O 3.47Å; W81-I120 HydrophobicContact CB-CG1 3.82Å; W81-I120 HydrophobicContact CG-CG1 4.24Å; W81-N131 PolarHBondContact NE1-O 3.47Å; W81-P133 HydrophobicContact CD2-CB 4.36Å; W81-P133 HydrophobicContact CD2-CG 3.49Å; W81-P133 VanDerWaalsContact CD2-CG 3.49Å; W81-P133 VanDerWaalsContact CE2-CD 3.48Å; W81-P133 HydrophobicContact CE3-CB 4.33Å; W81-P133 HydrophobicContact CE3-CG 3.73Å; W81-P133 HydrophobicContact CG-CG 4.08Å; W81-P133 HydrophobicContact CH2-CB 3.86Å; W81-P133 HydrophobicContact CH2-CG 4.06Å; W81-P133 HydrophobicContact CZ2-CB 3.89Å; W81-P133 HydrophobicContact CZ2-CG 3.85Å; W81-P133 HydrophobicContact CZ3-CB 4.08Å; W81-P133 HydrophobicContact CZ3-CG 4Å
82	L	98.3	Very high	91.9	Very high	17 Å²	17	71.5 Å²	71.5	9%	0.089	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	117.1	170.7	-62.1	178.1	0	0	0	108.9	V119 I120 H121 D124 I125 L132	L82-V119 PolarHBondContact N-O 2.87Å; L82-I120 HydrophobicContact CB-CG2 4.43Å; L82-I120 HydrophobicContact CD1-CG2 3.65Å; L82-I120 HydrophobicContact CG-CG2 4.08Å; L82-H121 HydrophobicContact CB-CB 4.45Å; L82-H121 WeakPolarHBondContact O-CB 3.41Å; L82-H121 PolarHBondContact O-N 3.01Å; L82-D124 HydrophobicContact CB-CB 4.04Å; L82-D124 HydrophobicContact CD1-CB 4.17Å; L82-D124 WeakPolarHBondContact CD1-O 3.29Å; L82-I125 HydrophobicContact CD1-CB 4.37Å; L82-I125 HydrophobicContact CD1-CG1 3.77Å; L82-L132 HydrophobicContact CD1-CD2 4.36Å
83	W	97.8	Very high	93.5	Very high	54 Å²	54	67.7 Å²	67.7	21%	0.205	32%	0.323	C	S	.	.			trans	-65.5	136.1	173.3	-66.5	110.1	0	0	0	110.6	V80 F85 R86 A88 Y89 T91 A107 D124	V80-W83 HydrophobicContact CB-CE3 4.43Å; V80-W83 HydrophobicContact CB-CZ3 4.33Å; V80-W83 HydrophobicContact CG1-CD2 3.89Å; V80-W83 HydrophobicContact CG1-CE3 3.63Å; V80-W83 HydrophobicContact CG1-CG 4.49Å; V80-W83 HydrophobicContact CG1-CZ3 3.97Å; V80-W83 HydrophobicContact CG2-CZ3 4.45Å; W83-F85 PolarHBondContact O-N 2.99Å; W83-F85 VanDerWaalsContact O-N 3.13Å; W83-R86 PolarHBondContact O-N 3.2Å; W83-A88 HydrophobicContact CD2-CB 4.26Å; W83-A88 HydrophobicContact CE3-CB 4.49Å; W83-A88 HydrophobicContact CH2-CB 4.3Å; W83-A88 HydrophobicContact CZ2-CB 4.02Å; W83-Y89 AromaticContact CE3-CD1 3.58Å; W83-Y89 HydrophobicContact CE3-CD1 3.58Å; W83-Y89 AromaticContact CE3-CE1 3.32Å; W83-Y89 HydrophobicContact CE3-CE1 3.32Å; W83-Y89 HydrophobicContact CE3-CE2 4.49Å; W83-Y89 HydrophobicContact CE3-CG 4.31Å; W83-Y89 AromaticContact CE3-CZ 3.82Å; W83-Y89 AromaticContact CZ3-CD1 3.5Å; W83-Y89 HydrophobicContact CZ3-CD1 3.5Å; W83-Y89 VanDerWaalsContact CZ3-CD1 3.5Å; W83-Y89 AromaticContact CZ3-CD2 3.85Å; W83-Y89 HydrophobicContact CZ3-CD2 3.85Å; W83-Y89 AromaticContact CZ3-CE1 3.35Å; W83-Y89 HydrophobicContact CZ3-CE1 3.35Å; W83-Y89 AromaticContact CZ3-CE2 3.69Å; W83-Y89 HydrophobicContact CZ3-CE2 3.69Å; W83-Y89 AromaticContact CZ3-CG 3.76Å; W83-Y89 HydrophobicContact CZ3-CG 3.76Å; W83-Y89 AromaticContact CZ3-CZ 3.44Å; W83-Y89 VanDerWaalsContact CZ3-CZ 3.44Å; W83-T91 HydrophobicContact CH2-CG2 3.7Å; W83-T91 HydrophobicContact CZ3-CG2 4.38Å; W83-A107 HydrophobicContact CH2-CB 4Å; W83-A107 HydrophobicContact CZ2-CB 3.14Å; W83-D124 VanDerWaalsContact O-CG 3.31Å; W83-D124 VanDerWaalsContact O-OD2 3.06Å
84	P	96.8	Very high	95.2	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-55.5	118.1	173.2	-26.1	36.9	0	0	0	112	R86 K87 Y89 H121 M146 W342	P84-R86 PolarHBondContact O-N 2.93Å; P84-R86 VanDerWaalsContact O-N 3.16Å; P84-K87 PolarHBondContact O-N 3.05Å; P84-K87 VanDerWaalsContact O-N 3.08Å; P84-Y89 HydrophobicContact CG-CE1 4.34Å; P84-H121 WeakPolarHBondContact CA-ND1 3.27Å; P84-H121 HydrophobicContact CG-CB 4.29Å; P84-M146 HydrophobicContact CG-CE 3.49Å; P84-M146 VanDerWaalsContact CG-CE 3.49Å; P84-W342 HydrophobicContact CB-CD2 3.57Å; P84-W342 VanDerWaalsContact CB-CE2 3.45Å; P84-W342 HydrophobicContact CB-CE3 3.93Å; P84-W342 HydrophobicContact CB-CG 4.04Å; P84-W342 HydrophobicContact CB-CH2 4.09Å; P84-W342 HydrophobicContact CB-CZ2 3.75Å; P84-W342 HydrophobicContact CB-CZ3 4.17Å; P84-W342 HydrophobicContact CG-CB 4.28Å; P84-W342 HydrophobicContact CG-CD2 3.48Å; P84-W342 VanDerWaalsContact CG-CD2 3.48Å; P84-W342 HydrophobicContact CG-CE3 3.57Å; P84-W342 HydrophobicContact CG-CG 3.8Å; P84-W342 HydrophobicContact CG-CZ2 4.47Å; P84-W342 HydrophobicContact CG-CZ3 4.11Å
85	F	96.2	Very high	96	Very high	97 Å²	97	52.7 Å²	52.7	43%	0.425	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	54.3	32.1	-177.7	-49.6	-72.8	0	0	0	112.9	W83 K87 H121 R123 D124 W342	W83-F85 PolarHBondContact O-N 2.99Å; W83-F85 VanDerWaalsContact O-N 3.13Å; F85-K87 PolarHBondContact O-N 2.95Å; F85-H121 AromaticContact CE2-CE1 3.97Å; F85-H121 AromaticContact CZ-CE1 3.91Å; F85-R123 HydrophobicContact CE1-CB 4.04Å; F85-R123 HydrophobicContact CE1-CG 4.12Å; F85-R123 HydrophobicContact CZ-CG 4.42Å; F85-D124 WeakPolarHBondContact CA-OD1 3.31Å; F85-D124 WeakPolarHBondContact CA-OD2 3.27Å; F85-D124 PolarHBondContact N-OD2 2.91Å; F85-W342 HydrophobicContact CD2-CZ2 4.23Å; F85-W342 HydrophobicContact CE2-CH2 4.36Å; F85-W342 AromaticContact CE2-CZ2 3.84Å; F85-W342 HydrophobicContact CE2-CZ2 3.84Å
86	R	96.2	Very high	96	Very high	213 Å²	213	55 Å²	55	80%	0.804	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	58.9	21.6	-177.5	-46.9	-176.6	-175.8	-172	-1.2	114.6	W83 P84 D124	W83-R86 PolarHBondContact O-N 3.2Å; P84-R86 PolarHBondContact O-N 2.93Å; P84-R86 VanDerWaalsContact O-N 3.16Å; R86-D124 VanDerWaalsContact CG-OD1 3.28Å; R86-D124 WeakPolarHBondContact CG-OD1 3.26Å; R86-D124 PolarHBondContact N-OD1 2.68Å
87	K	96.2	Very high	95.9	Very high	152 Å²	152	57.7 Å²	57.7	66%	0.661	30%	0.301	S	S	*	.			trans	-103.2	116.7	178.9	-66.8	-174.4	-179.6	-174.5	0	110.7	P84 F85	P84-K87 PolarHBondContact O-N 3.05Å; P84-K87 VanDerWaalsContact O-N 3.08Å; F85-K87 PolarHBondContact O-N 2.95Å
88	A	96.6	Very high	95.8	Very high	76 Å²	76	59.2 Å²	59.2	63%	0.628	31%	0.307	S	S	*	.			trans	-66.4	154.4	171.4	0	0	0	0	0	111.1	W83	W83-A88 HydrophobicContact CD2-CB 4.26Å; W83-A88 HydrophobicContact CE3-CB 4.49Å; W83-A88 HydrophobicContact CH2-CB 4.3Å; W83-A88 HydrophobicContact CZ2-CB 4.02Å
89	Y	95.6	Very high	95.6	Very high	39 Å²	39	65.9 Å²	65.9	15%	0.153	34%	0.343	C	S	.	.			trans	-141.3	165.6	173.8	51.5	-98.1	0	0	0	109.6	V80 W83 P84 T91 W342 A343 T346	V80-Y89 WeakPolarHBondContact CG2-OH 3.3Å; W83-Y89 AromaticContact CE3-CD1 3.58Å; W83-Y89 HydrophobicContact CE3-CD1 3.58Å; W83-Y89 AromaticContact CE3-CE1 3.32Å; W83-Y89 HydrophobicContact CE3-CE1 3.32Å; W83-Y89 HydrophobicContact CE3-CE2 4.49Å; W83-Y89 HydrophobicContact CE3-CG 4.31Å; W83-Y89 AromaticContact CE3-CZ 3.82Å; W83-Y89 AromaticContact CZ3-CD1 3.5Å; W83-Y89 HydrophobicContact CZ3-CD1 3.5Å; W83-Y89 VanDerWaalsContact CZ3-CD1 3.5Å; W83-Y89 AromaticContact CZ3-CD2 3.85Å; W83-Y89 HydrophobicContact CZ3-CD2 3.85Å; W83-Y89 AromaticContact CZ3-CE1 3.35Å; W83-Y89 HydrophobicContact CZ3-CE1 3.35Å; W83-Y89 AromaticContact CZ3-CE2 3.69Å; W83-Y89 HydrophobicContact CZ3-CE2 3.69Å; W83-Y89 AromaticContact CZ3-CG 3.76Å; W83-Y89 HydrophobicContact CZ3-CG 3.76Å; W83-Y89 AromaticContact CZ3-CZ 3.44Å; W83-Y89 VanDerWaalsContact CZ3-CZ 3.44Å; P84-Y89 HydrophobicContact CG-CE1 4.34Å; Y89-T91 PolarHBondContact O-N 2.93Å; Y89-W342 HydrophobicContact CD1-CB 3.38Å; Y89-W342 HydrophobicContact CD1-CG 4.17Å; Y89-W342 HydrophobicContact CD2-CB 4.46Å; Y89-W342 HydrophobicContact CE1-CB 3.23Å; Y89-W342 HydrophobicContact CE1-CG 4.14Å; Y89-W342 HydrophobicContact CE2-CB 4.37Å; Y89-W342 HydrophobicContact CG-CB 4Å; Y89-A343 HydrophobicContact CD2-CB 3.78Å; Y89-A343 HydrophobicContact CE2-CB 4.17Å; Y89-T346 WeakPolarHBondContact OH-CG2 3.19Å; Y89-T346 PolarHBondContact OH-OG1 3.46Å
90	E	93.7	Very high	95.5	Very high	140 Å²	140	66.6 Å²	66.6	65%	0.654	35%	0.346	S	S	*	.			trans	-64.4	127.8	180	-160.7	179.1	174.3	0	0	110.9	V93 A343	E90-V93 HydrophobicContact CB-CG1 4.01Å; E90-V93 HydrophobicContact CG-CG1 3.58Å; E90-V93 WeakPolarHBondContact OE1-CG1 3.48Å; E90-A343 WeakPolarHBondContact O-CB 3.14Å
91	T	92.7	Very high	95.3	Very high	42 Å²	42	72.2 Å²	72.2	26%	0.258	37%	0.373	S	S	.	.	S	Bend	trans	-102.1	-19.3	-172.5	59.8	0	0	0	0	113.5	W83 Y89 V93 I105	W83-T91 HydrophobicContact CH2-CG2 3.7Å; W83-T91 HydrophobicContact CZ3-CG2 4.38Å; Y89-T91 PolarHBondContact O-N 2.93Å; T91-V93 PolarHBondContact O-N 2.66Å; T91-I105 VanDerWaalsContact CB-O 3.23Å; T91-I105 WeakPolarHBondContact CB-O 3.42Å; T91-I105 HydrophobicContact CG2-CB 4.5Å; T91-I105 HydrophobicContact CG2-CG2 4.04Å; T91-I105 WeakPolarHBondContact O-CB 3.4Å; T91-I105 PolarHBondContact OG1-O 2.91Å
92	N	88.8	Confident	95.1	Very high	131 Å²	131	71.9 Å²	71.9	70%	0.701	38%	0.379	S	S	*	.	S	Bend	trans	-98.5	50	-177.8	-166.3	33.1	0	0	0	112.6
93	V	95.3	Very high	95.1	Very high	13 Å²	13	71.6 Å²	71.6	8%	0.079	38%	0.378	C	S	.	.			trans	-125.6	0.8	-174	-65.2	0	0	0	0	113.9	E90 T91 G95 A97 F98 A343	E90-V93 HydrophobicContact CB-CG1 4.01Å; E90-V93 HydrophobicContact CG-CG1 3.58Å; E90-V93 WeakPolarHBondContact OE1-CG1 3.48Å; T91-V93 PolarHBondContact O-N 2.66Å; V93-G95 PolarHBondContact O-N 2.83Å; V93-A97 HydrophobicContact CB-CB 4.04Å; V93-A97 WeakPolarHBondContact O-CA 3.46Å; V93-A97 VanDerWaalsContact O-CB 3.23Å; V93-A97 WeakPolarHBondContact O-CB 3.42Å; V93-A97 PolarHBondContact O-N 2.77Å; V93-F98 HydrophobicContact CG2-CE2 3.86Å; V93-A343 HydrophobicContact CG2-CB 3.64Å
94	C	96	Very high	95	Very high	6 Å²	6	70.7 Å²	70.7	4%	0.041	38%	0.376	C	S	.	.	H	α-helix	trans	-60.5	-50.5	-175.1	-61.2	0	0	0	0	113	F98 N99 I100 C103 I105 C347	C94-F98 CarbonylContact O-C 3.5Å; C94-F98 WeakPolarHBondContact O-CA 3.36Å; C94-F98 WeakPolarHBondContact O-CB 3.31Å; C94-F98 PolarHBondContact O-N 2.87Å; C94-N99 PolarHBondContact O-N 3.26Å; C94-N99 VanDerWaalsContact O-N 3.13Å; C94-I100 CarbonylContact C-O 3.6Å; C94-I100 HydrophobicContact CB-CB 4.18Å; C94-I100 HydrophobicContact CB-CG2 4.45Å; C94-I100 VanDerWaalsContact CB-O 3.22Å; C94-I100 WeakPolarHBondContact CB-O 2.99Å; C94-I100 PolarHBondContact O-N 3.31Å; C94-C103 HydrophobicContact CB-CB 3.88Å; C94-I105 VanDerWaalsContact SG-CG1 3.54Å; C94-C347 WeakPolarHBondContact CA-SG 3.45Å; C94-C347 HydrophobicContact CB-CB 3.75Å; C94-C347 WeakPolarHBondContact CB-SG 3.49Å; C94-C347 VanDerWaalsContact SG-CA 3.52Å; C94-C347 WeakPolarHBondContact SG-CB 3.41Å; C94-C347 CovalentContact SG-SG 2.04Å; C94-C347 PolarHBondContact SG-SG 3.03Å
95	G	94.9	Very high	95.1	Very high	18 Å²	18	71 Å²	71	19%	0.186	38%	0.377	C	S	.	.	H	α-helix	trans	-67.9	-54.2	176.6	0	0	0	0	0	112	V93 A97 N99 I100 E101	V93-G95 PolarHBondContact O-N 2.83Å; G95-A97 PolarHBondContact O-N 3.35Å; G95-N99 VanDerWaalsContact O-CA 3.27Å; G95-N99 WeakPolarHBondContact O-CA 3.44Å; G95-N99 PolarHBondContact O-N 3.28Å; G95-I100 PolarHBondContact N-O 2.92Å; G95-I100 VanDerWaalsContact N-O 3.11Å; G95-E101 WeakPolarHBondContact CA-OE1 3.44Å
96	S	94.5	Very high	95.1	Very high	106 Å²	106	67.1 Å²	67.1	74%	0.741	36%	0.362	S	S	*	.	H	α-helix	trans	-67.7	-36	-172.7	56.2	0	0	0	0	115
97	A	94.1	Very high	95.2	Very high	60 Å²	60	58.4 Å²	58.4	50%	0.496	34%	0.335	S	S	.	.	H	α-helix	trans	-102.3	-26.4	-175.3	0	0	0	0	0	113.8	V93 G95	V93-A97 HydrophobicContact CB-CB 4.04Å; V93-A97 WeakPolarHBondContact O-CA 3.46Å; V93-A97 VanDerWaalsContact O-CB 3.23Å; V93-A97 WeakPolarHBondContact O-CB 3.42Å; V93-A97 PolarHBondContact O-N 2.77Å; G95-A97 PolarHBondContact O-N 3.35Å
98	F	94	Very high	95.2	Very high	47 Å²	47	54.4 Å²	54.4	21%	0.206	32%	0.321	C	S	.	.	H	α-helix	trans	-127.1	1.9	-172.2	-47.4	-59.4	0	0	0	113.7	V93 C94 I100 S341 A343 E344 C347	V93-F98 HydrophobicContact CG2-CE2 3.86Å; C94-F98 CarbonylContact O-C 3.5Å; C94-F98 WeakPolarHBondContact O-CA 3.36Å; C94-F98 WeakPolarHBondContact O-CB 3.31Å; C94-F98 PolarHBondContact O-N 2.87Å; F98-I100 HydrophobicContact CB-CD1 4.12Å; F98-I100 HydrophobicContact CB-CG1 4.24Å; F98-I100 PolarHBondContact O-N 3.3Å; F98-S341 WeakPolarHBondContact CZ-OG 3.37Å; F98-A343 HydrophobicContact CE2-CB 4.07Å; F98-A343 HydrophobicContact CZ-CB 4.45Å; F98-E344 HydrophobicContact CD1-CB 4.01Å; F98-E344 HydrophobicContact CD1-CG 3.7Å; F98-E344 HydrophobicContact CD2-CB 4.26Å; F98-E344 HydrophobicContact CD2-CG 4.49Å; F98-E344 HydrophobicContact CE1-CB 3.6Å; F98-E344 HydrophobicContact CE1-CG 3.74Å; F98-E344 VanDerWaalsContact CE2-CA 3.5Å; F98-E344 HydrophobicContact CE2-CB 3.87Å; F98-E344 HydrophobicContact CG-CB 4.34Å; F98-E344 HydrophobicContact CG-CG 4.12Å; F98-E344 HydrophobicContact CZ-CB 3.54Å; F98-E344 HydrophobicContact CZ-CG 4.18Å; F98-C347 HydrophobicContact CD2-CB 4.09Å
99	N	95.1	Very high	95.2	Very high	140 Å²	140	56 Å²	56	75%	0.749	31%	0.311	S	S	*	.			trans	56.2	34.1	-177.3	-163.9	42.6	0	0	0	112.9	C94 G95	C94-N99 PolarHBondContact O-N 3.26Å; C94-N99 VanDerWaalsContact O-N 3.13Å; G95-N99 VanDerWaalsContact O-CA 3.27Å; G95-N99 WeakPolarHBondContact O-CA 3.44Å; G95-N99 PolarHBondContact O-N 3.28Å
100	I	95.6	Very high	95.3	Very high	15 Å²	15	62.5 Å²	62.5	8%	0.077	34%	0.34	C	S	.	.			trans	-108.7	98.1	177.3	-62.3	172.3	0	0	0	108.7	C94 G95 F98 C347 D351	C94-I100 CarbonylContact C-O 3.6Å; C94-I100 HydrophobicContact CB-CB 4.18Å; C94-I100 HydrophobicContact CB-CG2 4.45Å; C94-I100 VanDerWaalsContact CB-O 3.22Å; C94-I100 WeakPolarHBondContact CB-O 2.99Å; C94-I100 PolarHBondContact O-N 3.31Å; G95-I100 PolarHBondContact N-O 2.92Å; G95-I100 VanDerWaalsContact N-O 3.11Å; F98-I100 HydrophobicContact CB-CD1 4.12Å; F98-I100 HydrophobicContact CB-CG1 4.24Å; F98-I100 PolarHBondContact O-N 3.3Å; I100-C347 HydrophobicContact CD1-CB 3.82Å; I100-D351 HydrophobicContact CG2-CB 3.81Å
101	E	94.8	Very high	95.4	Very high	119 Å²	119	57.7 Å²	57.7	56%	0.556	32%	0.317	S	S	*	.			trans	-86	161.1	-179.2	-64.2	-57	151.5	0	0	113.8	G95 K354	G95-E101 WeakPolarHBondContact CA-OE1 3.44Å; E101-K354 PolarHBondContact O-NZ 3.34Å
102	G	95.1	Very high	95.6	Very high	24 Å²	24	56.2 Å²	56.2	25%	0.247	31%	0.307	C	S	.	.	S	Bend	trans	76.3	26.6	176.4	0	0	0	0	0	114	T76	T76-G102 PolarHBondContact N-O 3.37Å
103	C	96.3	Very high	96	Very high	11 Å²	11	54.7 Å²	54.7	7%	0.074	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	128.1	-177.4	-70.8	0	0	0	0	112.5	M75 C94 I105 C350	M75-C103 WeakPolarHBondContact CE-O 3.44Å; C94-C103 HydrophobicContact CB-CB 3.88Å; C103-I105 HydrophobicContact CB-CD1 4.36Å; C103-C350 WeakPolarHBondContact CA-SG 3.46Å; C103-C350 HydrophobicContact CB-CB 3.89Å; C103-C350 WeakPolarHBondContact CB-SG 3.45Å; C103-C350 WeakPolarHBondContact SG-CB 3.35Å; C103-C350 CovalentContact SG-SG 2.02Å; C103-C350 PolarHBondContact SG-SG 3.07Å
104	F	97.1	Very high	95.9	Very high	35 Å²	35	60.8 Å²	60.8	15%	0.154	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	97.7	168.4	-179.1	-111.8	0	0	0	109.4	L69 I71 M75 T76 I77 V78 T106 F111	L69-F104 HydrophobicContact CD2-CD2 4.27Å; L69-F104 HydrophobicContact CD2-CE2 3.65Å; L69-F104 HydrophobicContact CD2-CZ 4.26Å; I71-F104 HydrophobicContact CD1-CD1 3.99Å; I71-F104 HydrophobicContact CD1-CE1 3.81Å; I71-F104 HydrophobicContact CD1-CZ 4.31Å; I71-F104 HydrophobicContact CG1-CD1 4.5Å; M75-F104 HydrophobicContact CB-CB 4.34Å; M75-F104 HydrophobicContact CE-CB 4.4Å; M75-F104 HydrophobicContact SD-CB 4.17Å; T76-F104 PolarHBondContact O-N 3.14Å; I77-F104 WeakPolarHBondContact CA-O 3.45Å; I77-F104 HydrophobicContact CB-CD1 4.46Å; I77-F104 HydrophobicContact CG1-CB 4.37Å; I77-F104 HydrophobicContact CG1-CD1 4.08Å; I77-F104 HydrophobicContact CG2-CD1 3.96Å; V78-F104 PolarHBondContact N-O 3.32Å; F104-T106 HydrophobicContact CD1-CG2 4.36Å; F104-T106 HydrophobicContact CE1-CG2 3.87Å; F104-F111 HydrophobicContact CE1-CD1 4.03Å; F104-F111 AromaticContact CE1-CE1 3.79Å; F104-F111 HydrophobicContact CE1-CE1 3.79Å; F104-F111 HydrophobicContact CE1-CE2 4.36Å; F104-F111 HydrophobicContact CE1-CG 4.43Å; F104-F111 AromaticContact CE1-CZ 3.94Å; F104-F111 HydrophobicContact CE1-CZ 3.94Å; F104-F111 HydrophobicContact CZ-CZ 4.26Å
105	I	97.5	Very high	96	Very high	7 Å²	7	60.5 Å²	60.5	4%	0.036	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	128.8	177.2	-43.9	-60.3	0	0	0	108.9	V78 V80 T91 C94 C103 C350	V78-I105 HydrophobicContact CB-CD1 3.63Å; V78-I105 HydrophobicContact CG1-CD1 4.35Å; V78-I105 HydrophobicContact CG2-CD1 3.94Å; V78-I105 WeakPolarHBondContact O-CA 3.37Å; V80-I105 HydrophobicContact CG2-CG2 3.78Å; T91-I105 VanDerWaalsContact CB-O 3.23Å; T91-I105 WeakPolarHBondContact CB-O 3.42Å; T91-I105 HydrophobicContact CG2-CB 4.5Å; T91-I105 HydrophobicContact CG2-CG2 4.04Å; T91-I105 WeakPolarHBondContact O-CB 3.4Å; T91-I105 PolarHBondContact OG1-O 2.91Å; C94-I105 VanDerWaalsContact SG-CG1 3.54Å; C103-I105 HydrophobicContact CB-CD1 4.36Å; I105-C350 HydrophobicContact CD1-CB 3.82Å
106	T	97.4	Very high	96.1	Very high	16 Å²	16	61.2 Å²	61.2	10%	0.098	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	160.8	179.8	-175.7	0	0	0	0	111.2	V78 L79 V80 F104 D108 F111	V78-T106 PolarHBondContact O-N 3.32Å; L79-T106 CarbonylContact C-O 3.56Å; L79-T106 WeakPolarHBondContact CA-O 3.5Å; L79-T106 HydrophobicContact CD1-CG2 4.18Å; V80-T106 PolarHBondContact N-O 2.99Å; F104-T106 HydrophobicContact CD1-CG2 4.36Å; F104-T106 HydrophobicContact CE1-CG2 3.87Å; T106-D108 PolarHBondContact OG1-N 3.45Å; T106-D108 VanDerWaalsContact OG1-N 3.09Å; T106-F111 HydrophobicContact CG2-CB 3.85Å; T106-F111 HydrophobicContact CG2-CD2 4.03Å; T106-F111 HydrophobicContact CG2-CG 3.89Å
107	A	97.3	Very high	96.2	Very high	30 Å²	30	56.2 Å²	56.2	25%	0.248	29%	0.286	C	S	.	.			trans	-118	7.4	167	0	0	0	0	0	112.7	W83 R109	W83-A107 HydrophobicContact CH2-CB 4Å; W83-A107 HydrophobicContact CZ2-CB 3.14Å; A107-R109 PolarHBondContact O-N 3.23Å
108	D	97.2	Very high	96.4	Very high	68 Å²	68	53.3 Å²	53.3	36%	0.364	26%	0.263	S	S	.	.			trans	-72.7	115.5	175.3	-179	-3.8	0	0	0	109.9	L79 T106 K110 F111	L79-D108 WeakPolarHBondContact CD1-O 3.45Å; T106-D108 PolarHBondContact OG1-N 3.45Å; T106-D108 VanDerWaalsContact OG1-N 3.09Å; D108-K110 PolarHBondContact O-N 3.1Å; D108-K110 VanDerWaalsContact O-N 3.07Å; D108-K110 WeakPolarHBondContact OD1-CB 3.17Å; D108-K110 VanDerWaalsContact OD1-CG 3.3Å; D108-K110 WeakPolarHBondContact OD1-CG 3.36Å; D108-K110 PolarHBondContact OD1-N 3.13Å; D108-F111 HydrophobicContact CB-CD2 3.89Å; D108-F111 HydrophobicContact CB-CE2 4.28Å; D108-F111 WeakPolarHBondContact O-CB 3.31Å; D108-F111 PolarHBondContact O-N 2.88Å
109	R	96.7	Very high	96.6	Very high	110 Å²	110	51.1 Å²	51.1	42%	0.415	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-57.6	-24.1	-178.2	-54.5	-59.6	-174	-176.8	-3.3	113.2	W81 A107 F111 Y112	W81-R109 PolarHBondContact O-NH1 3.05Å; W81-R109 PolarHBondContact O-NH2 3.26Å; A107-R109 PolarHBondContact O-N 3.23Å; R109-F111 PolarHBondContact O-N 3.42Å; R109-F111 VanDerWaalsContact O-N 3.13Å; R109-Y112 VanDerWaalsContact O-CB 3.32Å; R109-Y112 WeakPolarHBondContact O-CB 3.48Å; R109-Y112 PolarHBondContact O-N 3.18Å
110	K	96.5	Very high	96.8	Very high	175 Å²	175	44.4 Å²	44.4	76%	0.761	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-59.4	-22.2	176	-65.3	174.8	-176	175.7	0	112.5	D108 Y112	D108-K110 PolarHBondContact O-N 3.1Å; D108-K110 VanDerWaalsContact O-N 3.07Å; D108-K110 WeakPolarHBondContact OD1-CB 3.17Å; D108-K110 VanDerWaalsContact OD1-CG 3.3Å; D108-K110 WeakPolarHBondContact OD1-CG 3.36Å; D108-K110 PolarHBondContact OD1-N 3.13Å; K110-Y112 VanDerWaalsContact C-N 3.33Å
111	F	96.5	Very high	96.9	Very high	39 Å²	39	43.8 Å²	43.8	17%	0.171	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-83.3	-3	177.2	-73.7	-86.8	0	0	0	114.3	I71 I77 F104 T106 D108 R109 N113 K114 S115	I71-F111 HydrophobicContact CD1-CD1 4.27Å; I71-F111 HydrophobicContact CD1-CE1 3.33Å; I71-F111 HydrophobicContact CD1-CZ 3.96Å; I77-F111 HydrophobicContact CD1-CD1 4.49Å; I77-F111 HydrophobicContact CG2-CD1 4.36Å; F104-F111 HydrophobicContact CE1-CD1 4.03Å; F104-F111 AromaticContact CE1-CE1 3.79Å; F104-F111 HydrophobicContact CE1-CE1 3.79Å; F104-F111 HydrophobicContact CE1-CE2 4.36Å; F104-F111 HydrophobicContact CE1-CG 4.43Å; F104-F111 AromaticContact CE1-CZ 3.94Å; F104-F111 HydrophobicContact CE1-CZ 3.94Å; F104-F111 HydrophobicContact CZ-CZ 4.26Å; T106-F111 HydrophobicContact CG2-CB 3.85Å; T106-F111 HydrophobicContact CG2-CD2 4.03Å; T106-F111 HydrophobicContact CG2-CG 3.89Å; D108-F111 HydrophobicContact CB-CD2 3.89Å; D108-F111 HydrophobicContact CB-CE2 4.28Å; D108-F111 WeakPolarHBondContact O-CB 3.31Å; D108-F111 PolarHBondContact O-N 2.88Å; R109-F111 PolarHBondContact O-N 3.42Å; R109-F111 VanDerWaalsContact O-N 3.13Å; F111-N113 VanDerWaalsContact C-N 3.33Å; F111-N113 PolarHBondContact O-N 3.16Å; F111-K114 HydrophobicContact CD1-CB 4.48Å; F111-K114 HydrophobicContact CD1-CD 4.49Å; F111-K114 CarbonylContact O-C 3.52Å; F111-K114 WeakPolarHBondContact O-CA 3.32Å; F111-K114 PolarHBondContact O-N 3.31Å; F111-S115 WeakPolarHBondContact O-CB 3.27Å; F111-S115 PolarHBondContact O-N 2.9Å; F111-S115 PolarHBondContact O-OG 3.09Å
112	Y	97.5	Very high	97.1	Very high	10 Å²	10	38.3 Å²	38.3	4%	0.039	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-46	-177.2	176.8	-102	0	0	0	112.9	L79 W81 R109 K110 K114 S115 V118 P133 S135 Q141 W143	L79-Y112 HydrophobicContact CD2-CD2 4.14Å; W81-Y112 HydrophobicContact CE3-CD2 4.11Å; W81-Y112 AromaticContact CZ3-CD2 3.89Å; W81-Y112 HydrophobicContact CZ3-CD2 3.89Å; W81-Y112 HydrophobicContact CZ3-CG 4.23Å; R109-Y112 VanDerWaalsContact O-CB 3.32Å; R109-Y112 WeakPolarHBondContact O-CB 3.48Å; R109-Y112 PolarHBondContact O-N 3.18Å; K110-Y112 VanDerWaalsContact C-N 3.33Å; Y112-K114 PolarHBondContact O-N 3.46Å; Y112-S115 PolarHBondContact O-OG 2.91Å; Y112-V118 HydrophobicContact CD2-CG2 4.04Å; Y112-V118 HydrophobicContact CE2-CG2 4.07Å; Y112-P133 HydrophobicContact CD2-CB 3.95Å; Y112-P133 HydrophobicContact CD2-CG 4.08Å; Y112-P133 HydrophobicContact CE1-CB 4.34Å; Y112-P133 HydrophobicContact CE2-CB 3.3Å; Y112-P133 HydrophobicContact CE2-CG 3.49Å; Y112-P133 VanDerWaalsContact CE2-CG 3.49Å; Y112-S135 PolarHBondContact OH-O 3.06Å; Y112-Q141 PolarHBondContact O-NE2 3.3Å; Y112-W143 HydrophobicContact CE2-CZ2 4.35Å; Y112-W143 AromaticContact CE2-NE1 3.82Å; Y112-W143 WeakPolarHBondContact OH-CZ2 3.26Å
113	N	95.9	Very high	97.2	Very high	100 Å²	100	42.1 Å²	42.1	54%	0.535	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-4.5	-179.7	-68.5	-23.9	0	0	0	114	F111	F111-N113 VanDerWaalsContact C-N 3.33Å; F111-N113 PolarHBondContact O-N 3.16Å
114	K	95	Very high	97.3	Very high	141 Å²	141	42.5 Å²	42.5	61%	0.613	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112.7	-15.7	-177.5	-59.8	-178.3	-179.2	-178.2	0	112.7	I77 F111 Y112	I77-K114 HydrophobicContact CD1-CB 4.39Å; F111-K114 HydrophobicContact CD1-CB 4.48Å; F111-K114 HydrophobicContact CD1-CD 4.49Å; F111-K114 CarbonylContact O-C 3.52Å; F111-K114 WeakPolarHBondContact O-CA 3.32Å; F111-K114 PolarHBondContact O-N 3.31Å; Y112-K114 PolarHBondContact O-N 3.46Å
115	S	96.3	Very high	97.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	19%	0.193	C	C	.	.			trans	-76.9	129.4	-175.3	52.7	0	0	0	0	112.6	I77 F111 Y112 G117 F140 Q141	I77-S115 CarbonylContact O-C 3.51Å; F111-S115 WeakPolarHBondContact O-CB 3.27Å; F111-S115 PolarHBondContact O-N 2.9Å; F111-S115 PolarHBondContact O-OG 3.09Å; Y112-S115 PolarHBondContact O-OG 2.91Å; S115-G117 WeakPolarHBondContact CB-O 3.35Å; S115-G117 PolarHBondContact O-N 2.99Å; S115-F140 WeakPolarHBondContact O-CE2 3.29Å; S115-Q141 WeakPolarHBondContact O-CG 3.43Å; S115-Q141 PolarHBondContact O-NE2 2.88Å; S115-Q141 PolarHBondContact OG-NE2 3Å
116	D	96.8	Very high	97.2	Very high	33 Å²	33	42.5 Å²	42.5	18%	0.176	20%	0.202	C	C	.	.	S	Bend	trans	-60.5	-36.9	167.8	-62	-99.6	0	0	0	111.3	T76 I77 Q141 K142 K357	T76-D116 WeakPolarHBondContact CA-OD2 3.38Å; T76-D116 HydrophobicContact CG2-CB 3.93Å; I77-D116 PolarHBondContact N-OD2 3.46Å; I77-D116 PolarHBondContact O-N 3.35Å; D116-Q141 WeakPolarHBondContact O-CA 3.12Å; D116-K142 PolarHBondContact O-N 2.8Å; D116-K357 IonicContact OD1-NZ 3.97Å; D116-K357 PolarHBondContact OD1-NZ 2.98Å
117	G	97.6	Very high	96.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	143.1	-177	0	0	0	0	0	113.7	I77 V78 L79 S115 K142 L353	I77-G117 PolarHBondContact O-N 3.28Å; I77-G117 VanDerWaalsContact O-N 3.15Å; V78-G117 WeakPolarHBondContact CA-O 3.49Å; L79-G117 PolarHBondContact N-O 3Å; S115-G117 WeakPolarHBondContact CB-O 3.35Å; S115-G117 PolarHBondContact O-N 2.99Å; G117-K142 CarbonylContact C-O 3.57Å; G117-K142 VanDerWaalsContact CA-O 3.28Å; G117-K142 WeakPolarHBondContact CA-O 3.42Å; G117-L353 VanDerWaalsContact CA-CD1 3.48Å
118	V	98.5	Very high	96.7	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	107.3	171.2	-175.6	0	0	0	0	109.2	L79 W81 Y112 I120 P133 Q141 K142 W143 V144	L79-V118 HydrophobicContact CB-CG2 4.37Å; L79-V118 CarbonylContact O-C 3.55Å; L79-V118 WeakPolarHBondContact O-CA 3.49Å; W81-V118 HydrophobicContact CB-CG1 3.49Å; W81-V118 VanDerWaalsContact CB-CG1 3.49Å; W81-V118 HydrophobicContact CD2-CG1 4.47Å; W81-V118 HydrophobicContact CE3-CG1 4.39Å; W81-V118 HydrophobicContact CG-CG1 4.13Å; Y112-V118 HydrophobicContact CD2-CG2 4.04Å; Y112-V118 HydrophobicContact CE2-CG2 4.07Å; V118-I120 HydrophobicContact CG1-CD1 4.24Å; V118-I120 HydrophobicContact CG1-CG1 4.15Å; V118-P133 HydrophobicContact CG1-CG 4.48Å; V118-Q141 HydrophobicContact CG2-CG 3.94Å; V118-Q141 VanDerWaalsContact CG2-OE1 3.28Å; V118-K142 PolarHBondContact N-O 3.46Å; V118-W143 HydrophobicContact CB-CG 4.37Å; V118-W143 WeakPolarHBondContact O-CA 3.29Å; V118-V144 PolarHBondContact O-N 2.82Å
119	V	98.7	Very high	96.6	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	124.4	-179.5	177.9	0	0	0	0	110	V78 L79 W81 L82 V144 M146 T346 A349	V78-V119 HydrophobicContact CG1-CG2 3.58Å; L79-V119 PolarHBondContact O-N 2.9Å; W81-V119 PolarHBondContact N-O 3.47Å; L82-V119 PolarHBondContact N-O 2.87Å; V119-V144 HydrophobicContact CG2-CB 4.07Å; V119-V144 HydrophobicContact CG2-CG1 4.47Å; V119-V144 HydrophobicContact CG2-CG2 4.38Å; V119-M146 HydrophobicContact CG1-CB 3.89Å; V119-M146 HydrophobicContact CG1-CE 3.75Å; V119-M146 HydrophobicContact CG1-SD 3.97Å; V119-T346 HydrophobicContact CB-CG2 4.41Å; V119-T346 HydrophobicContact CG1-CG2 4.07Å; V119-T346 HydrophobicContact CG2-CG2 4.24Å; V119-A349 HydrophobicContact CG2-CB 4.13Å
120	I	98.6	Very high	96.5	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	116	-177.4	-62.6	161.2	0	0	0	108.2	W81 L82 V118 I125 L132 W143 V144 M146 F164	W81-I120 HydrophobicContact CB-CG1 3.82Å; W81-I120 HydrophobicContact CG-CG1 4.24Å; L82-I120 HydrophobicContact CB-CG2 4.43Å; L82-I120 HydrophobicContact CD1-CG2 3.65Å; L82-I120 HydrophobicContact CG-CG2 4.08Å; V118-I120 HydrophobicContact CG1-CD1 4.24Å; V118-I120 HydrophobicContact CG1-CG1 4.15Å; I120-I125 HydrophobicContact CG2-CD1 3.79Å; I120-I125 HydrophobicContact CG2-CG1 3.69Å; I120-L132 HydrophobicContact CD1-CD2 4.25Å; I120-L132 HydrophobicContact CG2-CD2 3.73Å; I120-W143 HydrophobicContact CD1-CD2 3.92Å; I120-W143 HydrophobicContact CD1-CE3 3.72Å; I120-W143 HydrophobicContact CD1-CG 4.3Å; I120-W143 HydrophobicContact CD1-CZ3 4.27Å; I120-V144 PolarHBondContact N-O 3.46Å; I120-M146 PolarHBondContact O-N 3.06Å; I120-F164 HydrophobicContact CB-CE1 3.83Å; I120-F164 HydrophobicContact CB-CZ 4.17Å; I120-F164 HydrophobicContact CD1-CE1 3.59Å; I120-F164 HydrophobicContact CD1-CZ 4.08Å; I120-F164 HydrophobicContact CG1-CE1 4.22Å; I120-F164 HydrophobicContact CG2-CE1 4.28Å; I120-F164 HydrophobicContact CG2-CZ 4.1Å
121	H	98.4	Very high	96.5	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	124.2	176.4	-175.3	-117.4	0	0	0	112.3	L82 P84 F85 R123 D124 M146	L82-H121 HydrophobicContact CB-CB 4.45Å; L82-H121 WeakPolarHBondContact O-CB 3.41Å; L82-H121 PolarHBondContact O-N 3.01Å; P84-H121 WeakPolarHBondContact CA-ND1 3.27Å; P84-H121 HydrophobicContact CG-CB 4.29Å; F85-H121 AromaticContact CE2-CE1 3.97Å; F85-H121 AromaticContact CZ-CE1 3.91Å; H121-R123 VanDerWaalsContact CE1-CB 3.48Å; H121-R123 WeakPolarHBondContact CE1-CB 3.16Å; H121-R123 PolarHBondContact O-N 3.08Å; H121-D124 IonicContact CE1-OD2 3.14Å; H121-D124 IonicContact CG-OD2 2.83Å; H121-D124 IonicContact ND1-OD2 3.36Å; H121-D124 PolarHBondContact ND1-OD2 3.14Å; H121-D124 PolarHBondContact O-N 2.8Å; H121-M146 CarbonylContact C-O 3.51Å; H121-M146 WeakPolarHBondContact CA-O 3.16Å; H121-M146 HydrophobicContact CB-CE 3.95Å; H121-M146 PolarHBondContact CD2-O 3.01Å
122	H	98	Very high	96.5	Very high	5 Å²	5	37.4 Å²	37.4	2%	0.023	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-56.1	-45.7	-173.9	-177.9	73.3	0	0	0	114	D124 I125 W145 M146 N147 G155 W370	H122-D124 PolarHBondContact O-N 2.83Å; H122-D124 VanDerWaalsContact O-N 3.08Å; H122-I125 WeakPolarHBondContact O-CB 3.37Å; H122-I125 PolarHBondContact O-N 3.01Å; H122-I125 VanDerWaalsContact O-N 3.08Å; H122-W145 HydrophobicContact CB-CZ2 3.92Å; H122-W145 AromaticContact CG-CE2 3.9Å; H122-W145 AromaticContact CG-CZ2 3.77Å; H122-W145 AromaticContact CG-NE1 3.53Å; H122-W145 AromaticContact ND1-CE2 3.69Å; H122-W145 AromaticContact ND1-CZ2 3.76Å; H122-W145 AromaticContact ND1-NE1 3.03Å; H122-W145 PolarHBondContact ND1-NE1 3Å; H122-M146 PolarHBondContact N-O 3.2Å; H122-N147 HydrophobicContact CB-CB 3.67Å; H122-G155 PolarHBondContact CE1-O 3.5Å; H122-G155 PolarHBondContact NE2-O 2.91Å; H122-W370 AromaticContact CE1-CH2 3.51Å; H122-W370 AromaticContact CE1-CZ2 3.9Å; H122-W370 AromaticContact NE2-CH2 3.75Å; H122-W370 AromaticContact NE2-CZ2 3.66Å
123	R	97.1	Very high	96.4	Very high	104 Å²	104	37.5 Å²	37.5	39%	0.392	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-66.9	-12.4	-175.5	-63.6	-72.7	-57.8	-94.8	-9.1	113.5	F85 H121 E149 N153	F85-R123 HydrophobicContact CE1-CB 4.04Å; F85-R123 HydrophobicContact CE1-CG 4.12Å; F85-R123 HydrophobicContact CZ-CG 4.42Å; H121-R123 VanDerWaalsContact CE1-CB 3.48Å; H121-R123 WeakPolarHBondContact CE1-CB 3.16Å; H121-R123 PolarHBondContact O-N 3.08Å; R123-E149 IonicContact NH1-OE2 2.8Å; R123-N153 PolarHBondContact NH1-O 3.39Å
124	D	97.7	Very high	96.3	Very high	18 Å²	18	41.4 Å²	41.4	10%	0.096	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-105.9	-2.9	179.1	-66.1	-81.9	0	0	0	112.6	L82 W83 F85 R86 H121 H122 A126 N131	L82-D124 HydrophobicContact CB-CB 4.04Å; L82-D124 HydrophobicContact CD1-CB 4.17Å; L82-D124 WeakPolarHBondContact CD1-O 3.29Å; W83-D124 VanDerWaalsContact O-CG 3.31Å; W83-D124 VanDerWaalsContact O-OD2 3.06Å; F85-D124 WeakPolarHBondContact CA-OD1 3.31Å; F85-D124 WeakPolarHBondContact CA-OD2 3.27Å; F85-D124 PolarHBondContact N-OD2 2.91Å; R86-D124 VanDerWaalsContact CG-OD1 3.28Å; R86-D124 WeakPolarHBondContact CG-OD1 3.26Å; R86-D124 PolarHBondContact N-OD1 2.68Å; H121-D124 IonicContact CE1-OD2 3.14Å; H121-D124 IonicContact CG-OD2 2.83Å; H121-D124 IonicContact ND1-OD2 3.36Å; H121-D124 PolarHBondContact ND1-OD2 3.14Å; H121-D124 PolarHBondContact O-N 2.8Å; H122-D124 PolarHBondContact O-N 2.83Å; H122-D124 VanDerWaalsContact O-N 3.08Å; D124-A126 PolarHBondContact O-N 3.07Å; D124-N131 PolarHBondContact O-ND2 2.67Å
125	I	97.6	Very high	96.1	Very high	15 Å²	15	38.1 Å²	38.1	8%	0.077	22%	0.217	C	C	.	.	S	Bend	trans	-68.5	127.1	173.9	-59.1	176.5	0	0	0	108.7	L82 I120 H122 L129 L132 L157 I160 F164	L82-I125 HydrophobicContact CD1-CB 4.37Å; L82-I125 HydrophobicContact CD1-CG1 3.77Å; I120-I125 HydrophobicContact CG2-CD1 3.79Å; I120-I125 HydrophobicContact CG2-CG1 3.69Å; H122-I125 WeakPolarHBondContact O-CB 3.37Å; H122-I125 PolarHBondContact O-N 3.01Å; H122-I125 VanDerWaalsContact O-N 3.08Å; I125-L129 HydrophobicContact CG2-CD2 3.46Å; I125-L129 VanDerWaalsContact CG2-CD2 3.46Å; I125-L132 HydrophobicContact CG1-CD2 4.2Å; I125-L132 HydrophobicContact CG2-CD2 4.17Å; I125-L132 HydrophobicContact CG2-CG 4.45Å; I125-L157 HydrophobicContact CB-CD1 3.81Å; I125-L157 HydrophobicContact CD1-CD1 4.33Å; I125-L157 HydrophobicContact CG2-CD1 3.55Å; I125-I160 HydrophobicContact CD1-CD1 4.01Å; I125-F164 HydrophobicContact CD1-CE2 4.48Å; I125-F164 HydrophobicContact CD1-CZ 4.09Å
126	A	95.3	Very high	95.8	Very high	27 Å²	27	46.6 Å²	46.6	22%	0.223	26%	0.256	C	S	.	.			trans	-66.1	143.7	173.6	0	0	0	0	0	109.9	D124 D128 L129 N131	D124-A126 PolarHBondContact O-N 3.07Å; A126-D128 VanDerWaalsContact CB-OD1 3.26Å; A126-D128 WeakPolarHBondContact CB-OD1 3.41Å; A126-D128 PolarHBondContact O-N 3.33Å; A126-D128 VanDerWaalsContact O-N 3.08Å; A126-L129 WeakPolarHBondContact O-CA 3.43Å; A126-L129 PolarHBondContact O-N 2.62Å; A126-N131 HydrophobicContact CB-CB 4.33Å; A126-N131 WeakPolarHBondContact CB-OD1 3.49Å; A126-N131 PolarHBondContact N-ND2 3.44Å; A126-N131 PolarHBondContact N-OD1 2.99Å
127	G	92.1	Very high	95.7	Very high	65 Å²	65	48.7 Å²	48.7	67%	0.67	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-27.1	-176	0	0	0	0	0	114.3
128	D	92.5	Very high	95.5	Very high	112 Å²	112	49.5 Å²	49.5	60%	0.599	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	1.1	176.2	66.8	-7.3	0	0	0	113.9	A126 S130	A126-D128 VanDerWaalsContact CB-OD1 3.26Å; A126-D128 WeakPolarHBondContact CB-OD1 3.41Å; A126-D128 PolarHBondContact O-N 3.33Å; A126-D128 VanDerWaalsContact O-N 3.08Å; D128-S130 VanDerWaalsContact CG-OG 3.29Å; D128-S130 PolarHBondContact O-N 2.81Å; D128-S130 WeakPolarHBondContact OD1-CB 3.35Å; D128-S130 PolarHBondContact OD1-N 2.97Å; D128-S130 PolarHBondContact OD1-OG 2.81Å; D128-S130 WeakPolarHBondContact OD2-CB 3.38Å; D128-S130 PolarHBondContact OD2-OG 3Å
129	L	94.8	Very high	95.2	Very high	32 Å²	32	55.6 Å²	55.6	17%	0.168	31%	0.306	C	S	.	.			trans	61.7	13.3	-175.8	-47.3	-178.9	0	0	0	114.7	I125 A126 N131 L132 L157 R159 L163	I125-L129 HydrophobicContact CG2-CD2 3.46Å; I125-L129 VanDerWaalsContact CG2-CD2 3.46Å; A126-L129 WeakPolarHBondContact O-CA 3.43Å; A126-L129 PolarHBondContact O-N 2.62Å; L129-N131 PolarHBondContact O-N 3Å; L129-N131 VanDerWaalsContact O-N 3.08Å; L129-L132 HydrophobicContact CB-CD1 3.99Å; L129-L132 HydrophobicContact CB-CG 4.24Å; L129-L132 HydrophobicContact CD1-CD1 4.49Å; L129-L132 HydrophobicContact CD2-CD1 4.15Å; L129-L132 HydrophobicContact CG-CD1 4.45Å; L129-L132 WeakPolarHBondContact O-CB 3.17Å; L129-L132 PolarHBondContact O-N 2.91Å; L129-L132 VanDerWaalsContact O-N 3.08Å; L129-L157 HydrophobicContact CD2-CD1 4.22Å; L129-R159 HydrophobicContact CD1-CB 3.69Å; L129-L163 HydrophobicContact CD1-CD1 3.76Å
130	S	95.3	Very high	94.9	Very high	58 Å²	58	60.9 Å²	60.9	41%	0.406	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-22	-174.4	58	0	0	0	0	114.2	D128 K134	D128-S130 VanDerWaalsContact CG-OG 3.29Å; D128-S130 PolarHBondContact O-N 2.81Å; D128-S130 WeakPolarHBondContact OD1-CB 3.35Å; D128-S130 PolarHBondContact OD1-N 2.97Å; D128-S130 PolarHBondContact OD1-OG 2.81Å; D128-S130 WeakPolarHBondContact OD2-CB 3.38Å; D128-S130 PolarHBondContact OD2-OG 3Å; S130-K134 WeakPolarHBondContact O-CE 3.47Å
131	N	96.4	Very high	94.8	Very high	51 Å²	51	61 Å²	61	27%	0.273	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	8.9	-179.2	72.5	-20.2	0	0	0	114.3	W81 D124 A126 L129	W81-N131 PolarHBondContact NE1-O 3.47Å; D124-N131 PolarHBondContact O-ND2 2.67Å; A126-N131 HydrophobicContact CB-CB 4.33Å; A126-N131 WeakPolarHBondContact CB-OD1 3.49Å; A126-N131 PolarHBondContact N-ND2 3.44Å; A126-N131 PolarHBondContact N-OD1 2.99Å; L129-N131 PolarHBondContact O-N 3Å; L129-N131 VanDerWaalsContact O-N 3.08Å
132	L	96.8	Very high	94.7	Very high	13 Å²	13	61.4 Å²	61.4	7%	0.068	33%	0.332	C	S	.	.	S	Bend	trans	-82	162.1	168.5	-61	-169.1	0	0	0	111.3	L82 I120 I125 L129 K134 W143 L163	L82-L132 HydrophobicContact CD1-CD2 4.36Å; I120-L132 HydrophobicContact CD1-CD2 4.25Å; I120-L132 HydrophobicContact CG2-CD2 3.73Å; I125-L132 HydrophobicContact CG1-CD2 4.2Å; I125-L132 HydrophobicContact CG2-CD2 4.17Å; I125-L132 HydrophobicContact CG2-CG 4.45Å; L129-L132 HydrophobicContact CB-CD1 3.99Å; L129-L132 HydrophobicContact CB-CG 4.24Å; L129-L132 HydrophobicContact CD1-CD1 4.49Å; L129-L132 HydrophobicContact CD2-CD1 4.15Å; L129-L132 HydrophobicContact CG-CD1 4.45Å; L129-L132 WeakPolarHBondContact O-CB 3.17Å; L129-L132 PolarHBondContact O-N 2.91Å; L129-L132 VanDerWaalsContact O-N 3.08Å; L132-K134 PolarHBondContact O-N 3.45Å; L132-W143 HydrophobicContact CB-CH2 4.47Å; L132-W143 HydrophobicContact CB-CZ3 4.47Å; L132-W143 HydrophobicContact CD1-CZ3 4.25Å; L132-L163 HydrophobicContact CD1-CD1 4.08Å
133	P	95.9	Very high	94.7	Very high	12 Å²	12	62.1 Å²	62.1	8%	0.078	33%	0.334	C	S	.	.			trans	-59.2	130.1	174.5	-12.5	21.4	0	0	0	111.3	W81 Y112 V118 W143	W81-P133 HydrophobicContact CD2-CB 4.36Å; W81-P133 HydrophobicContact CD2-CG 3.49Å; W81-P133 VanDerWaalsContact CD2-CG 3.49Å; W81-P133 VanDerWaalsContact CE2-CD 3.48Å; W81-P133 HydrophobicContact CE3-CB 4.33Å; W81-P133 HydrophobicContact CE3-CG 3.73Å; W81-P133 HydrophobicContact CG-CG 4.08Å; W81-P133 HydrophobicContact CH2-CB 3.86Å; W81-P133 HydrophobicContact CH2-CG 4.06Å; W81-P133 HydrophobicContact CZ2-CB 3.89Å; W81-P133 HydrophobicContact CZ2-CG 3.85Å; W81-P133 HydrophobicContact CZ3-CB 4.08Å; W81-P133 HydrophobicContact CZ3-CG 4Å; Y112-P133 HydrophobicContact CD2-CB 3.95Å; Y112-P133 HydrophobicContact CD2-CG 4.08Å; Y112-P133 HydrophobicContact CE1-CB 4.34Å; Y112-P133 HydrophobicContact CE2-CB 3.3Å; Y112-P133 HydrophobicContact CE2-CG 3.49Å; Y112-P133 VanDerWaalsContact CE2-CG 3.49Å; V118-P133 HydrophobicContact CG1-CG 4.48Å; P133-W143 HydrophobicContact CB-CH2 4.16Å; P133-W143 HydrophobicContact CB-CZ2 3.66Å; P133-W143 HydrophobicContact CG-CH2 3.87Å; P133-W143 HydrophobicContact CG-CZ2 3.41Å; P133-W143 VanDerWaalsContact CG-CZ2 3.41Å
134	K	92.6	Very high	94.8	Very high	182 Å²	182	57.1 Å²	57.1	79%	0.791	32%	0.316	S	S	*	.			trans	-94	-21.2	180	-61.9	179.9	-179	179.1	0	113	S130 L132	S130-K134 WeakPolarHBondContact O-CE 3.47Å; L132-K134 PolarHBondContact O-N 3.45Å
135	S	90.6	Very high	94.8	Very high	72 Å²	72	56.3 Å²	56.3	50%	0.503	31%	0.311	S	S	.	.	S	Bend	trans	-71.7	148.3	178.6	-56.5	0	0	0	0	111.1	Y112 R137	Y112-S135 PolarHBondContact OH-O 3.06Å; S135-R137 PolarHBondContact O-N 3.47Å
136	Q	91.4	Very high	94.9	Very high	179 Å²	179	55.6 Å²	55.6	84%	0.836	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-53.4	127.9	176.9	-174.6	173.1	4.8	0	0	110.6	P138	Q136-P138 WeakPolarHBondContact O-CD 3.41Å
137	R	93.8	Very high	95	Very high	77 Å²	77	54.3 Å²	54.3	29%	0.291	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-70.1	125.2	178.5	-179.4	170	67.6	-160.3	-0.3	109.7	S135 Q141 W143 L163 N165	S135-R137 PolarHBondContact O-N 3.47Å; R137-Q141 HydrophobicContact CG-CB 4.09Å; R137-Q141 HydrophobicContact CG-CG 4.22Å; R137-W143 VanDerWaalsContact CD-CD1 3.44Å; R137-L163 PolarHBondContact NH1-O 2.84Å; R137-N165 VanDerWaalsContact CZ-OD1 3.26Å; R137-N165 PolarHBondContact NH1-OD1 3.21Å
138	P	94.1	Very high	95.2	Very high	17 Å²	17	51.2 Å²	51.2	11%	0.11	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-57	142.9	172.5	-23.9	33.1	0	0	0	111.7	Q136 F140 Q141	Q136-P138 WeakPolarHBondContact O-CD 3.41Å; P138-F140 VanDerWaalsContact C-N 3.25Å; P138-F140 HydrophobicContact CB-CD1 3.81Å; P138-F140 HydrophobicContact CB-CE1 3.38Å; P138-F140 HydrophobicContact CB-CE2 4.43Å; P138-F140 HydrophobicContact CB-CG 4.49Å; P138-F140 HydrophobicContact CB-CZ 3.73Å; P138-F140 HydrophobicContact CG-CE1 4.28Å; P138-F140 HydrophobicContact CG-CZ 4.24Å; P138-F140 PolarHBondContact O-N 3.42Å; P138-Q141 HydrophobicContact CB-CB 4.14Å; P138-Q141 HydrophobicContact CG-CB 4.38Å; P138-Q141 WeakPolarHBondContact O-CB 3.41Å; P138-Q141 PolarHBondContact O-N 2.99Å
139	P	92	Very high	95.4	Very high	127 Å²	127	47.5 Å²	47.5	83%	0.825	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-30.6	-175.5	-27.2	35.2	0	0	0	115.1	Q141	P139-Q141 VanDerWaalsContact C-N 3.35Å
140	F	91.8	Very high	95.5	Very high	112 Å²	112	46 Å²	46	49%	0.491	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-19.6	178.4	65.2	-95.7	0	0	0	113.3	S115 P138	S115-F140 WeakPolarHBondContact O-CE2 3.29Å; P138-F140 VanDerWaalsContact C-N 3.25Å; P138-F140 HydrophobicContact CB-CD1 3.81Å; P138-F140 HydrophobicContact CB-CE1 3.38Å; P138-F140 HydrophobicContact CB-CE2 4.43Å; P138-F140 HydrophobicContact CB-CG 4.49Å; P138-F140 HydrophobicContact CB-CZ 3.73Å; P138-F140 HydrophobicContact CG-CE1 4.28Å; P138-F140 HydrophobicContact CG-CZ 4.24Å; P138-F140 PolarHBondContact O-N 3.42Å
141	Q	96.1	Very high	95.6	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.009	22%	0.22	C	C	.	.			trans	-80.6	135.3	-171.4	175.5	174.4	104.1	0	0	111.7	Y112 S115 D116 V118 R137 P138 P139	Y112-Q141 PolarHBondContact O-NE2 3.3Å; S115-Q141 WeakPolarHBondContact O-CG 3.43Å; S115-Q141 PolarHBondContact O-NE2 2.88Å; S115-Q141 PolarHBondContact OG-NE2 3Å; D116-Q141 WeakPolarHBondContact O-CA 3.12Å; V118-Q141 HydrophobicContact CG2-CG 3.94Å; V118-Q141 VanDerWaalsContact CG2-OE1 3.28Å; R137-Q141 HydrophobicContact CG-CB 4.09Å; R137-Q141 HydrophobicContact CG-CG 4.22Å; P138-Q141 HydrophobicContact CB-CB 4.14Å; P138-Q141 HydrophobicContact CG-CB 4.38Å; P138-Q141 WeakPolarHBondContact O-CB 3.41Å; P138-Q141 PolarHBondContact O-N 2.99Å; P139-Q141 VanDerWaalsContact C-N 3.35Å
142	K	97.5	Very high	95.6	Very high	10 Å²	10	45.2 Å²	45.2	4%	0.043	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	124.2	174.5	-63.7	-173.1	178.1	87.9	0	111.2	D116 G117 V118 N165 L166 L353 H356 K357 E358	D116-K142 PolarHBondContact O-N 2.8Å; G117-K142 CarbonylContact C-O 3.57Å; G117-K142 VanDerWaalsContact CA-O 3.28Å; G117-K142 WeakPolarHBondContact CA-O 3.42Å; V118-K142 PolarHBondContact N-O 3.46Å; K142-N165 WeakPolarHBondContact CA-OD1 3.49Å; K142-N165 HydrophobicContact CB-CB 3.85Å; K142-N165 HydrophobicContact CG-CB 4.08Å; K142-L166 HydrophobicContact CB-CD1 4.15Å; K142-L166 HydrophobicContact CB-CG 4.4Å; K142-L166 HydrophobicContact CD-CD1 3.69Å; K142-L166 HydrophobicContact CD-CD2 4.34Å; K142-L166 HydrophobicContact CD-CG 4.01Å; K142-L353 HydrophobicContact CB-CD2 3.8Å; K142-L353 HydrophobicContact CD-CD2 3.8Å; K142-L353 HydrophobicContact CG-CD2 4.2Å; K142-H356 PolarHBondContact NZ-O 2.98Å; K142-K357 PolarHBondContact NZ-O 3.43Å; K142-E358 WeakPolarHBondContact CE-O 3.35Å; K142-E358 PolarHBondContact NZ-O 3.34Å
143	W	97.8	Very high	95.5	Very high	19 Å²	19	46.8 Å²	46.8	7%	0.072	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	128.5	165.7	-73.5	15	0	0	0	109.6	Y112 V118 I120 L132 P133 R137 F164 N165 L166	Y112-W143 HydrophobicContact CE2-CZ2 4.35Å; Y112-W143 AromaticContact CE2-NE1 3.82Å; Y112-W143 WeakPolarHBondContact OH-CZ2 3.26Å; V118-W143 HydrophobicContact CB-CG 4.37Å; V118-W143 WeakPolarHBondContact O-CA 3.29Å; I120-W143 HydrophobicContact CD1-CD2 3.92Å; I120-W143 HydrophobicContact CD1-CE3 3.72Å; I120-W143 HydrophobicContact CD1-CG 4.3Å; I120-W143 HydrophobicContact CD1-CZ3 4.27Å; L132-W143 HydrophobicContact CB-CH2 4.47Å; L132-W143 HydrophobicContact CB-CZ3 4.47Å; L132-W143 HydrophobicContact CD1-CZ3 4.25Å; P133-W143 HydrophobicContact CB-CH2 4.16Å; P133-W143 HydrophobicContact CB-CZ2 3.66Å; P133-W143 HydrophobicContact CG-CH2 3.87Å; P133-W143 HydrophobicContact CG-CZ2 3.41Å; P133-W143 VanDerWaalsContact CG-CZ2 3.41Å; R137-W143 VanDerWaalsContact CD-CD1 3.44Å; W143-F164 HydrophobicContact CB-CD1 3.81Å; W143-F164 HydrophobicContact CB-CE1 4.3Å; W143-F164 HydrophobicContact CE3-CE1 4.37Å; W143-N165 PolarHBondContact N-OD1 2.94Å; W143-N165 PolarHBondContact O-N 2.71Å; W143-L166 PolarHBondContact O-N 3.36Å; W143-L166 VanDerWaalsContact O-N 3.1Å
144	V	98.6	Very high	95.5	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	111.8	-179	-173.8	0	0	0	0	108.3	V118 V119 I120 M146 L166 L168 I176 L353	V118-V144 PolarHBondContact O-N 2.82Å; V119-V144 HydrophobicContact CG2-CB 4.07Å; V119-V144 HydrophobicContact CG2-CG1 4.47Å; V119-V144 HydrophobicContact CG2-CG2 4.38Å; I120-V144 PolarHBondContact N-O 3.46Å; V144-M146 PolarHBondContact O-N 3.26Å; V144-L166 WeakPolarHBondContact CA-O 3.19Å; V144-L166 HydrophobicContact CG1-CB 4.35Å; V144-L166 HydrophobicContact CG2-CB 4.22Å; V144-L166 HydrophobicContact CG2-CD1 4.13Å; V144-L168 HydrophobicContact CG1-CB 3.74Å; V144-L168 HydrophobicContact CG1-CD1 4.46Å; V144-I176 HydrophobicContact CG1-CD1 3.85Å; V144-L353 HydrophobicContact CG2-CD1 4.48Å
145	W	98.4	Very high	95.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	116.1	171.6	-178.8	80.1	0	0	0	108.9	H122 N147 F164 L166 T167 L168 N169 L365 W368 Y369 W370	H122-W145 HydrophobicContact CB-CZ2 3.92Å; H122-W145 AromaticContact CG-CE2 3.9Å; H122-W145 AromaticContact CG-CZ2 3.77Å; H122-W145 AromaticContact CG-NE1 3.53Å; H122-W145 AromaticContact ND1-CE2 3.69Å; H122-W145 AromaticContact ND1-CZ2 3.76Å; H122-W145 AromaticContact ND1-NE1 3.03Å; H122-W145 PolarHBondContact ND1-NE1 3Å; W145-N147 HydrophobicContact CD2-CB 4.42Å; W145-N147 HydrophobicContact CE3-CB 4.27Å; W145-N147 HydrophobicContact CH2-CB 3.33Å; W145-N147 HydrophobicContact CZ2-CB 3.45Å; W145-N147 VanDerWaalsContact CZ2-CB 3.45Å; W145-N147 HydrophobicContact CZ3-CB 3.74Å; W145-F164 HydrophobicContact CB-CB 4Å; W145-F164 HydrophobicContact CB-CD1 3.57Å; W145-F164 HydrophobicContact CB-CD2 3.96Å; W145-F164 HydrophobicContact CB-CE1 3.96Å; W145-F164 HydrophobicContact CB-CE2 4.33Å; W145-F164 HydrophobicContact CB-CG 3.56Å; W145-F164 HydrophobicContact CB-CZ 4.33Å; W145-F164 AromaticContact CD1-CE2 3.71Å; W145-F164 AromaticContact CD1-CZ 3.88Å; W145-F164 HydrophobicContact CG-CD2 4.29Å; W145-F164 HydrophobicContact CG-CE2 4.38Å; W145-F164 HydrophobicContact CG-CG 4.37Å; W145-F164 VanDerWaalsContact N-CD1 3.34Å; W145-L166 PolarHBondContact N-O 2.65Å; W145-T167 HydrophobicContact CE3-CG2 4.14Å; W145-T167 CarbonylContact O-C 3.15Å; W145-T167 WeakPolarHBondContact O-CA 3.18Å; W145-L168 PolarHBondContact O-N 2.91Å; W145-N169 HydrophobicContact CZ3-CB 4.5Å; W145-L365 HydrophobicContact CB-CD2 4.36Å; W145-L365 HydrophobicContact CD2-CD1 4.03Å; W145-L365 HydrophobicContact CD2-CD2 3.87Å; W145-L365 HydrophobicContact CD2-CG 4.48Å; W145-L365 HydrophobicContact CE3-CD1 3.98Å; W145-L365 HydrophobicContact CG-CD1 4.4Å; W145-L365 HydrophobicContact CG-CD2 3.73Å; W145-L365 HydrophobicContact CZ3-CD1 4.37Å; W145-W368 HydrophobicContact CE3-CZ3 4.27Å; W145-W368 HydrophobicContact CH2-CZ3 4.31Å; W145-W368 HydrophobicContact CZ3-CH2 4.24Å; W145-W368 AromaticContact CZ3-CZ3 3.64Å; W145-W368 HydrophobicContact CZ3-CZ3 3.64Å; W145-Y369 AromaticContact CH2-CD1 3.75Å; W145-Y369 HydrophobicContact CH2-CD1 3.75Å; W145-Y369 AromaticContact CH2-CD2 3.74Å; W145-Y369 HydrophobicContact CH2-CD2 3.74Å; W145-Y369 AromaticContact CH2-CE1 3.9Å; W145-Y369 HydrophobicContact CH2-CE1 3.9Å; W145-Y369 AromaticContact CH2-CE2 3.92Å; W145-Y369 HydrophobicContact CH2-CE2 3.92Å; W145-Y369 AromaticContact CH2-CG 3.68Å; W145-Y369 HydrophobicContact CH2-CG 3.68Å; W145-Y369 HydrophobicContact CZ2-CD1 4.2Å; W145-Y369 HydrophobicContact CZ2-CE1 4.42Å; W145-Y369 HydrophobicContact CZ2-CG 4.43Å; W145-Y369 HydrophobicContact CZ3-CD2 4.18Å; W145-Y369 HydrophobicContact CZ3-CE2 4.42Å; W145-Y369 HydrophobicContact CZ3-CG 4.45Å; W145-W370 HydrophobicContact CZ2-CH2 4.31Å
146	M	98.5	Very high	95.7	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	124.6	178.4	179.9	173.5	65.4	0	0	110.5	P84 V119 I120 H121 H122 V144 L148 L168 W342 R345	P84-M146 HydrophobicContact CG-CE 3.49Å; P84-M146 VanDerWaalsContact CG-CE 3.49Å; V119-M146 HydrophobicContact CG1-CB 3.89Å; V119-M146 HydrophobicContact CG1-CE 3.75Å; V119-M146 HydrophobicContact CG1-SD 3.97Å; I120-M146 PolarHBondContact O-N 3.06Å; H121-M146 CarbonylContact C-O 3.51Å; H121-M146 WeakPolarHBondContact CA-O 3.16Å; H121-M146 HydrophobicContact CB-CE 3.95Å; H121-M146 PolarHBondContact CD2-O 3.01Å; H122-M146 PolarHBondContact N-O 3.2Å; V144-M146 PolarHBondContact O-N 3.26Å; M146-L148 HydrophobicContact CG-CD2 3.86Å; M146-L168 WeakPolarHBondContact CA-O 3.26Å; M146-L168 HydrophobicContact CB-CB 4.23Å; M146-L168 HydrophobicContact CG-CB 4.33Å; M146-L168 HydrophobicContact CG-CD1 4.29Å; M146-L168 HydrophobicContact CG-CD2 4.06Å; M146-L168 HydrophobicContact CG-CG 4.46Å; M146-L168 HydrophobicContact SD-CD1 4.05Å; M146-L168 HydrophobicContact SD-CD2 4.34Å; M146-W342 HydrophobicContact CE-CE3 4.36Å; M146-W342 HydrophobicContact SD-CE3 4.29Å; M146-W342 HydrophobicContact SD-CZ3 4.44Å; M146-R345 HydrophobicContact SD-CB 4.45Å
147	N	97.8	Very high	95.8	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.2	C	C	.	.			trans	-151.6	133.1	169.9	-167	20.5	0	0	0	109.7	H122 W145 E149 S154 L168 N169 Y369	H122-N147 HydrophobicContact CB-CB 3.67Å; W145-N147 HydrophobicContact CD2-CB 4.42Å; W145-N147 HydrophobicContact CE3-CB 4.27Å; W145-N147 HydrophobicContact CH2-CB 3.33Å; W145-N147 HydrophobicContact CZ2-CB 3.45Å; W145-N147 VanDerWaalsContact CZ2-CB 3.45Å; W145-N147 HydrophobicContact CZ3-CB 3.74Å; N147-E149 PolarHBondContact ND2-O 3.07Å; N147-E149 PolarHBondContact OD1-N 2.79Å; N147-S154 PolarHBondContact ND2-OG 2.85Å; N147-L168 PolarHBondContact N-O 3.39Å; N147-L168 VanDerWaalsContact N-O 3.13Å; N147-N169 PolarHBondContact O-ND2 2.99Å; N147-Y369 WeakPolarHBondContact ND2-CE1 3.47Å
148	L	96.9	Very high	95.4	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	22%	0.219	C	C	.	.			trans	-116.1	-6.3	178.1	-78	-65.9	0	0	0	112.1	M146 L168 Y170 V178 Y180 W342	M146-L148 HydrophobicContact CG-CD2 3.86Å; L148-L168 HydrophobicContact CD2-CD2 4.1Å; L148-Y170 HydrophobicContact CD1-CD1 4.45Å; L148-Y170 VanDerWaalsContact O-CD1 3.29Å; L148-Y170 WeakPolarHBondContact O-CD1 3.27Å; L148-V178 WeakPolarHBondContact CD1-O 3.49Å; L148-Y180 HydrophobicContact CB-CE2 4.17Å; L148-Y180 HydrophobicContact CD1-CE2 4.31Å; L148-Y180 PolarHBondContact O-OH 3.34Å; L148-W342 HydrophobicContact CB-CH2 4.22Å; L148-W342 HydrophobicContact CB-CZ3 4.34Å; L148-W342 HydrophobicContact CD2-CZ3 3.91Å; L148-W342 HydrophobicContact CG-CH2 4.45Å; L148-W342 HydrophobicContact CG-CZ3 4.09Å
149	E	96.5	Very high	95.1	Very high	33 Å²	33	46.4 Å²	46.4	15%	0.154	25%	0.249	C	C	.	.	S	Bend	trans	-91.2	137.3	176.9	175.1	66.3	-99.8	0	0	110.9	R123 N147 N153 S154 N258 Y264 Y369	R123-E149 IonicContact NH1-OE2 2.8Å; N147-E149 PolarHBondContact ND2-O 3.07Å; N147-E149 PolarHBondContact OD1-N 2.79Å; E149-N153 HydrophobicContact CG-CB 3.37Å; E149-N153 WeakPolarHBondContact OE1-CB 3.1Å; E149-S154 PolarHBondContact O-OG 3.45Å; E149-N258 PolarHBondContact OE1-ND2 2.81Å; E149-Y264 PolarHBondContact OE1-OH 3.4Å; E149-Y369 VanDerWaalsContact C-OH 3.32Å; E149-Y369 PolarHBondContact O-OH 3.09Å
150	S	97	Very high	95.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.21	C	C	.	.			trans	-43.2	155.5	176.2	58.8	0	0	0	0	116.5	S152 N153 S154 S259	S150-S152 VanDerWaalsContact C-N 3.3Å; S150-S152 PolarHBondContact O-N 3.15Å; S150-N153 CarbonylContact O-C 3.48Å; S150-N153 PolarHBondContact O-N 3.36Å; S150-N153 VanDerWaalsContact O-N 3.08Å; S150-N153 WeakPolarHBondContact OG-CB 3.32Å; S150-N153 PolarHBondContact OG-ND2 2.85Å; S150-S154 VanDerWaalsContact O-CB 3.3Å; S150-S154 WeakPolarHBondContact O-CB 3.4Å; S150-S154 PolarHBondContact O-N 2.92Å; S150-S154 VanDerWaalsContact O-N 3.07Å; S150-S154 PolarHBondContact O-OG 3.08Å; S150-S259 WeakPolarHBondContact CB-OG 3.43Å; S150-S259 PolarHBondContact OG-OG 3.18Å
151	P	97	Very high	95.1	Very high	10 Å²	10	37.3 Å²	37.3	7%	0.065	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-55.9	-40.5	174.1	-26.7	33.9	0	0	0	113.4	N153 S154 Y170 Y369 W370	P151-N153 PolarHBondContact O-N 3.31Å; P151-S154 PolarHBondContact O-N 3Å; P151-Y170 WeakPolarHBondContact CD-OH 3.39Å; P151-Y369 HydrophobicContact CB-CD1 4.42Å; P151-Y369 HydrophobicContact CB-CE1 4.19Å; P151-Y369 HydrophobicContact CG-CD1 4.19Å; P151-Y369 HydrophobicContact CG-CE1 3.87Å; P151-Y369 HydrophobicContact CG-CE2 4.23Å; P151-Y369 WeakPolarHBondContact CG-O 3.48Å; P151-W370 HydrophobicContact CB-CG 4.27Å; P151-W370 PolarHBondContact O-NE1 2.97Å
152	S	95.7	Very high	94.9	Very high	84 Å²	84	42.1 Å²	42.1	59%	0.587	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-62.8	-24.4	177.8	-66.7	0	0	0	0	113.8	S150 H261	S150-S152 VanDerWaalsContact C-N 3.3Å; S150-S152 PolarHBondContact O-N 3.15Å; S152-H261 PolarHBondContact N-NE2 3.49Å; S152-H261 PolarHBondContact OG-NE2 3.5Å
153	N	95.2	Very high	94.7	Very high	46 Å²	46	44.1 Å²	44.1	25%	0.246	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-112.1	14	-179.1	-66.1	-78	0	0	0	112.1	R123 E149 S150 P151 N258	R123-N153 PolarHBondContact NH1-O 3.39Å; E149-N153 HydrophobicContact CG-CB 3.37Å; E149-N153 WeakPolarHBondContact OE1-CB 3.1Å; S150-N153 CarbonylContact O-C 3.48Å; S150-N153 PolarHBondContact O-N 3.36Å; S150-N153 VanDerWaalsContact O-N 3.08Å; S150-N153 WeakPolarHBondContact OG-CB 3.32Å; S150-N153 PolarHBondContact OG-ND2 2.85Å; P151-N153 PolarHBondContact O-N 3.31Å; N153-N258 PolarHBondContact ND2-ND2 3.01Å
154	S	95.6	Very high	94.6	Very high	4 Å²	4	43.4 Å²	43.4	3%	0.028	23%	0.233	C	C	.	.	S	Bend	trans	-125.1	110	177.2	-65.4	0	0	0	0	109.1	N147 E149 S150 P151 R156 W370	N147-S154 PolarHBondContact ND2-OG 2.85Å; E149-S154 PolarHBondContact O-OG 3.45Å; S150-S154 VanDerWaalsContact O-CB 3.3Å; S150-S154 WeakPolarHBondContact O-CB 3.4Å; S150-S154 PolarHBondContact O-N 2.92Å; S150-S154 VanDerWaalsContact O-N 3.07Å; S150-S154 PolarHBondContact O-OG 3.08Å; P151-S154 PolarHBondContact O-N 3Å; S154-R156 PolarHBondContact O-N 3.37Å; S154-W370 WeakPolarHBondContact O-CZ2 3.47Å; S154-W370 PolarHBondContact O-NE1 3.5Å
155	G	93.9	Very high	94.6	Very high	56 Å²	56	43.6 Å²	43.6	58%	0.577	23%	0.234	S	C	*	.			trans	-58.1	132.5	177.3	0	0	0	0	0	111.3	H122 W370	H122-G155 PolarHBondContact CE1-O 3.5Å; H122-G155 PolarHBondContact NE2-O 2.91Å; G155-W370 WeakPolarHBondContact O-CZ2 3.34Å
156	R	94.3	Very high	94.5	Very high	152 Å²	152	43.6 Å²	43.6	57%	0.574	23%	0.234	S	C	*	.			trans	-73.2	135.3	177.3	-174.7	178.1	173.5	165.2	-1.1	110.1	S154 N366 W370	S154-R156 PolarHBondContact O-N 3.37Å; R156-N366 WeakPolarHBondContact CG-OD1 3.28Å; R156-W370 HydrophobicContact CB-CD2 4.21Å; R156-W370 HydrophobicContact CB-CZ2 4.37Å; R156-W370 HydrophobicContact CG-CD2 4.17Å; R156-W370 HydrophobicContact CG-CE3 4.29Å
157	L	93.4	Very high	94.5	Very high	23 Å²	23	43.6 Å²	43.6	12%	0.12	23%	0.234	C	C	.	.			trans	-109.6	120.3	177.8	-64.8	176.9	0	0	0	109.6	I125 L129 R159 I160 N366	I125-L157 HydrophobicContact CB-CD1 3.81Å; I125-L157 HydrophobicContact CD1-CD1 4.33Å; I125-L157 HydrophobicContact CG2-CD1 3.55Å; L129-L157 HydrophobicContact CD2-CD1 4.22Å; L157-R159 VanDerWaalsContact C-N 3.31Å; L157-R159 PolarHBondContact O-N 2.73Å; L157-I160 HydrophobicContact CB-CB 4.04Å; L157-I160 HydrophobicContact CB-CD1 4.43Å; L157-I160 HydrophobicContact CB-CG2 4.37Å; L157-I160 HydrophobicContact CD1-CD1 4.14Å; L157-I160 VanDerWaalsContact O-CG2 3.27Å; L157-I160 WeakPolarHBondContact O-CG2 3.44Å; L157-I160 PolarHBondContact O-N 3.17Å; L157-N366 PolarHBondContact O-ND2 3.4Å; L157-N366 PolarHBondContact O-OD1 3.07Å
158	S	85.8	Confident	94.6	Very high	100 Å²	100	43.6 Å²	43.6	70%	0.699	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-35.3	-172	55.6	0	0	0	0	113.3
159	R	88	Confident	94.6	Very high	195 Å²	195	43.6 Å²	43.6	74%	0.736	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.4	16.8	-173.6	-63.8	-177.9	-179.4	-177.8	-0.2	114.6	L129 L157 L163	L129-R159 HydrophobicContact CD1-CB 3.69Å; L157-R159 VanDerWaalsContact C-N 3.31Å; L157-R159 PolarHBondContact O-N 2.73Å; R159-L163 VanDerWaalsContact O-CD1 3.29Å; R159-L163 WeakPolarHBondContact O-CD1 3.42Å
160	I	91.3	Very high	94.6	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.227	C	C	.	.			trans	-86.5	-17.9	-174.4	-154.8	169.3	0	0	0	114.4	I125 L157 L163 F164 L365 N366	I125-I160 HydrophobicContact CD1-CD1 4.01Å; L157-I160 HydrophobicContact CB-CB 4.04Å; L157-I160 HydrophobicContact CB-CD1 4.43Å; L157-I160 HydrophobicContact CB-CG2 4.37Å; L157-I160 HydrophobicContact CD1-CD1 4.14Å; L157-I160 VanDerWaalsContact O-CG2 3.27Å; L157-I160 WeakPolarHBondContact O-CG2 3.44Å; L157-I160 PolarHBondContact O-N 3.17Å; I160-L163 HydrophobicContact CG1-CD1 4.49Å; I160-L163 PolarHBondContact O-N 3.03Å; I160-F164 HydrophobicContact CD1-CD2 4.38Å; I160-F164 HydrophobicContact CD1-CE2 3.73Å; I160-F164 HydrophobicContact CG1-CD2 3.9Å; I160-F164 HydrophobicContact CG1-CE2 3.47Å; I160-F164 VanDerWaalsContact CG1-CE2 3.47Å; I160-L365 HydrophobicContact CD1-CD2 3.79Å; I160-L365 HydrophobicContact CG1-CD2 3.87Å; I160-L365 HydrophobicContact CG2-CB 4.47Å; I160-L365 HydrophobicContact CG2-CD2 4.03Å; I160-N366 WeakPolarHBondContact CG2-OD1 3.47Å
161	N	92.8	Very high	94.7	Very high	49 Å²	49	43.5 Å²	43.5	26%	0.262	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	139.7	179.5	-75	-21.5	0	0	0	110.7	L163 L365 N366	N161-L163 PolarHBondContact O-N 3.07Å; N161-L163 VanDerWaalsContact O-N 3.14Å; N161-L365 PolarHBondContact OD1-N 2.96Å; N161-L365 VanDerWaalsContact OD1-N 3.16Å; N161-N366 WeakPolarHBondContact OD1-CB 3.19Å; N161-N366 PolarHBondContact OD1-N 3.08Å
162	N	91	Very high	94.6	Very high	103 Å²	103	47.9 Å²	47.9	55%	0.551	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.1	4.6	178.4	-46.6	-44.7	0	0	0	115.7
163	L	93.1	Very high	94.7	Very high	52 Å²	52	47 Å²	47	27%	0.272	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-37.1	174.9	-63.7	-172.6	0	0	0	112.3	L129 L132 R137 R159 I160 N161	L129-L163 HydrophobicContact CD1-CD1 3.76Å; L132-L163 HydrophobicContact CD1-CD1 4.08Å; R137-L163 PolarHBondContact NH1-O 2.84Å; R159-L163 VanDerWaalsContact O-CD1 3.29Å; R159-L163 WeakPolarHBondContact O-CD1 3.42Å; I160-L163 HydrophobicContact CG1-CD1 4.49Å; I160-L163 PolarHBondContact O-N 3.03Å; N161-L163 PolarHBondContact O-N 3.07Å; N161-L163 VanDerWaalsContact O-N 3.14Å
164	F	96.4	Very high	94.8	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.018	23%	0.229	C	C	.	.			trans	-98.9	148.6	-170.6	-67.7	-82.7	0	0	0	112.5	I120 I125 W143 W145 I160 F362 L365	I120-F164 HydrophobicContact CB-CE1 3.83Å; I120-F164 HydrophobicContact CB-CZ 4.17Å; I120-F164 HydrophobicContact CD1-CE1 3.59Å; I120-F164 HydrophobicContact CD1-CZ 4.08Å; I120-F164 HydrophobicContact CG1-CE1 4.22Å; I120-F164 HydrophobicContact CG2-CE1 4.28Å; I120-F164 HydrophobicContact CG2-CZ 4.1Å; I125-F164 HydrophobicContact CD1-CE2 4.48Å; I125-F164 HydrophobicContact CD1-CZ 4.09Å; W143-F164 HydrophobicContact CB-CD1 3.81Å; W143-F164 HydrophobicContact CB-CE1 4.3Å; W143-F164 HydrophobicContact CE3-CE1 4.37Å; W145-F164 HydrophobicContact CB-CB 4Å; W145-F164 HydrophobicContact CB-CD1 3.57Å; W145-F164 HydrophobicContact CB-CD2 3.96Å; W145-F164 HydrophobicContact CB-CE1 3.96Å; W145-F164 HydrophobicContact CB-CE2 4.33Å; W145-F164 HydrophobicContact CB-CG 3.56Å; W145-F164 HydrophobicContact CB-CZ 4.33Å; W145-F164 AromaticContact CD1-CE2 3.71Å; W145-F164 AromaticContact CD1-CZ 3.88Å; W145-F164 HydrophobicContact CG-CD2 4.29Å; W145-F164 HydrophobicContact CG-CE2 4.38Å; W145-F164 HydrophobicContact CG-CG 4.37Å; W145-F164 VanDerWaalsContact N-CD1 3.34Å; I160-F164 HydrophobicContact CD1-CD2 4.38Å; I160-F164 HydrophobicContact CD1-CE2 3.73Å; I160-F164 HydrophobicContact CG1-CD2 3.9Å; I160-F164 HydrophobicContact CG1-CE2 3.47Å; I160-F164 VanDerWaalsContact CG1-CE2 3.47Å; F164-F362 WeakPolarHBondContact O-CB 3.43Å; F164-F362 PolarHBondContact O-N 3.05Å; F164-L365 HydrophobicContact CD2-CD2 4.09Å
165	N	97.4	Very high	94.8	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.021	23%	0.234	C	C	.	.	S	Bend	trans	-93.8	-36.7	176	-57.5	90.6	0	0	0	111.3	R137 K142 W143 R360 F362	R137-N165 VanDerWaalsContact CZ-OD1 3.26Å; R137-N165 PolarHBondContact NH1-OD1 3.21Å; K142-N165 WeakPolarHBondContact CA-OD1 3.49Å; K142-N165 HydrophobicContact CB-CB 3.85Å; K142-N165 HydrophobicContact CG-CB 4.08Å; W143-N165 PolarHBondContact N-OD1 2.94Å; W143-N165 PolarHBondContact O-N 2.71Å; N165-R360 WeakPolarHBondContact CB-O 3.39Å; N165-R360 PolarHBondContact ND2-O 3.45Å; N165-F362 PolarHBondContact O-N 3.49Å
166	L	98	Very high	95	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	157.2	-174.1	-57.5	176.2	0	0	0	111.4	K142 W143 V144 W145 D175 I176 Y352 L353 R360	K142-L166 HydrophobicContact CB-CD1 4.15Å; K142-L166 HydrophobicContact CB-CG 4.4Å; K142-L166 HydrophobicContact CD-CD1 3.69Å; K142-L166 HydrophobicContact CD-CD2 4.34Å; K142-L166 HydrophobicContact CD-CG 4.01Å; W143-L166 PolarHBondContact O-N 3.36Å; W143-L166 VanDerWaalsContact O-N 3.1Å; V144-L166 WeakPolarHBondContact CA-O 3.19Å; V144-L166 HydrophobicContact CG1-CB 4.35Å; V144-L166 HydrophobicContact CG2-CB 4.22Å; V144-L166 HydrophobicContact CG2-CD1 4.13Å; W145-L166 PolarHBondContact N-O 2.65Å; L166-D175 WeakPolarHBondContact CA-OD2 3.5Å; L166-D175 HydrophobicContact CB-CB 4.27Å; L166-D175 HydrophobicContact CD2-CB 3.96Å; L166-I176 HydrophobicContact CB-CD1 4.34Å; L166-I176 HydrophobicContact CD1-CD1 4.11Å; L166-Y352 HydrophobicContact CD1-CD1 3.74Å; L166-Y352 HydrophobicContact CD1-CE1 3.63Å; L166-Y352 HydrophobicContact CD2-CE1 3.65Å; L166-Y352 HydrophobicContact CG-CE1 4.3Å; L166-L353 HydrophobicContact CD1-CD2 3.73Å; L166-L353 HydrophobicContact CD1-CG 4.47Å; L166-R360 HydrophobicContact CD2-CB 4.44Å; L166-R360 HydrophobicContact CD2-CG 4.16Å
167	T	98.2	Very high	95.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	131	173.4	52.1	0	0	0	0	110.6	W145 S174 D175 I176 F362 L365 W368	W145-T167 HydrophobicContact CE3-CG2 4.14Å; W145-T167 CarbonylContact O-C 3.15Å; W145-T167 WeakPolarHBondContact O-CA 3.18Å; T167-S174 WeakPolarHBondContact OG1-CA 3.2Å; T167-S174 WeakPolarHBondContact OG1-CB 3.35Å; T167-D175 PolarHBondContact N-OD2 3.49Å; T167-D175 PolarHBondContact O-N 3.01Å; T167-D175 PolarHBondContact OG1-N 3.38Å; T167-D175 PolarHBondContact OG1-OD2 2.73Å; T167-I176 PolarHBondContact O-N 3.29Å; T167-F362 HydrophobicContact CG2-CD1 4.23Å; T167-F362 HydrophobicContact CG2-CD2 3.65Å; T167-F362 HydrophobicContact CG2-CE1 4.25Å; T167-F362 HydrophobicContact CG2-CE2 3.63Å; T167-F362 HydrophobicContact CG2-CG 3.95Å; T167-F362 HydrophobicContact CG2-CZ 3.95Å; T167-L365 HydrophobicContact CG2-CD1 3.68Å; T167-W368 HydrophobicContact CG2-CE3 4.41Å; T167-W368 HydrophobicContact CG2-CH2 4.22Å; T167-W368 HydrophobicContact CG2-CZ3 3.94Å
168	L	98.5	Very high	95.3	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	107	169.9	-167.3	176	0	0	0	108.2	V144 W145 M146 N147 L148 I176 V178 R345 A349	V144-L168 HydrophobicContact CG1-CB 3.74Å; V144-L168 HydrophobicContact CG1-CD1 4.46Å; W145-L168 PolarHBondContact O-N 2.91Å; M146-L168 WeakPolarHBondContact CA-O 3.26Å; M146-L168 HydrophobicContact CB-CB 4.23Å; M146-L168 HydrophobicContact CG-CB 4.33Å; M146-L168 HydrophobicContact CG-CD1 4.29Å; M146-L168 HydrophobicContact CG-CD2 4.06Å; M146-L168 HydrophobicContact CG-CG 4.46Å; M146-L168 HydrophobicContact SD-CD1 4.05Å; M146-L168 HydrophobicContact SD-CD2 4.34Å; N147-L168 PolarHBondContact N-O 3.39Å; N147-L168 VanDerWaalsContact N-O 3.13Å; L148-L168 HydrophobicContact CD2-CD2 4.1Å; L168-I176 WeakPolarHBondContact CA-O 3.11Å; L168-I176 HydrophobicContact CB-CB 4.22Å; L168-I176 HydrophobicContact CD1-CG2 4.47Å; L168-I176 HydrophobicContact CG-CB 4.14Å; L168-I176 HydrophobicContact CG-CG2 3.97Å; L168-V178 HydrophobicContact CD2-CB 4.11Å; L168-V178 HydrophobicContact CD2-CG2 3.99Å; L168-V178 HydrophobicContact CG-CG2 4.36Å; L168-R345 HydrophobicContact CD1-CB 4.43Å; L168-R345 WeakPolarHBondContact CD1-O 3.18Å; L168-R345 HydrophobicContact CD2-CB 4.24Å; L168-R345 HydrophobicContact CD2-CG 4.44Å; L168-A349 HydrophobicContact CD1-CB 3.89Å
169	N	98	Very high	95.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	167.7	-167.7	-166.6	-91.4	0	0	0	112.1	W145 N147 R171 S174 I176 V178 W368 Y369	W145-N169 HydrophobicContact CZ3-CB 4.5Å; N147-N169 PolarHBondContact O-ND2 2.99Å; N169-R171 VanDerWaalsContact C-N 3.32Å; N169-R171 WeakPolarHBondContact OD1-CB 3.44Å; N169-R171 WeakPolarHBondContact OD1-CG 3.47Å; N169-R171 PolarHBondContact OD1-N 3.25Å; N169-S174 PolarHBondContact O-OG 3.29Å; N169-I176 PolarHBondContact N-O 3.27Å; N169-V178 PolarHBondContact O-N 2.87Å; N169-W368 HydrophobicContact CB-CH2 3.94Å; N169-Y369 WeakPolarHBondContact ND2-CE2 3.37Å
170	Y	97.2	Very high	96.2	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.008	14%	0.135	C	C	.	.	S	Bend	trans	-76.2	-16.1	173.6	61.2	-98.8	0	0	0	113	L148 P151 H177 D263 Y264 Y369	L148-Y170 HydrophobicContact CD1-CD1 4.45Å; L148-Y170 VanDerWaalsContact O-CD1 3.29Å; L148-Y170 WeakPolarHBondContact O-CD1 3.27Å; P151-Y170 WeakPolarHBondContact CD-OH 3.39Å; Y170-H177 PolarHBondContact O-CE1 3.16Å; Y170-H177 PolarHBondContact O-ND1 3.38Å; Y170-D263 HydrophobicContact CD2-CB 4.43Å; Y170-D263 WeakPolarHBondContact CD2-O 3.05Å; Y170-Y264 AromaticContact CD1-CD2 3.95Å; Y170-Y264 HydrophobicContact CD1-CD2 3.95Å; Y170-Y264 HydrophobicContact CD1-CE2 4.45Å; Y170-Y264 HydrophobicContact CD2-CD2 4.18Å; Y170-Y264 AromaticContact CE1-CD2 3.6Å; Y170-Y264 HydrophobicContact CE1-CD2 3.6Å; Y170-Y264 HydrophobicContact CE1-CE2 4.17Å; Y170-Y264 AromaticContact CE2-CD2 3.84Å; Y170-Y264 HydrophobicContact CE2-CD2 3.84Å; Y170-Y264 HydrophobicContact CE2-CG 4.22Å; Y170-Y264 HydrophobicContact CG-CD2 4.25Å; Y170-Y264 AromaticContact CZ-CD2 3.56Å; Y170-Y369 HydrophobicContact CE1-CE2 4.41Å; Y170-Y369 WeakPolarHBondContact CE1-OH 3.46Å; Y170-Y369 PolarHBondContact OH-OH 3.48Å
171	R	97.1	Very high	96.4	Very high	30 Å²	30	27.7 Å²	27.7	11%	0.113	14%	0.135	C	C	.	.	S	Bend	trans	-71.4	140.9	178.3	-73.3	175.4	56.8	160.9	-3.3	111.5	N169 D173 S174 H177 D263 W368	N169-R171 VanDerWaalsContact C-N 3.32Å; N169-R171 WeakPolarHBondContact OD1-CB 3.44Å; N169-R171 WeakPolarHBondContact OD1-CG 3.47Å; N169-R171 PolarHBondContact OD1-N 3.25Å; R171-D173 WeakPolarHBondContact CB-OD1 3.19Å; R171-D173 IonicContact CZ-OD1 3.87Å; R171-D173 IonicContact CZ-OD2 3.93Å; R171-D173 IonicContact NE-OD1 2.86Å; R171-D173 PolarHBondContact NE-OD1 3.5Å; R171-D173 IonicContact NE-OD2 3.82Å; R171-D173 IonicContact NH2-OD1 3.75Å; R171-D173 PolarHBondContact NH2-OD1 2.94Å; R171-D173 VanDerWaalsContact NH2-OD1 3.14Å; R171-D173 IonicContact NH2-OD2 2.71Å; R171-D173 PolarHBondContact NH2-OD2 3.44Å; R171-D173 PolarHBondContact O-N 3.5Å; R171-S174 WeakPolarHBondContact O-CB 3.25Å; R171-S174 PolarHBondContact O-N 2.93Å; R171-S174 PolarHBondContact O-OG 3.2Å; R171-H177 VanDerWaalsContact C-ND1 3.28Å; R171-H177 PolarHBondContact O-ND1 3Å; R171-D263 HydrophobicContact CG-CB 4.32Å; R171-W368 HydrophobicContact CB-CZ2 4.12Å; R171-W368 PolarHBondContact NH1-O 3.43Å
172	R	96.5	Very high	96.6	Very high	102 Å²	102	27.1 Å²	27.1	39%	0.385	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-25.3	179.5	-71.3	-179.8	-65.8	164.7	-5.8	113.1	S174 D263 N291 F292	R172-S174 VanDerWaalsContact C-N 3.27Å; R172-S174 PolarHBondContact O-N 3.17Å; R172-D263 IonicContact CZ-OD1 3.56Å; R172-D263 PolarHBondContact N-OD2 3.32Å; R172-D263 IonicContact NE-OD1 3.21Å; R172-D263 PolarHBondContact NE-OD1 3.44Å; R172-D263 IonicContact NE-OD2 3.49Å; R172-D263 IonicContact NH2-OD1 3.32Å; R172-D263 PolarHBondContact NH2-OD1 2.71Å; R172-N291 VanDerWaalsContact NH1-CB 3.33Å; R172-N291 VanDerWaalsContact NH1-CG 3.29Å; R172-N291 PolarHBondContact NH1-OD1 3.05Å; R172-N291 PolarHBondContact NH2-OD1 3.1Å; R172-F292 VanDerWaalsContact CD-CZ 3.45Å; R172-F292 HydrophobicContact CG-CE1 3.73Å; R172-F292 HydrophobicContact CG-CZ 3.57Å
173	D	96.4	Very high	96.9	Very high	66 Å²	66	23.8 Å²	23.8	35%	0.353	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	17.2	178	60.1	17.5	0	0	0	113.6	R171 K262 W368	R171-D173 WeakPolarHBondContact CB-OD1 3.19Å; R171-D173 IonicContact CZ-OD1 3.87Å; R171-D173 IonicContact CZ-OD2 3.93Å; R171-D173 IonicContact NE-OD1 2.86Å; R171-D173 PolarHBondContact NE-OD1 3.5Å; R171-D173 IonicContact NE-OD2 3.82Å; R171-D173 IonicContact NH2-OD1 3.75Å; R171-D173 PolarHBondContact NH2-OD1 2.94Å; R171-D173 VanDerWaalsContact NH2-OD1 3.14Å; R171-D173 IonicContact NH2-OD2 2.71Å; R171-D173 PolarHBondContact NH2-OD2 3.44Å; R171-D173 PolarHBondContact O-N 3.5Å; D173-K262 IonicContact OD2-NZ 3.23Å; D173-K262 PolarHBondContact OD2-NZ 2.75Å; D173-W368 PolarHBondContact OD1-NE1 3.35Å; D173-W368 VanDerWaalsContact OD1-NE1 3.08Å
174	S	97.3	Very high	97	Very high	14 Å²	14	23.6 Å²	23.6	10%	0.098	12%	0.117	C	C	.	.	S	Bend	trans	-85.9	159.6	169.8	63	0	0	0	0	111.9	T167 N169 R171 R172 I176 H177	T167-S174 WeakPolarHBondContact OG1-CA 3.2Å; T167-S174 WeakPolarHBondContact OG1-CB 3.35Å; N169-S174 PolarHBondContact O-OG 3.29Å; R171-S174 WeakPolarHBondContact O-CB 3.25Å; R171-S174 PolarHBondContact O-N 2.93Å; R171-S174 PolarHBondContact O-OG 3.2Å; R172-S174 VanDerWaalsContact C-N 3.27Å; R172-S174 PolarHBondContact O-N 3.17Å; S174-I176 PolarHBondContact OG-O 2.9Å; S174-H177 WeakPolarHBondContact OG-CA 3.19Å; S174-H177 PolarHBondContact OG-N 3.08Å
175	D	97.1	Very high	96.9	Very high	24 Å²	24	26.6 Å²	26.6	13%	0.128	14%	0.143	C	C	.	.	S	Bend	trans	-65.9	-41.6	179	-53.7	-78.3	0	0	0	111.3	L166 T167 Y352 R360 F362	L166-D175 WeakPolarHBondContact CA-OD2 3.5Å; L166-D175 HydrophobicContact CB-CB 4.27Å; L166-D175 HydrophobicContact CD2-CB 3.96Å; T167-D175 PolarHBondContact N-OD2 3.49Å; T167-D175 PolarHBondContact O-N 3.01Å; T167-D175 PolarHBondContact OG1-N 3.38Å; T167-D175 PolarHBondContact OG1-OD2 2.73Å; D175-Y352 WeakPolarHBondContact O-CE2 3.14Å; D175-R360 IonicContact OD1-CZ 2.71Å; D175-R360 IonicContact OD1-NE 3.05Å; D175-R360 PolarHBondContact OD1-NE 3.37Å; D175-R360 IonicContact OD1-NH2 3.75Å; D175-R360 PolarHBondContact OD1-NH2 2.93Å; D175-F362 WeakPolarHBondContact OD2-CD2 3.29Å
176	I	98	Very high	96.5	Very high	7 Å²	7	27.9 Å²	27.9	4%	0.036	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	88.3	179	-53.2	158.6	0	0	0	107.8	V144 L166 T167 L168 N169 S174 V178 H348 A349 Y352	V144-I176 HydrophobicContact CG1-CD1 3.85Å; L166-I176 HydrophobicContact CB-CD1 4.34Å; L166-I176 HydrophobicContact CD1-CD1 4.11Å; T167-I176 PolarHBondContact O-N 3.29Å; L168-I176 WeakPolarHBondContact CA-O 3.11Å; L168-I176 HydrophobicContact CB-CB 4.22Å; L168-I176 HydrophobicContact CD1-CG2 4.47Å; L168-I176 HydrophobicContact CG-CB 4.14Å; L168-I176 HydrophobicContact CG-CG2 3.97Å; N169-I176 PolarHBondContact N-O 3.27Å; S174-I176 PolarHBondContact OG-O 2.9Å; I176-V178 HydrophobicContact CG2-CG2 4Å; I176-V178 PolarHBondContact O-N 3.43Å; I176-H348 HydrophobicContact CG2-CB 4.28Å; I176-A349 HydrophobicContact CD1-CB 4.19Å; I176-Y352 HydrophobicContact CD1-CD1 4.15Å; I176-Y352 HydrophobicContact CD1-CG 4.12Å; I176-Y352 HydrophobicContact CG1-CD1 3.91Å; I176-Y352 HydrophobicContact CG1-CD2 3.74Å; I176-Y352 HydrophobicContact CG1-CE1 4.45Å; I176-Y352 HydrophobicContact CG1-CE2 4.29Å; I176-Y352 HydrophobicContact CG1-CG 3.53Å
177	H	97.3	Very high	95.9	Very high	70 Å²	70	34.5 Å²	34.5	32%	0.324	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	113.3	179.1	177.6	60.7	0	0	0	111.1	Y170 R171 S174	Y170-H177 PolarHBondContact O-CE1 3.16Å; Y170-H177 PolarHBondContact O-ND1 3.38Å; R171-H177 VanDerWaalsContact C-ND1 3.28Å; R171-H177 PolarHBondContact O-ND1 3Å; S174-H177 WeakPolarHBondContact OG-CA 3.19Å; S174-H177 PolarHBondContact OG-N 3.08Å
178	V	96.4	Very high	95.2	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.012	21%	0.213	C	C	.	.			trans	-132.9	92.3	174.2	-167.3	0	0	0	0	109.1	L148 L168 N169 I176 I339 R345 H348	L148-V178 WeakPolarHBondContact CD1-O 3.49Å; L168-V178 HydrophobicContact CD2-CB 4.11Å; L168-V178 HydrophobicContact CD2-CG2 3.99Å; L168-V178 HydrophobicContact CG-CG2 4.36Å; N169-V178 PolarHBondContact O-N 2.87Å; I176-V178 HydrophobicContact CG2-CG2 4Å; I176-V178 PolarHBondContact O-N 3.43Å; V178-I339 HydrophobicContact CG1-CD1 4.04Å; V178-I339 HydrophobicContact CG1-CG2 3.77Å; V178-R345 HydrophobicContact CB-CG 4.16Å; V178-R345 HydrophobicContact CG1-CG 3.63Å; V178-H348 HydrophobicContact CG2-CB 3.76Å
179	P	95.5	Very high	94.5	Very high	15 Å²	15	42.6 Å²	42.6	10%	0.097	24%	0.239	C	C	.	.			trans	-72.5	-175.8	-179.9	31.4	-34.9	0	0	0	111.6	G181 I339 R345	P179-G181 VanDerWaalsContact C-N 3.29Å; P179-G181 VanDerWaalsContact CG-O 3.32Å; P179-G181 WeakPolarHBondContact CG-O 3.46Å; P179-I339 HydrophobicContact CG-CD1 4.37Å; P179-I339 WeakPolarHBondContact O-CB 3.35Å; P179-R345 PolarHBondContact O-NH2 3.22Å
180	Y	96.9	Very high	93.6	Very high	38 Å²	38	48.7 Å²	48.7	15%	0.149	27%	0.267	C	S	.	.	S	Bend	trans	-79.5	-13.8	174.8	-76.4	-101.1	0	0	0	113.4	L148 T266 E267 I339	L148-Y180 HydrophobicContact CB-CE2 4.17Å; L148-Y180 HydrophobicContact CD1-CE2 4.31Å; L148-Y180 PolarHBondContact O-OH 3.34Å; Y180-T266 HydrophobicContact CD2-CG2 4.05Å; Y180-T266 HydrophobicContact CE2-CG2 3.86Å; Y180-T266 HydrophobicContact CG-CG2 4.48Å; Y180-E267 HydrophobicContact CD1-CB 4.46Å; Y180-E267 WeakPolarHBondContact CD1-OE2 3.3Å; Y180-E267 WeakPolarHBondContact CE1-OE2 3.49Å; Y180-I339 PolarHBondContact O-N 3.42Å
181	G	96.4	Very high	92.8	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.7	176.2	177.4	0	0	0	0	0	110.8	P179 Y270 Y337	P179-G181 VanDerWaalsContact C-N 3.29Å; P179-G181 VanDerWaalsContact CG-O 3.32Å; P179-G181 WeakPolarHBondContact CG-O 3.46Å; G181-Y270 VanDerWaalsContact C-CE1 3.44Å; G181-Y270 VanDerWaalsContact C-CZ 3.45Å; G181-Y270 PolarHBondContact O-OH 2.65Å; G181-Y337 CarbonylContact C-O 3.55Å; G181-Y337 WeakPolarHBondContact CA-O 3.42Å
182	S	96.1	Very high	92.4	Very high	37 Å²	37	56.3 Å²	56.3	26%	0.259	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	162	177.8	58.3	0	0	0	0	110.9	Y337	S182-Y337 PolarHBondContact N-O 3.08Å; S182-Y337 PolarHBondContact O-N 2.9Å
183	I	96.3	Very high	92.2	Very high	33 Å²	33	57.2 Å²	57.2	17%	0.169	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	120.9	169.1	-57.8	-57.9	0	0	0	106.9	L273 V293 W330 F334 V336	I183-L273 HydrophobicContact CD1-CD1 4.38Å; I183-V293 HydrophobicContact CD1-CG1 4.1Å; I183-V293 HydrophobicContact CG1-CB 4.2Å; I183-V293 HydrophobicContact CG1-CG1 3.73Å; I183-W330 HydrophobicContact CD1-CH2 4.18Å; I183-W330 HydrophobicContact CD1-CZ3 3.94Å; I183-W330 HydrophobicContact CG2-CE3 4.41Å; I183-W330 HydrophobicContact CG2-CZ3 4.33Å; I183-F334 HydrophobicContact CG2-CB 3.35Å; I183-F334 HydrophobicContact CG2-CD1 4.03Å; I183-F334 HydrophobicContact CG2-CD2 4.41Å; I183-F334 HydrophobicContact CG2-CG 3.7Å; I183-V336 HydrophobicContact CD1-CG2 3.98Å
184	V	95.4	Very high	92	Very high	47 Å²	47	55 Å²	55	29%	0.285	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	155	-177.4	-58.1	0	0	0	0	109.7	A186 F334 K335	V184-A186 PolarHBondContact O-N 3.41Å; V184-F334 CarbonylContact O-C 3.6Å; V184-F334 WeakPolarHBondContact O-CA 3.35Å; V184-F334 WeakPolarHBondContact O-CB 3.48Å; V184-K335 HydrophobicContact CG2-CD 4.21Å; V184-K335 HydrophobicContact CG2-CG 3.46Å; V184-K335 VanDerWaalsContact CG2-CG 3.46Å; V184-K335 PolarHBondContact N-O 3.39Å; V184-K335 PolarHBondContact O-N 2.9Å
185	A	94.8	Very high	91.8	Very high	68 Å²	68	56.7 Å²	56.7	56%	0.562	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.8	138.8	176.2	0	0	0	0	0	110.9	K335	A185-K335 WeakPolarHBondContact O-CE 3.37Å
186	A	90.1	Very high	91.7	Very high	30 Å²	30	61 Å²	61	25%	0.248	36%	0.356	C	S	.	.			trans	-77.1	145.7	169	0	0	0	0	0	109.5	V184 T188 H333	V184-A186 PolarHBondContact O-N 3.41Å; A186-T188 VanDerWaalsContact C-N 3.32Å; A186-T188 WeakPolarHBondContact CB-O 3.4Å; A186-H333 PolarHBondContact N-O 2.73Å
187	D	85.4	Confident	91.7	Very high	139 Å²	139	62.4 Å²	62.4	74%	0.743	36%	0.362	S	S	*	.	S	Bend	trans	-75.9	-28.1	180	-48	-55.1	0	0	0	111.1	K335	D187-K335 IonicContact OD1-NZ 2.66Å; D187-K335 IonicContact OD2-NZ 3.55Å; D187-K335 PolarHBondContact OD2-NZ 2.88Å
188	T	83.4	Confident	91.7	Very high	81 Å²	81	65 Å²	65	50%	0.497	38%	0.378	S	S	.	.	S	Bend	trans	-128	149.8	177.7	57.9	0	0	0	0	110.7	A186 E190	A186-T188 VanDerWaalsContact C-N 3.32Å; A186-T188 WeakPolarHBondContact CB-O 3.4Å; T188-E190 PolarHBondContact OG1-OE1 2.85Å
189	V	82.6	Confident	91.8	Very high	90 Å²	90	67 Å²	67	55%	0.545	39%	0.387	S	S	.	.			trans	-91.9	101.8	174.2	177.5	0	0	0	0	107.8	R332	V189-R332 HydrophobicContact CG1-CG 3.55Å; V189-R332 VanDerWaalsContact CG1-NE 3.29Å
190	E	79.5	Confident	91.9	Very high	127 Å²	127	67.7 Å²	67.7	59%	0.593	39%	0.389	S	S	*	.			trans	-128.6	145.6	-179.5	-72.4	173.7	-149.4	0	0	110.9	T188 F192	T188-E190 PolarHBondContact OG1-OE1 2.85Å; E190-F192 PolarHBondContact O-N 2.61Å
191	D	81.3	Confident	92	Very high	137 Å²	137	65.9 Å²	65.9	73%	0.733	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-73.3	117	173.5	-71.9	-32.5	0	0	0	109.3	V193	D191-V193 PolarHBondContact O-N 3.34Å
192	F	88.6	Confident	92.1	Very high	56 Å²	56	65.9 Å²	65.9	25%	0.246	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-79.7	122.2	177.5	176.7	-105.7	0	0	0	111.3	E190 P194 F328 R331	E190-F192 PolarHBondContact O-N 2.61Å; F192-P194 HydrophobicContact CE1-CB 3.86Å; F192-P194 HydrophobicContact CZ-CB 4.47Å; F192-F328 HydrophobicContact CD1-CB 3.86Å; F192-F328 HydrophobicContact CD1-CD1 4.03Å; F192-F328 HydrophobicContact CD1-CG 4Å; F192-F328 HydrophobicContact CE1-CB 4.43Å; F192-F328 AromaticContact CE1-CD1 3.73Å; F192-F328 HydrophobicContact CE1-CD1 3.73Å; F192-F328 HydrophobicContact CE1-CE1 4.19Å; F192-F328 HydrophobicContact CE1-CG 4.09Å; F192-R331 HydrophobicContact CB-CB 3.75Å; F192-R331 HydrophobicContact CD1-CB 4.48Å; F192-R331 VanDerWaalsContact CD1-CD 3.41Å; F192-R331 VanDerWaalsContact CD2-CZ 3.45Å; F192-R331 HydrophobicContact CG-CB 4.14Å; F192-R331 VanDerWaalsContact CG-NH1 3.29Å
193	V	90.5	Very high	92.2	Very high	120 Å²	120	64.3 Å²	64.3	73%	0.727	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-98.8	116	168.6	-176.3	0	0	0	0	108.7	D191	D191-V193 PolarHBondContact O-N 3.34Å
194	P	92.9	Very high	92.3	Very high	21 Å²	21	64 Å²	64	14%	0.136	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-62.6	146.8	174.7	26	-32.9	0	0	0	110.5	F192 Y324 L325 F328	F192-P194 HydrophobicContact CE1-CB 3.86Å; F192-P194 HydrophobicContact CZ-CB 4.47Å; P194-Y324 HydrophobicContact CG-CE1 4.4Å; P194-L325 HydrophobicContact CG-CD2 3.66Å; P194-F328 HydrophobicContact CB-CD2 4.32Å; P194-F328 HydrophobicContact CB-CE2 3.92Å; P194-F328 HydrophobicContact CB-CZ 4.01Å; P194-F328 HydrophobicContact CG-CD2 4.06Å; P194-F328 HydrophobicContact CG-CE2 3.89Å; P194-F328 HydrophobicContact CG-CZ 4.48Å
195	P	94.2	Very high	92.3	Very high	48 Å²	48	62 Å²	62	31%	0.312	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-63.6	162	178	27.8	-33.9	0	0	0	111	K197 S248 M275	P195-K197 WeakPolarHBondContact O-CD 3.42Å; P195-K197 WeakPolarHBondContact O-CE 3.47Å; P195-K197 WeakPolarHBondContact O-CG 3.44Å; P195-K197 PolarHBondContact O-N 2.87Å; P195-S248 VanDerWaalsContact CG-OG 3.27Å; P195-S248 WeakPolarHBondContact CG-OG 3.36Å; P195-M275 WeakPolarHBondContact CG-O 3.42Å
196	S	94.6	Very high	92.1	Very high	114 Å²	114	61.6 Å²	61.6	80%	0.797	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-55.1	132.2	178.9	-176.4	0	0	0	0	111.9
197	K	97.3	Very high	92.2	Very high	37 Å²	37	63.7 Å²	63.7	16%	0.161	36%	0.357	C	S	.	.			trans	-113.1	125.4	-176.4	-51.3	-55.8	-171.7	169	0	110	P195 S248 S249 C250 K251 G276 T277 Y324	P195-K197 WeakPolarHBondContact O-CD 3.42Å; P195-K197 WeakPolarHBondContact O-CE 3.47Å; P195-K197 WeakPolarHBondContact O-CG 3.44Å; P195-K197 PolarHBondContact O-N 2.87Å; K197-S248 VanDerWaalsContact CD-O 3.26Å; K197-S248 WeakPolarHBondContact CD-O 3.29Å; K197-S248 PolarHBondContact NZ-O 2.88Å; K197-S249 CarbonylContact C-O 3.36Å; K197-S249 WeakPolarHBondContact CA-O 3.35Å; K197-C250 WeakPolarHBondContact CD-O 3.41Å; K197-C250 PolarHBondContact NZ-O 2.95Å; K197-K251 HydrophobicContact CB-CG 3.67Å; K197-K251 HydrophobicContact CG-CG 3.9Å; K197-G276 WeakPolarHBondContact CE-O 3.41Å; K197-G276 PolarHBondContact NZ-O 3.47Å; K197-T277 PolarHBondContact NZ-OG1 2.01Å; K197-Y324 WeakPolarHBondContact CE-OH 3.43Å
198	N	96.9	Very high	92.6	Very high	124 Å²	124	61.3 Å²	61.3	66%	0.663	34%	0.338	S	S	*	.			trans	-123.6	0.6	177.5	69.4	4.1	0	0	0	113.7	S249	N198-S249 PolarHBondContact N-O 3.4Å; N198-S249 WeakPolarHBondContact OD1-CB 3.36Å; N198-S249 PolarHBondContact OD1-O 3.37Å
199	K	98.1	Very high	93.1	Very high	46 Å²	46	58.9 Å²	58.9	20%	0.2	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	140.6	175	-69.9	167.9	-160.6	136.5	0	109.2	Q228 Y230 S249 C250 K251	K199-Q228 HydrophobicContact CD-CB 4.45Å; K199-Q228 HydrophobicContact CD-CG 4.21Å; K199-Q228 HydrophobicContact CG-CG 4.16Å; K199-Y230 WeakPolarHBondContact CE-OH 2.94Å; K199-S249 PolarHBondContact N-O 2.88Å; K199-S249 VanDerWaalsContact N-O 3.08Å; K199-S249 PolarHBondContact NZ-OG 3.25Å; K199-C250 HydrophobicContact CB-CB 4.25Å; K199-C250 CarbonylContact O-C 3.47Å; K199-C250 VanDerWaalsContact O-CA 3.27Å; K199-C250 WeakPolarHBondContact O-CA 3.31Å; K199-K251 PolarHBondContact O-N 3.32Å
200	L	98.4	Very high	93.6	Very high	29 Å²	29	58.5 Å²	58.5	15%	0.152	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	-63.7	-178.7	-177.8	55.6	0	0	0	111	I225 K251 F252 L315 D318	L200-I225 HydrophobicContact CD2-CD1 3.76Å; L200-I225 HydrophobicContact CD2-CG1 4Å; L200-I225 HydrophobicContact CG-CD1 4.29Å; L200-K251 HydrophobicContact CD1-CD 4.29Å; L200-K251 PolarHBondContact O-N 3.15Å; L200-F252 HydrophobicContact CD1-CD2 3.85Å; L200-F252 HydrophobicContact CD1-CE2 3.8Å; L200-F252 WeakPolarHBondContact O-CD2 3.48Å; L200-F252 PolarHBondContact O-N 3.27Å; L200-L315 HydrophobicContact CD2-CD2 3.77Å; L200-D318 HydrophobicContact CD1-CB 3.68Å
201	V	98.8	Very high	94.4	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	130.3	-179.5	-170.3	0	0	0	0	110.1	I225 I227 Q228 F252 L254 L314	V201-I225 HydrophobicContact CG2-CD1 3.64Å; V201-I225 HydrophobicContact CG2-CG1 4.18Å; V201-I227 HydrophobicContact CB-CG1 4.25Å; V201-I227 HydrophobicContact CG1-CG1 4.16Å; V201-I227 HydrophobicContact CG1-CG2 4.17Å; V201-I227 CarbonylContact O-C 3.59Å; V201-I227 WeakPolarHBondContact O-CA 3.3Å; V201-Q228 PolarHBondContact O-N 2.74Å; V201-Q228 PolarHBondContact O-OE1 2.75Å; V201-F252 WeakPolarHBondContact CA-O 3.49Å; V201-F252 HydrophobicContact CG2-CB 4.3Å; V201-F252 HydrophobicContact CG2-CD2 4.44Å; V201-L254 HydrophobicContact CG1-CD1 4.39Å; V201-L254 HydrophobicContact CG1-CD2 3.69Å; V201-L254 HydrophobicContact CG1-CG 3.78Å; V201-L314 HydrophobicContact CG2-CD1 3.96Å
202	C	98.7	Very high	95	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	151.7	176	-63.8	0	0	0	0	112.8	Q228 C250 F252 Y253 L254	C202-Q228 CarbonylContact C-O 3.55Å; C202-Q228 VanDerWaalsContact CA-O 3.31Å; C202-Q228 WeakPolarHBondContact CA-O 3.09Å; C202-C250 HydrophobicContact CB-CB 3.69Å; C202-C250 WeakPolarHBondContact CB-SG 3.45Å; C202-C250 WeakPolarHBondContact SG-CB 3.35Å; C202-C250 CovalentContact SG-SG 2.01Å; C202-C250 PolarHBondContact SG-SG 2.78Å; C202-F252 PolarHBondContact N-O 2.86Å; C202-Y253 HydrophobicContact CB-CD2 4.19Å; C202-Y253 WeakPolarHBondContact O-CA 3.38Å; C202-L254 PolarHBondContact O-N 3.07Å
203	W	98.4	Very high	95.4	Very high	4 Å²	4	54.7 Å²	54.7	2%	0.015	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	127.7	172.8	-165.4	33.1	0	0	0	111.7	V205 W208 R214 Y218 I227 Q228 T229 Y230 F234 L254 F256	W203-V205 HydrophobicContact CD2-CG2 3.26Å; W203-V205 HydrophobicContact CE3-CG2 3.74Å; W203-V205 HydrophobicContact CG-CG2 3.73Å; W203-V205 HydrophobicContact CH2-CG2 3.94Å; W203-V205 HydrophobicContact CZ2-CG2 3.48Å; W203-V205 VanDerWaalsContact CZ2-CG2 3.48Å; W203-V205 HydrophobicContact CZ3-CG2 4.03Å; W203-W208 HydrophobicContact CH2-CE3 4.24Å; W203-W208 AromaticContact CH2-CZ3 3.63Å; W203-W208 HydrophobicContact CH2-CZ3 3.63Å; W203-W208 HydrophobicContact CZ3-CE3 4.36Å; W203-W208 AromaticContact CZ3-CZ3 3.59Å; W203-W208 HydrophobicContact CZ3-CZ3 3.59Å; W203-R214 HydrophobicContact CZ2-CB 4.25Å; W203-R214 HydrophobicContact CZ2-CG 4.31Å; W203-Y218 HydrophobicContact CD2-CD2 4.39Å; W203-Y218 HydrophobicContact CE3-CD1 4.28Å; W203-Y218 AromaticContact CE3-CD2 3.36Å; W203-Y218 HydrophobicContact CE3-CD2 3.36Å; W203-Y218 AromaticContact CE3-CE2 3.77Å; W203-Y218 HydrophobicContact CE3-CE2 3.77Å; W203-Y218 AromaticContact CE3-CG 3.66Å; W203-Y218 HydrophobicContact CE3-CG 3.66Å; W203-Y218 HydrophobicContact CH2-CD1 4.42Å; W203-Y218 HydrophobicContact CH2-CD2 4.43Å; W203-Y218 AromaticContact CH2-CG 3.93Å; W203-Y218 HydrophobicContact CH2-CG 3.93Å; W203-Y218 AromaticContact CZ3-CD1 3.56Å; W203-Y218 HydrophobicContact CZ3-CD1 3.56Å; W203-Y218 AromaticContact CZ3-CD2 3.4Å; W203-Y218 HydrophobicContact CZ3-CD2 3.4Å; W203-Y218 VanDerWaalsContact CZ3-CD2 3.4Å; W203-Y218 HydrophobicContact CZ3-CE1 4.14Å; W203-Y218 HydrophobicContact CZ3-CE2 4.04Å; W203-Y218 AromaticContact CZ3-CG 3.13Å; W203-Y218 HydrophobicContact CZ3-CG 3.13Å; W203-I227 HydrophobicContact CB-CG2 4.11Å; W203-Q228 PolarHBondContact N-O 3.4Å; W203-T229 CarbonylContact O-C 3.6Å; W203-T229 VanDerWaalsContact O-CA 3.3Å; W203-T229 WeakPolarHBondContact O-CA 3.31Å; W203-Y230 PolarHBondContact O-N 3.16Å; W203-F234 HydrophobicContact CE3-CE2 4.12Å; W203-F234 AromaticContact CE3-CZ 3.99Å; W203-F234 HydrophobicContact CE3-CZ 3.99Å; W203-F234 HydrophobicContact CZ3-CE2 4.37Å; W203-F234 AromaticContact CZ3-CZ 3.99Å; W203-F234 HydrophobicContact CZ3-CZ 3.99Å; W203-L254 HydrophobicContact CB-CB 4.02Å; W203-L254 HydrophobicContact CB-CD1 4.03Å; W203-L254 HydrophobicContact CB-CG 4.22Å; W203-L254 VanDerWaalsContact CD1-CB 3.48Å; W203-L254 HydrophobicContact CD2-CB 4.41Å; W203-L254 HydrophobicContact CD2-CD1 4.21Å; W203-L254 HydrophobicContact CG-CB 3.74Å; W203-L254 HydrophobicContact CG-CD1 4.04Å; W203-L254 HydrophobicContact CG-CG 4.33Å; W203-L254 PolarHBondContact NE1-O 3.22Å; W203-F256 HydrophobicContact CZ2-CB 4.43Å; W203-F256 HydrophobicContact CZ2-CD2 4.03Å
204	I	97.5	Very high	95.7	Very high	25 Å²	25	49.6 Å²	49.6	13%	0.128	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	114.6	-179.3	-51	169.1	0	0	0	108.2	Y230 L238 Y243 T246 M247 Y253	I204-Y230 CarbonylContact C-O 3.39Å; I204-Y230 WeakPolarHBondContact CA-O 3.39Å; I204-Y230 HydrophobicContact CG1-CD2 4.36Å; I204-L238 HydrophobicContact CD1-CD1 3.98Å; I204-L238 HydrophobicContact CG1-CD1 4.34Å; I204-L238 HydrophobicContact CG2-CD1 4.4Å; I204-Y243 HydrophobicContact CB-CE2 4.12Å; I204-Y243 HydrophobicContact CD1-CD2 3.58Å; I204-Y243 HydrophobicContact CD1-CE2 3.61Å; I204-Y243 HydrophobicContact CD1-CG 4.44Å; I204-Y243 HydrophobicContact CG1-CE2 4.46Å; I204-Y243 HydrophobicContact CG2-CD2 4Å; I204-Y243 HydrophobicContact CG2-CE2 3.86Å; I204-T246 HydrophobicContact CD1-CG2 4.37Å; I204-M247 HydrophobicContact CD1-CE 4.49Å; I204-Y253 HydrophobicContact CB-CE2 4.38Å; I204-Y253 HydrophobicContact CD1-CE2 3.95Å; I204-Y253 HydrophobicContact CG1-CE2 3.88Å
205	V	95.9	Very high	95.9	Very high	5 Å²	5	48.6 Å²	48.6	3%	0.03	28%	0.279	C	S	.	.			trans	-134.1	132.7	-172.7	-173	0	0	0	0	111.6	W203 N207 Y230 G231 R232 A233 F234	W203-V205 HydrophobicContact CD2-CG2 3.26Å; W203-V205 HydrophobicContact CE3-CG2 3.74Å; W203-V205 HydrophobicContact CG-CG2 3.73Å; W203-V205 HydrophobicContact CH2-CG2 3.94Å; W203-V205 HydrophobicContact CZ2-CG2 3.48Å; W203-V205 VanDerWaalsContact CZ2-CG2 3.48Å; W203-V205 HydrophobicContact CZ3-CG2 4.03Å; V205-N207 WeakPolarHBondContact CG1-O 3.39Å; V205-Y230 PolarHBondContact N-O 3.01Å; V205-G231 CarbonylContact O-C 3.54Å; V205-G231 WeakPolarHBondContact O-CA 3.4Å; V205-R232 PolarHBondContact O-N 3.44Å; V205-A233 HydrophobicContact CB-CB 4.06Å; V205-A233 HydrophobicContact CG1-CB 4.04Å; V205-A233 VanDerWaalsContact O-CB 3.23Å; V205-A233 WeakPolarHBondContact O-CB 3.43Å; V205-A233 PolarHBondContact O-N 3.25Å; V205-F234 HydrophobicContact CB-CE2 4Å; V205-F234 HydrophobicContact CG2-CE2 4.14Å
206	S	91.8	Very high	96.1	Very high	60 Å²	60	51.9 Å²	51.9	42%	0.42	29%	0.289	S	S	.	.	S	Bend	trans	-115.7	-25.1	173.2	-66.3	0	0	0	0	113.9
207	N	91.3	Very high	96.3	Very high	75 Å²	75	48.3 Å²	48.3	40%	0.401	26%	0.258	S	S	.	.	S	Bend	trans	-105.6	98.4	177.4	177	5.6	0	0	0	109	V205 R214	V205-N207 WeakPolarHBondContact CG1-O 3.39Å; N207-R214 PolarHBondContact O-NH2 2.9Å
208	W	93.3	Very high	96.3	Very high	89 Å²	89	47.5 Å²	47.5	34%	0.337	25%	0.254	S	S	.	.			trans	-109.8	139.2	-179.4	177.5	-90.7	0	0	0	111	W203 S215 Y218 A233 F234	W203-W208 HydrophobicContact CH2-CE3 4.24Å; W203-W208 AromaticContact CH2-CZ3 3.63Å; W203-W208 HydrophobicContact CH2-CZ3 3.63Å; W203-W208 HydrophobicContact CZ3-CE3 4.36Å; W203-W208 AromaticContact CZ3-CZ3 3.59Å; W203-W208 HydrophobicContact CZ3-CZ3 3.59Å; W208-S215 VanDerWaalsContact CH2-CB 3.48Å; W208-S215 WeakPolarHBondContact CZ3-OG 3.42Å; W208-Y218 AromaticContact CH2-CD1 3.84Å; W208-Y218 HydrophobicContact CH2-CD1 3.84Å; W208-Y218 HydrophobicContact CH2-CE1 4.33Å; W208-Y218 HydrophobicContact CZ3-CD1 4.09Å; W208-A233 HydrophobicContact CB-CB 3.66Å; W208-A233 HydrophobicContact CG-CB 4.37Å; W208-F234 HydrophobicContact CE3-CZ 4.47Å; W208-F234 HydrophobicContact CZ3-CZ 4.26Å
209	S	94.6	Very high	96.4	Very high	30 Å²	30	43.8 Å²	43.8	21%	0.21	23%	0.234	C	C	.	.			trans	-148	133.9	165.1	174.1	0	0	0	0	108	N211 H212 S215	S209-N211 PolarHBondContact O-N 3.14Å; S209-N211 PolarHBondContact OG-N 2.93Å; S209-H212 WeakPolarHBondContact CB-CE1 3.34Å; S209-H212 WeakPolarHBondContact CB-ND1 3.46Å; S209-H212 PolarHBondContact N-ND1 3.02Å; S209-H212 PolarHBondContact O-N 3.48Å; S209-S215 WeakPolarHBondContact O-CB 3.15Å; S209-S215 PolarHBondContact O-OG 2.89Å
210	P	93.9	Very high	96.4	Very high	81 Å²	81	45.6 Å²	45.6	53%	0.526	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-20.7	176.8	26.2	-34.9	0	0	0	112.7
211	N	94.6	Very high	96.4	Very high	124 Å²	124	44.2 Å²	44.2	66%	0.663	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-14.6	-179.8	-65.5	-27.5	0	0	0	113.6	S209	S209-N211 PolarHBondContact O-N 3.14Å; S209-N211 PolarHBondContact OG-N 2.93Å
212	H	95.3	Very high	96.4	Very high	44 Å²	44	48.8 Å²	48.8	20%	0.204	26%	0.256	C	S	.	.	S	Bend	trans	-67.9	139.1	177.8	-65.6	155.9	0	0	0	111.4	S209 R214 S215 K216	S209-H212 WeakPolarHBondContact CB-CE1 3.34Å; S209-H212 WeakPolarHBondContact CB-ND1 3.46Å; S209-H212 PolarHBondContact N-ND1 3.02Å; S209-H212 PolarHBondContact O-N 3.48Å; H212-R214 VanDerWaalsContact C-N 3.27Å; H212-R214 HydrophobicContact CB-CG 3.93Å; H212-R214 PolarHBondContact O-N 2.93Å; H212-S215 PolarHBondContact O-N 3.44Å; H212-K216 PolarHBondContact O-N 2.9Å; H212-K216 VanDerWaalsContact O-N 3.1Å
213	A	95.9	Very high	96.4	Very high	72 Å²	72	55 Å²	55	60%	0.595	28%	0.283	S	S	*	.	H	α-helix	trans	-52	-45.5	175.5	0	0	0	0	0	112.1	S215 K216 Y217	A213-S215 VanDerWaalsContact C-N 3.3Å; A213-S215 PolarHBondContact O-N 2.47Å; A213-K216 PolarHBondContact O-N 3.17Å; A213-Y217 WeakPolarHBondContact O-CB 3.4Å; A213-Y217 PolarHBondContact O-N 3.33Å
214	R	96.8	Very high	96.5	Very high	14 Å²	14	58.4 Å²	58.4	5%	0.053	30%	0.299	C	S	.	.	H	α-helix	trans	-59	-35.6	176.3	65.5	173.7	179.7	-163.3	-5.2	114.8	W203 N207 H212 Y218 F256 E257 L282	W203-R214 HydrophobicContact CZ2-CB 4.25Å; W203-R214 HydrophobicContact CZ2-CG 4.31Å; N207-R214 PolarHBondContact O-NH2 2.9Å; H212-R214 VanDerWaalsContact C-N 3.27Å; H212-R214 HydrophobicContact CB-CG 3.93Å; H212-R214 PolarHBondContact O-N 2.93Å; R214-Y218 VanDerWaalsContact O-CB 3.29Å; R214-Y218 WeakPolarHBondContact O-CB 3.03Å; R214-Y218 PolarHBondContact O-N 3.29Å; R214-F256 HydrophobicContact CB-CB 3.69Å; R214-F256 HydrophobicContact CB-CD2 3.93Å; R214-F256 HydrophobicContact CB-CG 4.25Å; R214-F256 PolarHBondContact NH1-O 3.46Å; R214-E257 WeakPolarHBondContact CD-O 3.47Å; R214-L282 HydrophobicContact CB-CD2 4.14Å
215	S	97.6	Very high	96.5	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-74.9	-39.5	-179.3	-70.6	0	0	0	0	110.6	W208 S209 H212 A213 N219	W208-S215 VanDerWaalsContact CH2-CB 3.48Å; W208-S215 WeakPolarHBondContact CZ3-OG 3.42Å; S209-S215 WeakPolarHBondContact O-CB 3.15Å; S209-S215 PolarHBondContact O-OG 2.89Å; H212-S215 PolarHBondContact O-N 3.44Å; A213-S215 VanDerWaalsContact C-N 3.3Å; A213-S215 PolarHBondContact O-N 2.47Å; S215-N219 WeakPolarHBondContact O-CB 3.33Å; S215-N219 VanDerWaalsContact O-CG 3.29Å; S215-N219 PolarHBondContact O-N 3.19Å; S215-N219 PolarHBondContact O-ND2 2.9Å
216	K	98	Very high	96.6	Very high	117 Å²	117	65.4 Å²	65.4	51%	0.509	33%	0.328	S	S	.	.	H	α-helix	trans	-62.7	-49.5	172.1	-65.3	178.1	179.7	177.8	0	111.2	H212 A213 Y218 N219 E220	H212-K216 PolarHBondContact O-N 2.9Å; H212-K216 VanDerWaalsContact O-N 3.1Å; A213-K216 PolarHBondContact O-N 3.17Å; K216-Y218 PolarHBondContact O-N 3.21Å; K216-N219 PolarHBondContact O-N 2.93Å; K216-N219 VanDerWaalsContact O-N 3.14Å; K216-E220 PolarHBondContact O-N 2.91Å
217	Y	98.5	Very high	96.9	Very high	38 Å²	38	63.5 Å²	63.5	15%	0.149	31%	0.313	C	S	.	.	H	α-helix	trans	-60.3	-46.7	179.3	-161.9	-77	0	0	0	111.9	A213 N219 E220 L221 F256 L282 V301 P307 L310	A213-Y217 WeakPolarHBondContact O-CB 3.4Å; A213-Y217 PolarHBondContact O-N 3.33Å; Y217-N219 VanDerWaalsContact C-N 3.31Å; Y217-N219 PolarHBondContact O-N 2.88Å; Y217-E220 PolarHBondContact O-N 2.82Å; Y217-L221 HydrophobicContact CD1-CB 4.39Å; Y217-L221 HydrophobicContact CE1-CB 4.37Å; Y217-L221 HydrophobicContact CE1-CD2 4.35Å; Y217-L221 WeakPolarHBondContact O-CB 3.41Å; Y217-L221 PolarHBondContact O-N 3.4Å; Y217-F256 AromaticContact CD1-CE2 3.85Å; Y217-F256 HydrophobicContact CD1-CE2 3.85Å; Y217-F256 AromaticContact CD1-CZ 3.74Å; Y217-F256 HydrophobicContact CD1-CZ 3.74Å; Y217-F256 HydrophobicContact CE1-CZ 4.14Å; Y217-F256 HydrophobicContact CG-CE2 4.45Å; Y217-L282 HydrophobicContact CG-CD2 4.24Å; Y217-V301 HydrophobicContact CD1-CG1 4.35Å; Y217-V301 HydrophobicContact CE1-CB 4.23Å; Y217-V301 HydrophobicContact CE1-CG1 3.69Å; Y217-V301 HydrophobicContact CE2-CB 3.8Å; Y217-V301 HydrophobicContact CE2-CG1 4.12Å; Y217-V301 HydrophobicContact CE2-CG2 4.26Å; Y217-V301 WeakPolarHBondContact OH-CB 3.4Å; Y217-P307 HydrophobicContact CE1-CB 4.26Å; Y217-P307 HydrophobicContact CE1-CG 4.26Å; Y217-P307 HydrophobicContact CE2-CG 4.11Å; Y217-L310 HydrophobicContact CE1-CD2 3.84Å; Y217-L310 WeakPolarHBondContact OH-CD2 3.28Å
218	Y	98.4	Very high	97.3	Very high	21 Å²	21	61.6 Å²	61.6	8%	0.082	30%	0.302	C	S	.	.	H	α-helix	trans	-57.5	-42.1	174.5	165	-98.8	0	0	0	112.8	W203 W208 R214 K216 E220 L221 K222 I227 T229 F234 L254	W203-Y218 HydrophobicContact CD2-CD2 4.39Å; W203-Y218 HydrophobicContact CE3-CD1 4.28Å; W203-Y218 AromaticContact CE3-CD2 3.36Å; W203-Y218 HydrophobicContact CE3-CD2 3.36Å; W203-Y218 AromaticContact CE3-CE2 3.77Å; W203-Y218 HydrophobicContact CE3-CE2 3.77Å; W203-Y218 AromaticContact CE3-CG 3.66Å; W203-Y218 HydrophobicContact CE3-CG 3.66Å; W203-Y218 HydrophobicContact CH2-CD1 4.42Å; W203-Y218 HydrophobicContact CH2-CD2 4.43Å; W203-Y218 AromaticContact CH2-CG 3.93Å; W203-Y218 HydrophobicContact CH2-CG 3.93Å; W203-Y218 AromaticContact CZ3-CD1 3.56Å; W203-Y218 HydrophobicContact CZ3-CD1 3.56Å; W203-Y218 AromaticContact CZ3-CD2 3.4Å; W203-Y218 HydrophobicContact CZ3-CD2 3.4Å; W203-Y218 VanDerWaalsContact CZ3-CD2 3.4Å; W203-Y218 HydrophobicContact CZ3-CE1 4.14Å; W203-Y218 HydrophobicContact CZ3-CE2 4.04Å; W203-Y218 AromaticContact CZ3-CG 3.13Å; W203-Y218 HydrophobicContact CZ3-CG 3.13Å; W208-Y218 AromaticContact CH2-CD1 3.84Å; W208-Y218 HydrophobicContact CH2-CD1 3.84Å; W208-Y218 HydrophobicContact CH2-CE1 4.33Å; W208-Y218 HydrophobicContact CZ3-CD1 4.09Å; R214-Y218 VanDerWaalsContact O-CB 3.29Å; R214-Y218 WeakPolarHBondContact O-CB 3.03Å; R214-Y218 PolarHBondContact O-N 3.29Å; K216-Y218 PolarHBondContact O-N 3.21Å; Y218-E220 PolarHBondContact O-N 3.08Å; Y218-L221 PolarHBondContact O-N 2.66Å; Y218-K222 HydrophobicContact CD1-CD 4.12Å; Y218-K222 HydrophobicContact CE1-CD 3.55Å; Y218-K222 HydrophobicContact CE2-CB 4.11Å; Y218-K222 HydrophobicContact CE2-CD 4.48Å; Y218-K222 WeakPolarHBondContact O-CB 3.39Å; Y218-K222 WeakPolarHBondContact O-CG 3.3Å; Y218-K222 PolarHBondContact O-N 3.34Å; Y218-I227 HydrophobicContact CD2-CD1 3.7Å; Y218-I227 HydrophobicContact CD2-CG2 4.48Å; Y218-I227 HydrophobicContact CE2-CB 4.06Å; Y218-I227 HydrophobicContact CE2-CD1 3.67Å; Y218-I227 HydrophobicContact CE2-CG1 4.49Å; Y218-I227 HydrophobicContact CE2-CG2 3.94Å; Y218-T229 HydrophobicContact CE2-CG2 3.73Å; Y218-T229 VanDerWaalsContact OH-CG2 3.26Å; Y218-T229 WeakPolarHBondContact OH-CG2 3.41Å; Y218-F234 HydrophobicContact CE1-CE1 4.23Å; Y218-F234 HydrophobicContact CE1-CZ 4.17Å; Y218-L254 HydrophobicContact CD2-CD1 4.24Å
219	N	98.4	Very high	97.5	Very high	45 Å²	45	58.3 Å²	58.3	24%	0.241	29%	0.292	C	S	.	.	H	α-helix	trans	-64	-29.4	-178.7	-81.3	-30.4	0	0	0	113.1	S215 K216 Y217 K222 K223	S215-N219 WeakPolarHBondContact O-CB 3.33Å; S215-N219 VanDerWaalsContact O-CG 3.29Å; S215-N219 PolarHBondContact O-N 3.19Å; S215-N219 PolarHBondContact O-ND2 2.9Å; K216-N219 PolarHBondContact O-N 2.93Å; K216-N219 VanDerWaalsContact O-N 3.14Å; Y217-N219 VanDerWaalsContact C-N 3.31Å; Y217-N219 PolarHBondContact O-N 2.88Å; N219-K222 PolarHBondContact OD1-NZ 2.95Å; N219-K223 WeakPolarHBondContact O-CE 3.45Å
220	E	98.6	Very high	97.7	Very high	85 Å²	85	59 Å²	59	40%	0.397	29%	0.29	S	S	.	.	H	α-helix	trans	-80	-48.2	171.7	-64	-51	120.3	0	0	111.5	K216 Y217 Y218 K222 K223 H224 P307	K216-E220 PolarHBondContact O-N 2.91Å; Y217-E220 PolarHBondContact O-N 2.82Å; Y218-E220 PolarHBondContact O-N 3.08Å; E220-K222 VanDerWaalsContact C-N 3.33Å; E220-K222 PolarHBondContact O-N 3.07Å; E220-K223 WeakPolarHBondContact O-CB 3.42Å; E220-K223 PolarHBondContact O-N 3.32Å; E220-K223 VanDerWaalsContact O-N 3.16Å; E220-K223 IonicContact OE1-NZ 3.88Å; E220-K223 PolarHBondContact OE1-NZ 3.2Å; E220-K223 IonicContact OE2-NZ 3.46Å; E220-K223 PolarHBondContact OE2-NZ 2.71Å; E220-H224 PolarHBondContact O-CD2 2.63Å; E220-P307 HydrophobicContact CB-CB 4.12Å; E220-P307 HydrophobicContact CB-CG 3.83Å
221	L	98.9	Very high	97.8	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-58.7	-42.2	-178.2	-176.2	62.1	0	0	0	112.7	Y217 Y218 K223 H224 I225 I227 L254 P307 L310 A311	Y217-L221 HydrophobicContact CD1-CB 4.39Å; Y217-L221 HydrophobicContact CE1-CB 4.37Å; Y217-L221 HydrophobicContact CE1-CD2 4.35Å; Y217-L221 WeakPolarHBondContact O-CB 3.41Å; Y217-L221 PolarHBondContact O-N 3.4Å; Y218-L221 PolarHBondContact O-N 2.66Å; L221-K223 PolarHBondContact O-N 3.49Å; L221-H224 PolarHBondContact O-N 2.85Å; L221-I225 HydrophobicContact CD1-CG2 3.94Å; L221-I225 HydrophobicContact CG-CG2 3.9Å; L221-I225 PolarHBondContact O-N 2.96Å; L221-I227 HydrophobicContact CB-CD1 4.37Å; L221-I227 HydrophobicContact CD2-CD1 4.06Å; L221-I227 HydrophobicContact CG-CD1 4.02Å; L221-L254 HydrophobicContact CD2-CD1 4.23Å; L221-L254 HydrophobicContact CD2-CD2 4.01Å; L221-P307 HydrophobicContact CB-CB 4.12Å; L221-P307 HydrophobicContact CD1-CB 4.24Å; L221-P307 WeakPolarHBondContact CD1-O 3.49Å; L221-L310 HydrophobicContact CD1-CB 4.49Å; L221-L310 HydrophobicContact CD1-CD2 4.09Å; L221-L310 HydrophobicContact CD1-CG 4.25Å; L221-L310 HydrophobicContact CD2-CD2 4.22Å; L221-A311 HydrophobicContact CD1-CB 3.95Å
222	K	98.6	Very high	97.8	Very high	96 Å²	96	57.7 Å²	57.7	42%	0.417	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-15.8	-177.6	78.7	-173.7	-173.7	-173.5	0	114	Y218 N219 E220 I227	Y218-K222 HydrophobicContact CD1-CD 4.12Å; Y218-K222 HydrophobicContact CE1-CD 3.55Å; Y218-K222 HydrophobicContact CE2-CB 4.11Å; Y218-K222 HydrophobicContact CE2-CD 4.48Å; Y218-K222 WeakPolarHBondContact O-CB 3.39Å; Y218-K222 WeakPolarHBondContact O-CG 3.3Å; Y218-K222 PolarHBondContact O-N 3.34Å; N219-K222 PolarHBondContact OD1-NZ 2.95Å; E220-K222 VanDerWaalsContact C-N 3.33Å; E220-K222 PolarHBondContact O-N 3.07Å; K222-I227 HydrophobicContact CB-CD1 3.89Å
223	K	98.8	Very high	97.8	Very high	129 Å²	129	57.2 Å²	57.2	56%	0.561	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-20.6	175.2	-58.6	174.7	-171.8	169.1	0	112	N219 E220 L221	N219-K223 WeakPolarHBondContact O-CE 3.45Å; E220-K223 WeakPolarHBondContact O-CB 3.42Å; E220-K223 PolarHBondContact O-N 3.32Å; E220-K223 VanDerWaalsContact O-N 3.16Å; E220-K223 IonicContact OE1-NZ 3.88Å; E220-K223 PolarHBondContact OE1-NZ 3.2Å; E220-K223 IonicContact OE2-NZ 3.46Å; E220-K223 PolarHBondContact OE2-NZ 2.71Å; L221-K223 PolarHBondContact O-N 3.49Å
224	H	98.8	Very high	97.8	Very high	77 Å²	77	56 Å²	56	36%	0.356	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.9	-19.9	-171.5	-55.3	-63.7	0	0	0	113.4	E220 L221 K308 A311	E220-H224 PolarHBondContact O-CD2 2.63Å; L221-H224 PolarHBondContact O-N 2.85Å; H224-K308 HydrophobicContact CB-CG 4.49Å; H224-A311 HydrophobicContact CB-CB 3.54Å
225	I	98.7	Very high	97.7	Very high	10 Å²	10	64.2 Å²	64.2	5%	0.051	29%	0.291	C	S	.	.	S	Bend	trans	-145.6	144.7	-179.5	-166.9	166.6	0	0	0	111.3	L200 V201 L221 I227 A311 L314 L315	L200-I225 HydrophobicContact CD2-CD1 3.76Å; L200-I225 HydrophobicContact CD2-CG1 4Å; L200-I225 HydrophobicContact CG-CD1 4.29Å; V201-I225 HydrophobicContact CG2-CD1 3.64Å; V201-I225 HydrophobicContact CG2-CG1 4.18Å; L221-I225 HydrophobicContact CD1-CG2 3.94Å; L221-I225 HydrophobicContact CG-CG2 3.9Å; L221-I225 PolarHBondContact O-N 2.96Å; I225-I227 HydrophobicContact CG2-CD1 4.33Å; I225-I227 HydrophobicContact CG2-CG1 4.05Å; I225-I227 PolarHBondContact O-N 2.67Å; I225-A311 HydrophobicContact CB-CB 3.86Å; I225-A311 HydrophobicContact CG2-CB 3.98Å; I225-L314 HydrophobicContact CD1-CB 3.78Å; I225-L314 HydrophobicContact CD1-CD1 4.17Å; I225-L315 HydrophobicContact CD1-CD2 4.39Å; I225-L315 HydrophobicContact CD1-CG 4.14Å; I225-L315 HydrophobicContact CG1-CD2 4.49Å
226	K	98.2	Very high	97.6	Very high	166 Å²	166	69.9 Å²	69.9	72%	0.722	32%	0.315	S	S	*	.			trans	-73.2	118.5	176.7	-171.7	-175.3	-179.2	176.1	0	110
227	I	98.6	Very high	97.4	Very high	20 Å²	20	68.9 Å²	68.9	10%	0.103	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	123	178.2	-55.5	163.9	0	0	0	109.4	V201 W203 Y218 L221 K222 I225 T229 L254	V201-I227 HydrophobicContact CB-CG1 4.25Å; V201-I227 HydrophobicContact CG1-CG1 4.16Å; V201-I227 HydrophobicContact CG1-CG2 4.17Å; V201-I227 CarbonylContact O-C 3.59Å; V201-I227 WeakPolarHBondContact O-CA 3.3Å; W203-I227 HydrophobicContact CB-CG2 4.11Å; Y218-I227 HydrophobicContact CD2-CD1 3.7Å; Y218-I227 HydrophobicContact CD2-CG2 4.48Å; Y218-I227 HydrophobicContact CE2-CB 4.06Å; Y218-I227 HydrophobicContact CE2-CD1 3.67Å; Y218-I227 HydrophobicContact CE2-CG1 4.49Å; Y218-I227 HydrophobicContact CE2-CG2 3.94Å; L221-I227 HydrophobicContact CB-CD1 4.37Å; L221-I227 HydrophobicContact CD2-CD1 4.06Å; L221-I227 HydrophobicContact CG-CD1 4.02Å; K222-I227 HydrophobicContact CB-CD1 3.89Å; I225-I227 HydrophobicContact CG2-CD1 4.33Å; I225-I227 HydrophobicContact CG2-CG1 4.05Å; I225-I227 PolarHBondContact O-N 2.67Å; I227-T229 HydrophobicContact CG2-CG2 4.1Å; I227-T229 PolarHBondContact O-N 2.72Å; I227-L254 HydrophobicContact CD1-CD1 4.11Å; I227-L254 HydrophobicContact CG2-CD1 4.11Å
228	Q	98.4	Very high	97.1	Very high	35 Å²	35	69.7 Å²	69.7	16%	0.164	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	113.5	172.7	-70.9	75.3	57.8	0	0	110.1	K199 V201 C202 W203 Y230	K199-Q228 HydrophobicContact CD-CB 4.45Å; K199-Q228 HydrophobicContact CD-CG 4.21Å; K199-Q228 HydrophobicContact CG-CG 4.16Å; V201-Q228 PolarHBondContact O-N 2.74Å; V201-Q228 PolarHBondContact O-OE1 2.75Å; C202-Q228 CarbonylContact C-O 3.55Å; C202-Q228 VanDerWaalsContact CA-O 3.31Å; C202-Q228 WeakPolarHBondContact CA-O 3.09Å; W203-Q228 PolarHBondContact N-O 3.4Å; Q228-Y230 HydrophobicContact CB-CE2 3.85Å
229	T	98.2	Very high	96.9	Very high	21 Å²	21	71.5 Å²	71.5	13%	0.129	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	138.9	-176.5	57.9	0	0	0	0	113.5	W203 Y218 I227 F234 K236	W203-T229 CarbonylContact O-C 3.6Å; W203-T229 VanDerWaalsContact O-CA 3.3Å; W203-T229 WeakPolarHBondContact O-CA 3.31Å; Y218-T229 HydrophobicContact CE2-CG2 3.73Å; Y218-T229 VanDerWaalsContact OH-CG2 3.26Å; Y218-T229 WeakPolarHBondContact OH-CG2 3.41Å; I227-T229 HydrophobicContact CG2-CG2 4.1Å; I227-T229 PolarHBondContact O-N 2.72Å; T229-F234 HydrophobicContact CG2-CD1 4.26Å; T229-F234 HydrophobicContact CG2-CD2 4.4Å; T229-F234 HydrophobicContact CG2-CE1 3.87Å; T229-F234 HydrophobicContact CG2-CE2 3.99Å; T229-F234 HydrophobicContact CG2-CZ 3.71Å; T229-F234 WeakPolarHBondContact OG1-CD1 3.4Å; T229-K236 WeakPolarHBondContact O-CD 3.49Å
230	Y	97.8	Very high	96.3	Very high	45 Å²	45	75.9 Å²	75.9	18%	0.176	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	174.8	178.7	-54	-95.1	0	0	0	111.6	K199 W203 I204 V205 Q228 F234 K236 L238 T246	K199-Y230 WeakPolarHBondContact CE-OH 2.94Å; W203-Y230 PolarHBondContact O-N 3.16Å; I204-Y230 CarbonylContact C-O 3.39Å; I204-Y230 WeakPolarHBondContact CA-O 3.39Å; I204-Y230 HydrophobicContact CG1-CD2 4.36Å; V205-Y230 PolarHBondContact N-O 3.01Å; Q228-Y230 HydrophobicContact CB-CE2 3.85Å; Y230-F234 WeakPolarHBondContact O-CD2 3.35Å; Y230-K236 HydrophobicContact CD1-CB 4.3Å; Y230-L238 HydrophobicContact CD1-CD1 4.1Å; Y230-L238 HydrophobicContact CD1-CD2 3.92Å; Y230-L238 HydrophobicContact CD1-CG 4.27Å; Y230-L238 HydrophobicContact CE1-CD2 4.45Å; Y230-L238 HydrophobicContact CG-CD1 3.93Å; Y230-L238 HydrophobicContact CG-CG 4.48Å; Y230-T246 HydrophobicContact CD2-CG2 3.75Å; Y230-T246 HydrophobicContact CE1-CG2 4.42Å; Y230-T246 HydrophobicContact CE2-CG2 3.43Å; Y230-T246 VanDerWaalsContact CE2-CG2 3.43Å; Y230-T246 HydrophobicContact CG-CG2 4.37Å
231	G	95.9	Very high	95.8	Very high	4 Å²	4	76.8 Å²	76.8	4%	0.041	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	95.2	179.7	-179.9	0	0	0	0	0	113	V205 A233 F234 Q235 K236	V205-G231 CarbonylContact O-C 3.54Å; V205-G231 WeakPolarHBondContact O-CA 3.4Å; G231-A233 PolarHBondContact O-N 2.87Å; G231-F234 CarbonylContact O-C 3.44Å; G231-F234 PolarHBondContact O-N 3.33Å; G231-Q235 PolarHBondContact O-N 3Å; G231-K236 PolarHBondContact N-O 2.82Å; G231-K236 PolarHBondContact O-N 3.24Å; G231-K236 VanDerWaalsContact O-N 3.14Å
232	R	95.3	Very high	95.6	Very high	172 Å²	172	80.2 Å²	80.2	65%	0.649	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-59.7	-34.9	-174	-167.6	-171.5	-57.2	128.9	-0	112.5	V205 F234 Q235	V205-R232 PolarHBondContact O-N 3.44Å; R232-F234 PolarHBondContact O-N 3.44Å; R232-F234 VanDerWaalsContact O-N 3.15Å; R232-Q235 PolarHBondContact O-N 2.86Å
233	A	94.9	Very high	95.4	Very high	35 Å²	35	78 Å²	78	29%	0.289	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-62.1	-21.7	179.1	0	0	0	0	0	113.2	V205 W208 G231	V205-A233 HydrophobicContact CB-CB 4.06Å; V205-A233 HydrophobicContact CG1-CB 4.04Å; V205-A233 VanDerWaalsContact O-CB 3.23Å; V205-A233 WeakPolarHBondContact O-CB 3.43Å; V205-A233 PolarHBondContact O-N 3.25Å; W208-A233 HydrophobicContact CB-CB 3.66Å; W208-A233 HydrophobicContact CG-CB 4.37Å; G231-A233 PolarHBondContact O-N 2.87Å
234	F	95.4	Very high	95.2	Very high	47 Å²	47	73.8 Å²	73.8	21%	0.206	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-120.7	15.2	-177	-59.6	-80	0	0	0	112.7	W203 V205 W208 Y218 T229 Y230 G231 R232 K236	W203-F234 HydrophobicContact CE3-CE2 4.12Å; W203-F234 AromaticContact CE3-CZ 3.99Å; W203-F234 HydrophobicContact CE3-CZ 3.99Å; W203-F234 HydrophobicContact CZ3-CE2 4.37Å; W203-F234 AromaticContact CZ3-CZ 3.99Å; W203-F234 HydrophobicContact CZ3-CZ 3.99Å; V205-F234 HydrophobicContact CB-CE2 4Å; V205-F234 HydrophobicContact CG2-CE2 4.14Å; W208-F234 HydrophobicContact CE3-CZ 4.47Å; W208-F234 HydrophobicContact CZ3-CZ 4.26Å; Y218-F234 HydrophobicContact CE1-CE1 4.23Å; Y218-F234 HydrophobicContact CE1-CZ 4.17Å; T229-F234 HydrophobicContact CG2-CD1 4.26Å; T229-F234 HydrophobicContact CG2-CD2 4.4Å; T229-F234 HydrophobicContact CG2-CE1 3.87Å; T229-F234 HydrophobicContact CG2-CE2 3.99Å; T229-F234 HydrophobicContact CG2-CZ 3.71Å; T229-F234 WeakPolarHBondContact OG1-CD1 3.4Å; Y230-F234 WeakPolarHBondContact O-CD2 3.35Å; G231-F234 CarbonylContact O-C 3.44Å; G231-F234 PolarHBondContact O-N 3.33Å; R232-F234 PolarHBondContact O-N 3.44Å; R232-F234 VanDerWaalsContact O-N 3.15Å; F234-K236 WeakPolarHBondContact O-CG 3.43Å; F234-K236 PolarHBondContact O-N 3.46Å; F234-K236 VanDerWaalsContact O-N 3.11Å
235	Q	94.9	Very high	95.1	Very high	186 Å²	186	74.2 Å²	74.2	87%	0.869	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	31.8	-179.3	-56	175.1	27.5	0	0	113.5	G231 R232	G231-Q235 PolarHBondContact O-N 3Å; R232-Q235 PolarHBondContact O-N 2.86Å
236	K	95.8	Very high	94.9	Very high	118 Å²	118	74.4 Å²	74.4	51%	0.513	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-130.4	61.6	-177.4	-73.4	174.5	-174.9	-177	0	109.7	T229 Y230 G231 F234	T229-K236 WeakPolarHBondContact O-CD 3.49Å; Y230-K236 HydrophobicContact CD1-CB 4.3Å; G231-K236 PolarHBondContact N-O 2.82Å; G231-K236 PolarHBondContact O-N 3.24Å; G231-K236 VanDerWaalsContact O-N 3.14Å; F234-K236 WeakPolarHBondContact O-CG 3.43Å; F234-K236 PolarHBondContact O-N 3.46Å; F234-K236 VanDerWaalsContact O-N 3.11Å
237	S	93.5	Very high	94.8	Very high	97 Å²	97	66.5 Å²	66.5	68%	0.678	34%	0.336	S	S	*	.			trans	-60.3	145.5	178.9	-63.8	0	0	0	0	111
238	L	93.4	Very high	94.7	Very high	54 Å²	54	66.8 Å²	66.8	28%	0.283	34%	0.34	S	S	.	.			trans	-118.6	144.3	179.7	-64.7	171.7	0	0	0	109.3	I204 Y230 D242 T246	I204-L238 HydrophobicContact CD1-CD1 3.98Å; I204-L238 HydrophobicContact CG1-CD1 4.34Å; I204-L238 HydrophobicContact CG2-CD1 4.4Å; Y230-L238 HydrophobicContact CD1-CD1 4.1Å; Y230-L238 HydrophobicContact CD1-CD2 3.92Å; Y230-L238 HydrophobicContact CD1-CG 4.27Å; Y230-L238 HydrophobicContact CE1-CD2 4.45Å; Y230-L238 HydrophobicContact CG-CD1 3.93Å; Y230-L238 HydrophobicContact CG-CG 4.48Å; L238-D242 HydrophobicContact CB-CB 4.09Å; L238-D242 HydrophobicContact CD2-CB 3.92Å; L238-T246 HydrophobicContact CD1-CG2 4.3Å
239	S	93.4	Very high	94.7	Very high	59 Å²	59	65.9 Å²	65.9	41%	0.413	34%	0.337	S	S	.	.			trans	-65.8	167.5	163	76.7	0	0	0	0	110.1	N241 D242 Y243	S239-N241 VanDerWaalsContact C-N 3.27Å; S239-N241 PolarHBondContact O-N 3.43Å; S239-D242 WeakPolarHBondContact CB-OD2 3.24Å; S239-D242 PolarHBondContact O-N 2.82Å; S239-D242 PolarHBondContact OG-N 3.47Å; S239-D242 VanDerWaalsContact OG-N 3.14Å; S239-D242 PolarHBondContact OG-OD2 2.99Å; S239-Y243 WeakPolarHBondContact O-CB 3.48Å; S239-Y243 PolarHBondContact O-N 3.1Å
240	Q	85.9	Confident	94.7	Very high	138 Å²	138	64.9 Å²	64.9	65%	0.645	33%	0.331	S	S	*	.	H	α-helix	trans	-61.5	-37.6	177.6	-173.5	59.6	40	0	0	112.3	Y243 L244	Q240-Y243 WeakPolarHBondContact O-CB 3.33Å; Q240-Y243 PolarHBondContact O-N 2.78Å; Q240-L244 PolarHBondContact O-N 2.7Å
241	N	88.6	Confident	94.7	Very high	104 Å²	104	64.5 Å²	64.5	56%	0.556	33%	0.33	S	S	*	.	H	α-helix	trans	-67.2	-45.9	176.9	-170	54.1	0	0	0	110.8	S239 Y243 L244 N245	S239-N241 VanDerWaalsContact C-N 3.27Å; S239-N241 PolarHBondContact O-N 3.43Å; N241-Y243 VanDerWaalsContact C-N 3.25Å; N241-Y243 PolarHBondContact O-N 3.01Å; N241-L244 PolarHBondContact O-N 3.13Å; N241-N245 PolarHBondContact ND2-ND2 3.03Å; N241-N245 WeakPolarHBondContact O-CB 3.45Å; N241-N245 VanDerWaalsContact O-CG 3.27Å; N241-N245 PolarHBondContact O-N 3.14Å; N241-N245 PolarHBondContact O-ND2 3.37Å; N241-N245 PolarHBondContact OD1-ND2 2.92Å
242	D	94.3	Very high	94.9	Very high	72 Å²	72	64.3 Å²	64.3	39%	0.385	33%	0.328	S	S	.	.	H	α-helix	trans	-66.6	-29.1	178.8	-58.1	-38.4	0	0	0	112.4	L238 S239 T246	L238-D242 HydrophobicContact CB-CB 4.09Å; L238-D242 HydrophobicContact CD2-CB 3.92Å; S239-D242 WeakPolarHBondContact CB-OD2 3.24Å; S239-D242 PolarHBondContact O-N 2.82Å; S239-D242 PolarHBondContact OG-N 3.47Å; S239-D242 VanDerWaalsContact OG-N 3.14Å; S239-D242 PolarHBondContact OG-OD2 2.99Å; D242-T246 WeakPolarHBondContact O-CA 3.06Å; D242-T246 WeakPolarHBondContact O-CB 3.38Å; D242-T246 PolarHBondContact O-N 3.17Å; D242-T246 PolarHBondContact O-OG1 2.9Å
243	Y	94.2	Very high	95.1	Very high	48 Å²	48	56.3 Å²	56.3	19%	0.188	30%	0.298	C	S	.	.	H	α-helix	trans	-60.9	-51.3	175.5	177.2	-96.4	0	0	0	111.6	I204 S239 Q240 N241 M247 V271	I204-Y243 HydrophobicContact CB-CE2 4.12Å; I204-Y243 HydrophobicContact CD1-CD2 3.58Å; I204-Y243 HydrophobicContact CD1-CE2 3.61Å; I204-Y243 HydrophobicContact CD1-CG 4.44Å; I204-Y243 HydrophobicContact CG1-CE2 4.46Å; I204-Y243 HydrophobicContact CG2-CD2 4Å; I204-Y243 HydrophobicContact CG2-CE2 3.86Å; S239-Y243 WeakPolarHBondContact O-CB 3.48Å; S239-Y243 PolarHBondContact O-N 3.1Å; Q240-Y243 WeakPolarHBondContact O-CB 3.33Å; Q240-Y243 PolarHBondContact O-N 2.78Å; N241-Y243 VanDerWaalsContact C-N 3.25Å; N241-Y243 PolarHBondContact O-N 3.01Å; Y243-M247 HydrophobicContact CE1-CE 3.77Å; Y243-M247 HydrophobicContact CE2-CE 4.23Å; Y243-M247 PolarHBondContact O-N 2.84Å; Y243-M247 VanDerWaalsContact O-N 3.14Å; Y243-M247 WeakPolarHBondContact OH-CE 3.05Å; Y243-V271 HydrophobicContact CE1-CG1 4.22Å
244	L	95.3	Very high	95.2	Very high	42 Å²	42	54.7 Å²	54.7	22%	0.22	29%	0.285	C	S	.	.	H	α-helix	trans	-69.5	-44.5	179.4	-62.9	178.9	0	0	0	111.4	Q240 N241 T246 M247 S248 V271 M275	Q240-L244 PolarHBondContact O-N 2.7Å; N241-L244 PolarHBondContact O-N 3.13Å; L244-T246 VanDerWaalsContact C-N 3.35Å; L244-T246 PolarHBondContact O-N 2.96Å; L244-M247 PolarHBondContact O-N 3.14Å; L244-S248 WeakPolarHBondContact O-CB 3.35Å; L244-S248 PolarHBondContact O-N 2.68Å; L244-V271 HydrophobicContact CD2-CG1 3.87Å; L244-M275 HydrophobicContact CB-SD 4.23Å; L244-M275 HydrophobicContact CD2-SD 4.21Å
245	N	95.5	Very high	95.4	Very high	86 Å²	86	52.5 Å²	52.5	46%	0.46	28%	0.275	S	S	.	.	H	α-helix	trans	-63.1	-41.2	178.9	-69.7	-21.2	0	0	0	112	N241 S248 S249	N241-N245 PolarHBondContact ND2-ND2 3.03Å; N241-N245 WeakPolarHBondContact O-CB 3.45Å; N241-N245 VanDerWaalsContact O-CG 3.27Å; N241-N245 PolarHBondContact O-N 3.14Å; N241-N245 PolarHBondContact O-ND2 3.37Å; N241-N245 PolarHBondContact OD1-ND2 2.92Å; N245-S248 PolarHBondContact O-N 3.36Å; N245-S249 WeakPolarHBondContact O-CB 3.4Å; N245-S249 PolarHBondContact O-N 2.89Å; N245-S249 PolarHBondContact O-OG 3.03Å
246	T	96.1	Very high	95.6	Very high	13 Å²	13	43.7 Å²	43.7	8%	0.08	23%	0.234	C	C	.	.	H	α-helix	trans	-60.2	-50.9	174.8	-65.5	0	0	0	0	110	I204 Y230 L238 D242 L244 S248 S249 C250	I204-T246 HydrophobicContact CD1-CG2 4.37Å; Y230-T246 HydrophobicContact CD2-CG2 3.75Å; Y230-T246 HydrophobicContact CE1-CG2 4.42Å; Y230-T246 HydrophobicContact CE2-CG2 3.43Å; Y230-T246 VanDerWaalsContact CE2-CG2 3.43Å; Y230-T246 HydrophobicContact CG-CG2 4.37Å; L238-T246 HydrophobicContact CD1-CG2 4.3Å; D242-T246 WeakPolarHBondContact O-CA 3.06Å; D242-T246 WeakPolarHBondContact O-CB 3.38Å; D242-T246 PolarHBondContact O-N 3.17Å; D242-T246 PolarHBondContact O-OG1 2.9Å; L244-T246 VanDerWaalsContact C-N 3.35Å; L244-T246 PolarHBondContact O-N 2.96Å; T246-S248 PolarHBondContact O-N 3.21Å; T246-S249 PolarHBondContact O-N 3.48Å; T246-S249 VanDerWaalsContact O-N 3.16Å; T246-S249 PolarHBondContact O-OG 3.21Å; T246-C250 PolarHBondContact O-SG 3.11Å
247	M	95.6	Very high	95.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.2	-41.8	-179.1	-167.8	178.9	-57.8	0	0	112.8	I204 Y243 L244 S249 C250 Y253 V271 P272 T277	I204-M247 HydrophobicContact CD1-CE 4.49Å; Y243-M247 HydrophobicContact CE1-CE 3.77Å; Y243-M247 HydrophobicContact CE2-CE 4.23Å; Y243-M247 PolarHBondContact O-N 2.84Å; Y243-M247 VanDerWaalsContact O-N 3.14Å; Y243-M247 WeakPolarHBondContact OH-CE 3.05Å; L244-M247 PolarHBondContact O-N 3.14Å; M247-S249 VanDerWaalsContact C-N 3.26Å; M247-S249 PolarHBondContact O-N 2.83Å; M247-C250 PolarHBondContact O-N 3.04Å; M247-Y253 HydrophobicContact CE-CD2 4.26Å; M247-Y253 HydrophobicContact CE-CE1 4.08Å; M247-Y253 HydrophobicContact CE-CE2 3.71Å; M247-Y253 HydrophobicContact CG-CD2 3.75Å; M247-Y253 HydrophobicContact CG-CE2 4.09Å; M247-Y253 HydrophobicContact CG-CG 4.13Å; M247-Y253 HydrophobicContact SD-CD2 4.38Å; M247-Y253 HydrophobicContact SD-CE2 4.41Å; M247-Y253 HydrophobicContact SD-CG 4.46Å; M247-V271 HydrophobicContact CE-CB 4.26Å; M247-V271 HydrophobicContact CE-CG1 3.77Å; M247-V271 HydrophobicContact SD-CB 3.97Å; M247-V271 HydrophobicContact SD-CG1 3.49Å; M247-V271 WeakPolarHBondContact SD-CG1 3.37Å; M247-P272 HydrophobicContact CG-CB 4.16Å; M247-P272 WeakPolarHBondContact SD-CA 3.19Å; M247-P272 HydrophobicContact SD-CB 3.66Å; M247-P272 WeakPolarHBondContact SD-CD 3.2Å; M247-P272 HydrophobicContact SD-CG 4.08Å; M247-T277 PolarHBondContact O-OG1 3.29Å
248	S	97.2	Very high	95.8	Very high	27 Å²	27	34.8 Å²	34.8	19%	0.189	18%	0.184	C	C	.	.	H	α-helix	trans	-62.3	-32	176.3	-177.1	0	0	0	0	112.5	P195 K197 L244 N245 T246 C250	P195-S248 VanDerWaalsContact CG-OG 3.27Å; P195-S248 WeakPolarHBondContact CG-OG 3.36Å; K197-S248 VanDerWaalsContact CD-O 3.26Å; K197-S248 WeakPolarHBondContact CD-O 3.29Å; K197-S248 PolarHBondContact NZ-O 2.88Å; L244-S248 WeakPolarHBondContact O-CB 3.35Å; L244-S248 PolarHBondContact O-N 2.68Å; N245-S248 PolarHBondContact O-N 3.36Å; T246-S248 PolarHBondContact O-N 3.21Å; S248-C250 PolarHBondContact O-N 3.22Å
249	S	97.6	Very high	95.9	Very high	15 Å²	15	33 Å²	33	11%	0.105	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-5.5	179.2	72.6	0	0	0	0	115.2	K197 N198 K199 N245 T246 M247	K197-S249 CarbonylContact C-O 3.36Å; K197-S249 WeakPolarHBondContact CA-O 3.35Å; N198-S249 PolarHBondContact N-O 3.4Å; N198-S249 WeakPolarHBondContact OD1-CB 3.36Å; N198-S249 PolarHBondContact OD1-O 3.37Å; K199-S249 PolarHBondContact N-O 2.88Å; K199-S249 VanDerWaalsContact N-O 3.08Å; K199-S249 PolarHBondContact NZ-OG 3.25Å; N245-S249 WeakPolarHBondContact O-CB 3.4Å; N245-S249 PolarHBondContact O-N 2.89Å; N245-S249 PolarHBondContact O-OG 3.03Å; T246-S249 PolarHBondContact O-N 3.48Å; T246-S249 VanDerWaalsContact O-N 3.16Å; T246-S249 PolarHBondContact O-OG 3.21Å; M247-S249 VanDerWaalsContact C-N 3.26Å; M247-S249 PolarHBondContact O-N 2.83Å
250	C	98.3	Very high	96	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	140.8	-175.6	-45.2	0	0	0	0	111.7	K197 K199 C202 T246 M247 S248 T277	K197-C250 WeakPolarHBondContact CD-O 3.41Å; K197-C250 PolarHBondContact NZ-O 2.95Å; K199-C250 HydrophobicContact CB-CB 4.25Å; K199-C250 CarbonylContact O-C 3.47Å; K199-C250 VanDerWaalsContact O-CA 3.27Å; K199-C250 WeakPolarHBondContact O-CA 3.31Å; C202-C250 HydrophobicContact CB-CB 3.69Å; C202-C250 WeakPolarHBondContact CB-SG 3.45Å; C202-C250 WeakPolarHBondContact SG-CB 3.35Å; C202-C250 CovalentContact SG-SG 2.01Å; C202-C250 PolarHBondContact SG-SG 2.78Å; T246-C250 PolarHBondContact O-SG 3.11Å; M247-C250 PolarHBondContact O-N 3.04Å; S248-C250 PolarHBondContact O-N 3.22Å; C250-T277 HydrophobicContact CB-CG2 4.42Å; C250-T277 VanDerWaalsContact O-CG2 3.26Å; C250-T277 WeakPolarHBondContact O-CG2 3.33Å; C250-T277 PolarHBondContact O-OG1 3.14Å
251	K	98.6	Very high	96.6	Very high	38 Å²	38	29.3 Å²	29.3	17%	0.165	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	-47.6	171.1	-76.6	-169.6	173.4	-178.1	0	110.8	K197 K199 L200 V278 D318 Y324	K197-K251 HydrophobicContact CB-CG 3.67Å; K197-K251 HydrophobicContact CG-CG 3.9Å; K199-K251 PolarHBondContact O-N 3.32Å; L200-K251 HydrophobicContact CD1-CD 4.29Å; L200-K251 PolarHBondContact O-N 3.15Å; K251-V278 PolarHBondContact O-N 3.14Å; K251-D318 VanDerWaalsContact CD-OD1 3.3Å; K251-D318 WeakPolarHBondContact CD-OD1 3.37Å; K251-D318 VanDerWaalsContact CE-OD1 3.31Å; K251-D318 WeakPolarHBondContact CE-OD1 2.96Å; K251-D318 PolarHBondContact NZ-O 2.65Å; K251-D318 IonicContact NZ-OD1 3.97Å; K251-D318 PolarHBondContact NZ-OD1 3.21Å; K251-Y324 HydrophobicContact CB-CE2 3.92Å; K251-Y324 HydrophobicContact CD-CE2 4.38Å; K251-Y324 HydrophobicContact CG-CE2 4.13Å
252	F	98.9	Very high	97	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	143.9	-179.4	-53.6	-73.3	0	0	0	111.7	L200 V201 C202 V278 V280 I299 L314 L317 Y324	L200-F252 HydrophobicContact CD1-CD2 3.85Å; L200-F252 HydrophobicContact CD1-CE2 3.8Å; L200-F252 WeakPolarHBondContact O-CD2 3.48Å; L200-F252 PolarHBondContact O-N 3.27Å; V201-F252 WeakPolarHBondContact CA-O 3.49Å; V201-F252 HydrophobicContact CG2-CB 4.3Å; V201-F252 HydrophobicContact CG2-CD2 4.44Å; C202-F252 PolarHBondContact N-O 2.86Å; F252-V278 VanDerWaalsContact CA-O 3.29Å; F252-V278 WeakPolarHBondContact CA-O 3.47Å; F252-V278 HydrophobicContact CD1-CB 3.78Å; F252-V278 HydrophobicContact CD1-CG1 4.09Å; F252-V278 HydrophobicContact CE1-CB 4.02Å; F252-V278 HydrophobicContact CE1-CG1 4.21Å; F252-V278 HydrophobicContact CE1-CG2 4.44Å; F252-V280 HydrophobicContact CB-CG2 4.09Å; F252-V280 HydrophobicContact CD1-CG2 4.39Å; F252-I299 HydrophobicContact CD1-CD1 4.01Å; F252-I299 HydrophobicContact CE1-CD1 3.79Å; F252-L314 HydrophobicContact CD1-CD2 3.7Å; F252-L314 HydrophobicContact CD2-CB 4.3Å; F252-L314 HydrophobicContact CD2-CD2 4.03Å; F252-L314 HydrophobicContact CE1-CD2 3.82Å; F252-L314 HydrophobicContact CE2-CB 4.21Å; F252-L314 HydrophobicContact CE2-CD2 4.12Å; F252-L314 HydrophobicContact CG-CD2 3.84Å; F252-L314 HydrophobicContact CZ-CD2 4.03Å; F252-L317 HydrophobicContact CE1-CD1 3.71Å; F252-L317 HydrophobicContact CE2-CB 4.39Å; F252-L317 HydrophobicContact CZ-CB 3.63Å; F252-L317 HydrophobicContact CZ-CD1 3.64Å; F252-L317 HydrophobicContact CZ-CG 4.31Å; F252-Y324 HydrophobicContact CE1-CD2 4.27Å; F252-Y324 HydrophobicContact CE1-CE2 4.33Å; F252-Y324 AromaticContact CZ-CD2 3.99Å; F252-Y324 HydrophobicContact CZ-CD2 3.99Å; F252-Y324 HydrophobicContact CZ-CE2 4.27Å
253	Y	98.9	Very high	97.2	Very high	4 Å²	4	26 Å²	26	2%	0.016	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	130.6	174.3	-174.9	-95.2	0	0	0	110.5	C202 I204 M247 S255 P272 V278 V280	C202-Y253 HydrophobicContact CB-CD2 4.19Å; C202-Y253 WeakPolarHBondContact O-CA 3.38Å; I204-Y253 HydrophobicContact CB-CE2 4.38Å; I204-Y253 HydrophobicContact CD1-CE2 3.95Å; I204-Y253 HydrophobicContact CG1-CE2 3.88Å; M247-Y253 HydrophobicContact CE-CD2 4.26Å; M247-Y253 HydrophobicContact CE-CE1 4.08Å; M247-Y253 HydrophobicContact CE-CE2 3.71Å; M247-Y253 HydrophobicContact CG-CD2 3.75Å; M247-Y253 HydrophobicContact CG-CE2 4.09Å; M247-Y253 HydrophobicContact CG-CG 4.13Å; M247-Y253 HydrophobicContact SD-CD2 4.38Å; M247-Y253 HydrophobicContact SD-CE2 4.41Å; M247-Y253 HydrophobicContact SD-CG 4.46Å; Y253-S255 WeakPolarHBondContact CD1-OG 3.43Å; Y253-S255 PolarHBondContact O-N 3.36Å; Y253-P272 HydrophobicContact CD1-CB 4.24Å; Y253-P272 HydrophobicContact CD1-CG 3.93Å; Y253-P272 HydrophobicContact CG-CB 4.26Å; Y253-P272 HydrophobicContact CG-CG 4.45Å; Y253-V278 PolarHBondContact N-O 2.85Å; Y253-V280 PolarHBondContact O-N 3.46Å
254	L	98.9	Very high	97.4	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.005	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	92.2	175.5	-58.9	-171	0	0	0	110.1	V201 C202 W203 Y218 L221 I227 F256 V280	V201-L254 HydrophobicContact CG1-CD1 4.39Å; V201-L254 HydrophobicContact CG1-CD2 3.69Å; V201-L254 HydrophobicContact CG1-CG 3.78Å; C202-L254 PolarHBondContact O-N 3.07Å; W203-L254 HydrophobicContact CB-CB 4.02Å; W203-L254 HydrophobicContact CB-CD1 4.03Å; W203-L254 HydrophobicContact CB-CG 4.22Å; W203-L254 VanDerWaalsContact CD1-CB 3.48Å; W203-L254 HydrophobicContact CD2-CB 4.41Å; W203-L254 HydrophobicContact CD2-CD1 4.21Å; W203-L254 HydrophobicContact CG-CB 3.74Å; W203-L254 HydrophobicContact CG-CD1 4.04Å; W203-L254 HydrophobicContact CG-CG 4.33Å; W203-L254 PolarHBondContact NE1-O 3.22Å; Y218-L254 HydrophobicContact CD2-CD1 4.24Å; L221-L254 HydrophobicContact CD2-CD1 4.23Å; L221-L254 HydrophobicContact CD2-CD2 4.01Å; I227-L254 HydrophobicContact CD1-CD1 4.11Å; I227-L254 HydrophobicContact CG2-CD1 4.11Å; L254-F256 HydrophobicContact CB-CD1 4.23Å; L254-F256 HydrophobicContact CB-CD2 4.36Å; L254-F256 HydrophobicContact CB-CE1 4.22Å; L254-F256 HydrophobicContact CB-CE2 4.34Å; L254-F256 HydrophobicContact CB-CG 4.32Å; L254-F256 HydrophobicContact CB-CZ 4.28Å; L254-F256 HydrophobicContact CD1-CE2 4.02Å; L254-F256 HydrophobicContact CD1-CZ 4.23Å; L254-F256 HydrophobicContact CD2-CE1 4.17Å; L254-F256 HydrophobicContact CD2-CZ 3.93Å; L254-F256 HydrophobicContact CG-CZ 4.37Å; L254-F256 PolarHBondContact O-N 3.05Å; L254-V280 CarbonylContact C-O 3.51Å; L254-V280 HydrophobicContact CD2-CB 3.93Å; L254-V280 HydrophobicContact CD2-CG1 4.14Å; L254-V280 HydrophobicContact CD2-CG2 4.42Å
255	S	98.6	Very high	97.5	Very high	1 Å²	1	22 Å²	22	1%	0.007	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	51.1	178.7	-66.8	0	0	0	0	111.8	Y253 K268 P272 P279 V280	Y253-S255 WeakPolarHBondContact CD1-OG 3.43Å; Y253-S255 PolarHBondContact O-N 3.36Å; S255-K268 WeakPolarHBondContact CB-O 3.39Å; S255-K268 PolarHBondContact OG-O 2.86Å; S255-P272 WeakPolarHBondContact OG-CG 3.45Å; S255-P279 WeakPolarHBondContact OG-CB 3.49Å; S255-V280 PolarHBondContact N-O 3.17Å
256	F	98.6	Very high	97.6	Very high	1 Å²	1	17.9 Å²	17.9	0%	0.004	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	117.4	-173.6	-65.2	-4.9	0	0	0	112.1	W203 R214 Y217 L254 K268 V280 L282 V301	W203-F256 HydrophobicContact CZ2-CB 4.43Å; W203-F256 HydrophobicContact CZ2-CD2 4.03Å; R214-F256 HydrophobicContact CB-CB 3.69Å; R214-F256 HydrophobicContact CB-CD2 3.93Å; R214-F256 HydrophobicContact CB-CG 4.25Å; R214-F256 PolarHBondContact NH1-O 3.46Å; Y217-F256 AromaticContact CD1-CE2 3.85Å; Y217-F256 HydrophobicContact CD1-CE2 3.85Å; Y217-F256 AromaticContact CD1-CZ 3.74Å; Y217-F256 HydrophobicContact CD1-CZ 3.74Å; Y217-F256 HydrophobicContact CE1-CZ 4.14Å; Y217-F256 HydrophobicContact CG-CE2 4.45Å; L254-F256 HydrophobicContact CB-CD1 4.23Å; L254-F256 HydrophobicContact CB-CD2 4.36Å; L254-F256 HydrophobicContact CB-CE1 4.22Å; L254-F256 HydrophobicContact CB-CE2 4.34Å; L254-F256 HydrophobicContact CB-CG 4.32Å; L254-F256 HydrophobicContact CB-CZ 4.28Å; L254-F256 HydrophobicContact CD1-CE2 4.02Å; L254-F256 HydrophobicContact CD1-CZ 4.23Å; L254-F256 HydrophobicContact CD2-CE1 4.17Å; L254-F256 HydrophobicContact CD2-CZ 3.93Å; L254-F256 HydrophobicContact CG-CZ 4.37Å; L254-F256 PolarHBondContact O-N 3.05Å; F256-K268 VanDerWaalsContact O-CD 3.28Å; F256-K268 WeakPolarHBondContact O-CD 3.4Å; F256-V280 WeakPolarHBondContact CD1-O 3.32Å; F256-V280 HydrophobicContact CE1-CG1 4.24Å; F256-V280 WeakPolarHBondContact CE1-O 3.48Å; F256-L282 HydrophobicContact CB-CB 4.31Å; F256-L282 HydrophobicContact CD1-CB 3.44Å; F256-L282 VanDerWaalsContact CD1-CB 3.44Å; F256-L282 HydrophobicContact CD2-CD2 4.17Å; F256-L282 HydrophobicContact CE1-CB 3.76Å; F256-L282 HydrophobicContact CE2-CD2 4.42Å; F256-L282 HydrophobicContact CG-CB 3.87Å; F256-L282 HydrophobicContact CG-CD2 4.2Å; F256-L282 HydrophobicContact CZ-CB 4.43Å; F256-V301 HydrophobicContact CE1-CG1 3.85Å; F256-V301 HydrophobicContact CZ-CG1 4.05Å
257	E	98.1	Very high	97.7	Very high	6 Å²	6	20.2 Å²	20.2	3%	0.028	11%	0.111	C	C	.	.			trans	-67.4	156	177.4	-66.8	-61.1	173	0	0	112.6	R214 S259 Y264 T266 K268 L282	R214-E257 WeakPolarHBondContact CD-O 3.47Å; E257-S259 WeakPolarHBondContact CB-O 3.35Å; E257-S259 PolarHBondContact O-N 3.28Å; E257-Y264 HydrophobicContact CB-CD1 4.42Å; E257-Y264 HydrophobicContact CB-CE1 4.31Å; E257-Y264 HydrophobicContact CG-CD1 4.48Å; E257-T266 VanDerWaalsContact OE1-CB 3.31Å; E257-T266 WeakPolarHBondContact OE1-CB 3.27Å; E257-T266 WeakPolarHBondContact OE1-CG2 3.49Å; E257-T266 PolarHBondContact OE1-N 3.28Å; E257-T266 PolarHBondContact OE1-OG1 2.9Å; E257-T266 WeakPolarHBondContact OE2-CG2 3.45Å; E257-T266 PolarHBondContact OE2-OG1 3.18Å; E257-K268 WeakPolarHBondContact OE2-CD 3.17Å; E257-K268 WeakPolarHBondContact OE2-CE 3.47Å; E257-K268 IonicContact OE2-NZ 3.32Å; E257-K268 PolarHBondContact OE2-NZ 3.03Å; E257-L282 PolarHBondContact N-O 3.35Å
258	N	96.2	Very high	97.8	Very high	21 Å²	21	21.7 Å²	21.7	11%	0.112	12%	0.118	C	C	.	.	S	Bend	trans	-74.6	-12.6	177.8	65.8	-2.3	0	0	0	112.8	E149 N153 Y264	E149-N258 PolarHBondContact OE1-ND2 2.81Å; N153-N258 PolarHBondContact ND2-ND2 3.01Å; N258-Y264 WeakPolarHBondContact OD1-CE1 3.34Å; N258-Y264 PolarHBondContact OD1-OH 3.44Å
259	S	95.6	Very high	97.8	Very high	18 Å²	18	20.4 Å²	20.4	13%	0.126	11%	0.109	C	C	.	.	S	Bend	trans	-163.1	161.8	177.9	58.3	0	0	0	0	110.2	S150 E257 H261	S150-S259 WeakPolarHBondContact CB-OG 3.43Å; S150-S259 PolarHBondContact OG-OG 3.18Å; E257-S259 WeakPolarHBondContact CB-O 3.35Å; E257-S259 PolarHBondContact O-N 3.28Å; S259-H261 PolarHBondContact OG-CD2 2.83Å
260	A	96.3	Very high	97.9	Very high	69 Å²	69	19.8 Å²	19.8	57%	0.57	10%	0.104	S	C	*	.			trans	-105.8	109.4	-179.8	0	0	0	0	0	109.7	G283	A260-G283 WeakPolarHBondContact CA-O 3.47Å; A260-G283 WeakPolarHBondContact CB-O 3.27Å
261	H	97.4	Very high	97.8	Very high	49 Å²	49	20.2 Å²	20.2	23%	0.227	11%	0.106	C	C	.	.			trans	-144.7	150.6	178.6	-73.7	-80.7	0	0	0	110.5	S152 S259 D263 Y264 T284	S152-H261 PolarHBondContact N-NE2 3.49Å; S152-H261 PolarHBondContact OG-NE2 3.5Å; S259-H261 PolarHBondContact OG-CD2 2.83Å; H261-D263 PolarHBondContact O-N 2.98Å; H261-Y264 WeakPolarHBondContact O-CB 3.48Å; H261-Y264 PolarHBondContact O-N 2.99Å; H261-Y264 VanDerWaalsContact O-N 3.07Å; H261-T284 WeakPolarHBondContact O-CB 3.38Å
262	K	97.2	Very high	97.7	Very high	106 Å²	106	18.4 Å²	18.4	46%	0.461	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	130.8	176.5	-179.7	-173.3	173.9	-169.2	0	110.5	D173 Y264	D173-K262 IonicContact OD2-NZ 3.23Å; D173-K262 PolarHBondContact OD2-NZ 2.75Å; K262-Y264 PolarHBondContact O-N 2.89Å
263	D	98	Very high	97.7	Very high	2 Å²	2	18.6 Å²	18.6	1%	0.011	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	59	5.1	179.2	-58.9	-23.5	0	0	0	114.9	Y170 R171 R172 H261 I265 N288 F292	Y170-D263 HydrophobicContact CD2-CB 4.43Å; Y170-D263 WeakPolarHBondContact CD2-O 3.05Å; R171-D263 HydrophobicContact CG-CB 4.32Å; R172-D263 IonicContact CZ-OD1 3.56Å; R172-D263 PolarHBondContact N-OD2 3.32Å; R172-D263 IonicContact NE-OD1 3.21Å; R172-D263 PolarHBondContact NE-OD1 3.44Å; R172-D263 IonicContact NE-OD2 3.49Å; R172-D263 IonicContact NH2-OD1 3.32Å; R172-D263 PolarHBondContact NH2-OD1 2.71Å; H261-D263 PolarHBondContact O-N 2.98Å; D263-I265 VanDerWaalsContact C-N 3.34Å; D263-I265 PolarHBondContact O-N 3.11Å; D263-N288 PolarHBondContact N-OD1 3.11Å; D263-N288 PolarHBondContact OD1-ND2 2.02Å; D263-F292 HydrophobicContact CB-CE2 4.14Å; D263-F292 HydrophobicContact CB-CZ 3.71Å; D263-F292 WeakPolarHBondContact OD1-CE2 3.37Å; D263-F292 WeakPolarHBondContact OD1-CZ 3.37Å
264	Y	98.3	Very high	97.5	Very high	3 Å²	3	19.6 Å²	19.6	1%	0.012	11%	0.107	C	C	.	.			trans	-79.2	83.5	-178.9	-174.8	-112.9	0	0	0	111.1	E149 Y170 E257 N258 H261 K262 T266	E149-Y264 PolarHBondContact OE1-OH 3.4Å; Y170-Y264 AromaticContact CD1-CD2 3.95Å; Y170-Y264 HydrophobicContact CD1-CD2 3.95Å; Y170-Y264 HydrophobicContact CD1-CE2 4.45Å; Y170-Y264 HydrophobicContact CD2-CD2 4.18Å; Y170-Y264 AromaticContact CE1-CD2 3.6Å; Y170-Y264 HydrophobicContact CE1-CD2 3.6Å; Y170-Y264 HydrophobicContact CE1-CE2 4.17Å; Y170-Y264 AromaticContact CE2-CD2 3.84Å; Y170-Y264 HydrophobicContact CE2-CD2 3.84Å; Y170-Y264 HydrophobicContact CE2-CG 4.22Å; Y170-Y264 HydrophobicContact CG-CD2 4.25Å; Y170-Y264 AromaticContact CZ-CD2 3.56Å; E257-Y264 HydrophobicContact CB-CD1 4.42Å; E257-Y264 HydrophobicContact CB-CE1 4.31Å; E257-Y264 HydrophobicContact CG-CD1 4.48Å; N258-Y264 WeakPolarHBondContact OD1-CE1 3.34Å; N258-Y264 PolarHBondContact OD1-OH 3.44Å; H261-Y264 WeakPolarHBondContact O-CB 3.48Å; H261-Y264 PolarHBondContact O-N 2.99Å; H261-Y264 VanDerWaalsContact O-N 3.07Å; K262-Y264 PolarHBondContact O-N 2.89Å; Y264-T266 HydrophobicContact CD1-CG2 4.48Å; Y264-T266 HydrophobicContact CD2-CG2 4.11Å; Y264-T266 HydrophobicContact CE1-CG2 3.95Å; Y264-T266 HydrophobicContact CE2-CG2 3.53Å; Y264-T266 VanDerWaalsContact CZ-CG2 3.45Å
265	I	98.3	Very high	97.4	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.01	12%	0.117	C	C	.	.			trans	-125.8	115.9	-178.6	-61.7	171.4	0	0	0	107.9	D263 L269 Y270 T284 Y289 F292	D263-I265 VanDerWaalsContact C-N 3.34Å; D263-I265 PolarHBondContact O-N 3.11Å; I265-L269 HydrophobicContact CG2-CB 3.78Å; I265-L269 HydrophobicContact CG2-CD2 3.3Å; I265-L269 HydrophobicContact CG2-CG 4.17Å; I265-Y270 HydrophobicContact CG2-CE2 3.92Å; I265-T284 HydrophobicContact CD1-CG2 4.08Å; I265-T284 HydrophobicContact CG1-CG2 4.03Å; I265-Y289 HydrophobicContact CB-CE1 4.36Å; I265-Y289 HydrophobicContact CD1-CD1 3.51Å; I265-Y289 HydrophobicContact CD1-CE1 3.85Å; I265-Y289 HydrophobicContact CD1-CG 3.98Å; I265-Y289 HydrophobicContact CG1-CD1 3.89Å; I265-Y289 HydrophobicContact CG1-CE1 3.65Å; I265-Y289 HydrophobicContact CG2-CD1 4.26Å; I265-Y289 HydrophobicContact CG2-CE1 3.91Å; I265-F292 HydrophobicContact CD1-CB 4.4Å; I265-F292 HydrophobicContact CD1-CD2 3.55Å; I265-F292 HydrophobicContact CD1-CE2 4.01Å; I265-F292 HydrophobicContact CD1-CG 4.11Å
266	T	97.9	Very high	97.3	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.116	C	C	.	.			trans	-110.1	-167.7	-165.3	72.6	0	0	0	0	113.3	Y180 E257 Y264 K268 L269 Y270	Y180-T266 HydrophobicContact CD2-CG2 4.05Å; Y180-T266 HydrophobicContact CE2-CG2 3.86Å; Y180-T266 HydrophobicContact CG-CG2 4.48Å; E257-T266 VanDerWaalsContact OE1-CB 3.31Å; E257-T266 WeakPolarHBondContact OE1-CB 3.27Å; E257-T266 WeakPolarHBondContact OE1-CG2 3.49Å; E257-T266 PolarHBondContact OE1-N 3.28Å; E257-T266 PolarHBondContact OE1-OG1 2.9Å; E257-T266 WeakPolarHBondContact OE2-CG2 3.45Å; E257-T266 PolarHBondContact OE2-OG1 3.18Å; Y264-T266 HydrophobicContact CD1-CG2 4.48Å; Y264-T266 HydrophobicContact CD2-CG2 4.11Å; Y264-T266 HydrophobicContact CE1-CG2 3.95Å; Y264-T266 HydrophobicContact CE2-CG2 3.53Å; Y264-T266 VanDerWaalsContact CZ-CG2 3.45Å; T266-K268 PolarHBondContact O-N 3.04Å; T266-K268 PolarHBondContact OG1-N 2.81Å; T266-K268 PolarHBondContact OG1-NZ 3.24Å; T266-L269 PolarHBondContact O-N 3.34Å; T266-L269 VanDerWaalsContact O-N 3.08Å; T266-Y270 WeakPolarHBondContact O-CD2 3.5Å
267	E	97.1	Very high	97.3	Very high	61 Å²	61	21.4 Å²	21.4	29%	0.285	12%	0.116	S	C	.	.	H	α-helix	trans	-51.7	-25.3	171.9	76.3	-67.6	153.6	0	0	113.1	Y180 L269 Y270 V271	Y180-E267 HydrophobicContact CD1-CB 4.46Å; Y180-E267 WeakPolarHBondContact CD1-OE2 3.3Å; Y180-E267 WeakPolarHBondContact CE1-OE2 3.49Å; E267-L269 PolarHBondContact O-N 3.44Å; E267-Y270 PolarHBondContact O-N 3.43Å; E267-V271 HydrophobicContact CB-CG2 3.99Å; E267-V271 WeakPolarHBondContact O-CB 3.23Å; E267-V271 WeakPolarHBondContact O-CG2 3.4Å; E267-V271 PolarHBondContact O-N 3.44Å
268	K	97.3	Very high	97.3	Very high	31 Å²	31	21.2 Å²	21.2	14%	0.135	12%	0.115	C	C	.	.	H	α-helix	trans	-60.2	-28.1	179.6	-67.2	175.1	-150	62.6	0	112.7	S255 F256 E257 T266 P272	S255-K268 WeakPolarHBondContact CB-O 3.39Å; S255-K268 PolarHBondContact OG-O 2.86Å; F256-K268 VanDerWaalsContact O-CD 3.28Å; F256-K268 WeakPolarHBondContact O-CD 3.4Å; E257-K268 WeakPolarHBondContact OE2-CD 3.17Å; E257-K268 WeakPolarHBondContact OE2-CE 3.47Å; E257-K268 IonicContact OE2-NZ 3.32Å; E257-K268 PolarHBondContact OE2-NZ 3.03Å; T266-K268 PolarHBondContact O-N 3.04Å; T266-K268 PolarHBondContact OG1-N 2.81Å; T266-K268 PolarHBondContact OG1-NZ 3.24Å; K268-P272 WeakPolarHBondContact O-CD 3.49Å; K268-P272 WeakPolarHBondContact O-CG 3.37Å
269	L	98.4	Very high	97.4	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-86.3	-51.3	172.6	-178.3	67.8	0	0	0	111.2	I265 T266 E267 V271 P272 L273 P279 V281 Y289 V293 F298	I265-L269 HydrophobicContact CG2-CB 3.78Å; I265-L269 HydrophobicContact CG2-CD2 3.3Å; I265-L269 HydrophobicContact CG2-CG 4.17Å; T266-L269 PolarHBondContact O-N 3.34Å; T266-L269 VanDerWaalsContact O-N 3.08Å; E267-L269 PolarHBondContact O-N 3.44Å; L269-V271 PolarHBondContact O-N 3.28Å; L269-P272 VanDerWaalsContact O-CD 3.25Å; L269-P272 WeakPolarHBondContact O-CD 3.45Å; L269-P272 VanDerWaalsContact O-CG 3.29Å; L269-P272 WeakPolarHBondContact O-CG 3.46Å; L269-L273 HydrophobicContact CD1-CD1 4.07Å; L269-L273 HydrophobicContact CD2-CD1 4.44Å; L269-L273 HydrophobicContact CG-CD1 3.82Å; L269-L273 VanDerWaalsContact O-CG 3.32Å; L269-L273 WeakPolarHBondContact O-CG 3.46Å; L269-L273 PolarHBondContact O-N 3.49Å; L269-P279 HydrophobicContact CD1-CB 3.83Å; L269-P279 HydrophobicContact CD1-CG 3.6Å; L269-V281 HydrophobicContact CD1-CG1 3.68Å; L269-Y289 HydrophobicContact CD2-CD1 3.93Å; L269-Y289 HydrophobicContact CD2-CE1 4.09Å; L269-V293 HydrophobicContact CD2-CG1 3.66Å; L269-V293 HydrophobicContact CD2-CG2 4.06Å; L269-F298 HydrophobicContact CD1-CB 4.47Å
270	Y	98.1	Very high	97.6	Very high	2 Å²	2	19.3 Å²	19.3	1%	0.008	10%	0.104	C	C	.	.	H	α-helix	trans	-72.8	-33.4	-168	-60.9	-71.4	0	0	0	113.6	G181 I265 T266 E267 S274 V293 V336	G181-Y270 VanDerWaalsContact C-CE1 3.44Å; G181-Y270 VanDerWaalsContact C-CZ 3.45Å; G181-Y270 PolarHBondContact O-OH 2.65Å; I265-Y270 HydrophobicContact CG2-CE2 3.92Å; T266-Y270 WeakPolarHBondContact O-CD2 3.5Å; E267-Y270 PolarHBondContact O-N 3.43Å; Y270-S274 WeakPolarHBondContact O-CB 3.18Å; Y270-S274 PolarHBondContact O-N 2.82Å; Y270-S274 PolarHBondContact O-OG 3.34Å; Y270-V293 HydrophobicContact CE1-CG1 4.18Å; Y270-V336 HydrophobicContact CD1-CG1 4.04Å; Y270-V336 HydrophobicContact CG-CG1 4.47Å
271	V	96.9	Very high	97.7	Very high	8 Å²	8	16 Å²	16	5%	0.048	8%	0.077	C	C	.	.	H	α-helix	trans	-62.7	-53.9	177.2	-176	0	0	0	0	111.6	Y243 L244 M247 E267 L269 L273 S274 M275	Y243-V271 HydrophobicContact CE1-CG1 4.22Å; L244-V271 HydrophobicContact CD2-CG1 3.87Å; M247-V271 HydrophobicContact CE-CB 4.26Å; M247-V271 HydrophobicContact CE-CG1 3.77Å; M247-V271 HydrophobicContact SD-CB 3.97Å; M247-V271 HydrophobicContact SD-CG1 3.49Å; M247-V271 WeakPolarHBondContact SD-CG1 3.37Å; E267-V271 HydrophobicContact CB-CG2 3.99Å; E267-V271 WeakPolarHBondContact O-CB 3.23Å; E267-V271 WeakPolarHBondContact O-CG2 3.4Å; E267-V271 PolarHBondContact O-N 3.44Å; L269-V271 PolarHBondContact O-N 3.28Å; V271-L273 VanDerWaalsContact C-N 3.34Å; V271-L273 PolarHBondContact O-N 3.2Å; V271-S274 PolarHBondContact O-N 2.79Å; V271-S274 VanDerWaalsContact O-N 3.15Å; V271-S274 PolarHBondContact O-OG 2.95Å; V271-M275 HydrophobicContact CG1-CG 4.31Å; V271-M275 VanDerWaalsContact O-CG 3.3Å; V271-M275 WeakPolarHBondContact O-CG 2.89Å; V271-M275 PolarHBondContact O-N 3.41Å
272	P	97.6	Very high	97.8	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-62.2	-39.2	179.3	19.9	-29.8	0	0	0	113	M247 Y253 S255 K268 L269 S274 M275 G276 T277 P279	M247-P272 HydrophobicContact CG-CB 4.16Å; M247-P272 WeakPolarHBondContact SD-CA 3.19Å; M247-P272 HydrophobicContact SD-CB 3.66Å; M247-P272 WeakPolarHBondContact SD-CD 3.2Å; M247-P272 HydrophobicContact SD-CG 4.08Å; Y253-P272 HydrophobicContact CD1-CB 4.24Å; Y253-P272 HydrophobicContact CD1-CG 3.93Å; Y253-P272 HydrophobicContact CG-CB 4.26Å; Y253-P272 HydrophobicContact CG-CG 4.45Å; S255-P272 WeakPolarHBondContact OG-CG 3.45Å; K268-P272 WeakPolarHBondContact O-CD 3.49Å; K268-P272 WeakPolarHBondContact O-CG 3.37Å; L269-P272 VanDerWaalsContact O-CD 3.25Å; L269-P272 WeakPolarHBondContact O-CD 3.45Å; L269-P272 VanDerWaalsContact O-CG 3.29Å; L269-P272 WeakPolarHBondContact O-CG 3.46Å; P272-S274 VanDerWaalsContact C-N 3.3Å; P272-S274 PolarHBondContact O-N 2.88Å; P272-M275 CarbonylContact O-C 3.33Å; P272-M275 PolarHBondContact O-N 2.8Å; P272-G276 PolarHBondContact O-N 2.91Å; P272-G276 VanDerWaalsContact O-N 3.17Å; P272-T277 CarbonylContact C-O 3.27Å; P272-T277 VanDerWaalsContact C-O 3.27Å; P272-T277 HydrophobicContact CB-CG2 4.2Å; P272-T277 PolarHBondContact O-N 2.87Å; P272-T277 VanDerWaalsContact O-O 3.1Å; P272-P279 HydrophobicContact CG-CB 4.1Å
273	L	97.7	Very high	97.8	Very high	5 Å²	5	10.8 Å²	10.8	3%	0.026	6%	0.058	C	C	.	.	H	α-helix	trans	-57.1	-44	174.2	-69.9	175.3	0	0	0	111.9	I183 L269 V271 M275 G276 P279 V293 A297 W330 V336	I183-L273 HydrophobicContact CD1-CD1 4.38Å; L269-L273 HydrophobicContact CD1-CD1 4.07Å; L269-L273 HydrophobicContact CD2-CD1 4.44Å; L269-L273 HydrophobicContact CG-CD1 3.82Å; L269-L273 VanDerWaalsContact O-CG 3.32Å; L269-L273 WeakPolarHBondContact O-CG 3.46Å; L269-L273 PolarHBondContact O-N 3.49Å; V271-L273 VanDerWaalsContact C-N 3.34Å; V271-L273 PolarHBondContact O-N 3.2Å; L273-M275 VanDerWaalsContact C-N 3.27Å; L273-M275 PolarHBondContact O-N 3.32Å; L273-G276 PolarHBondContact O-N 2.92Å; L273-P279 HydrophobicContact CD2-CG 3.69Å; L273-P279 HydrophobicContact CG-CG 3.98Å; L273-V293 HydrophobicContact CD1-CG1 4.04Å; L273-A297 HydrophobicContact CD2-CB 4.13Å; L273-A297 VanDerWaalsContact CD2-O 3.32Å; L273-A297 WeakPolarHBondContact CD2-O 3.46Å; L273-W330 HydrophobicContact CB-CH2 4.42Å; L273-W330 HydrophobicContact CB-CZ2 4.34Å; L273-W330 HydrophobicContact CD2-CZ2 3.81Å; L273-V336 HydrophobicContact CB-CG2 3.67Å
274	S	95.8	Very high	97.8	Very high	24 Å²	24	11.4 Å²	11.4	17%	0.168	6%	0.062	C	C	.	.	H	α-helix	trans	-65.6	-28.9	176.6	71.3	0	0	0	0	113.4	Y270 V271 P272 G276	Y270-S274 WeakPolarHBondContact O-CB 3.18Å; Y270-S274 PolarHBondContact O-N 2.82Å; Y270-S274 PolarHBondContact O-OG 3.34Å; V271-S274 PolarHBondContact O-N 2.79Å; V271-S274 VanDerWaalsContact O-N 3.15Å; V271-S274 PolarHBondContact O-OG 2.95Å; P272-S274 VanDerWaalsContact C-N 3.3Å; P272-S274 PolarHBondContact O-N 2.88Å; S274-G276 VanDerWaalsContact C-N 3.33Å
275	M	95.7	Very high	97.8	Very high	42 Å²	42	15 Å²	15	21%	0.207	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	5.6	-179.3	-60.9	-63.6	95.7	0	0	113.1	P195 L244 V271 P272 L273 T277	P195-M275 WeakPolarHBondContact CG-O 3.42Å; L244-M275 HydrophobicContact CB-SD 4.23Å; L244-M275 HydrophobicContact CD2-SD 4.21Å; V271-M275 HydrophobicContact CG1-CG 4.31Å; V271-M275 VanDerWaalsContact O-CG 3.3Å; V271-M275 WeakPolarHBondContact O-CG 2.89Å; V271-M275 PolarHBondContact O-N 3.41Å; P272-M275 CarbonylContact O-C 3.33Å; P272-M275 PolarHBondContact O-N 2.8Å; L273-M275 VanDerWaalsContact C-N 3.27Å; L273-M275 PolarHBondContact O-N 3.32Å; M275-T277 VanDerWaalsContact C-N 3.34Å; M275-T277 PolarHBondContact O-N 3.37Å
276	G	96.5	Very high	97.8	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	33	-178.1	0	0	0	0	0	113.1	K197 P272 L273 S274 F328	K197-G276 WeakPolarHBondContact CE-O 3.41Å; K197-G276 PolarHBondContact NZ-O 3.47Å; P272-G276 PolarHBondContact O-N 2.91Å; P272-G276 VanDerWaalsContact O-N 3.17Å; L273-G276 PolarHBondContact O-N 2.92Å; S274-G276 VanDerWaalsContact C-N 3.33Å; G276-F328 VanDerWaalsContact C-CE1 3.48Å; G276-F328 WeakPolarHBondContact O-CE1 3.49Å; G276-F328 VanDerWaalsContact O-CZ 3.27Å; G276-F328 WeakPolarHBondContact O-CZ 3.35Å
277	T	98.3	Very high	97.8	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.125	C	C	.	.			trans	-116.4	134.3	178.3	-65.9	0	0	0	0	108.9	K197 M247 C250 P272 M275 P279	K197-T277 PolarHBondContact NZ-OG1 2.01Å; M247-T277 PolarHBondContact O-OG1 3.29Å; C250-T277 HydrophobicContact CB-CG2 4.42Å; C250-T277 VanDerWaalsContact O-CG2 3.26Å; C250-T277 WeakPolarHBondContact O-CG2 3.33Å; C250-T277 PolarHBondContact O-OG1 3.14Å; P272-T277 CarbonylContact C-O 3.27Å; P272-T277 VanDerWaalsContact C-O 3.27Å; P272-T277 HydrophobicContact CB-CG2 4.2Å; P272-T277 PolarHBondContact O-N 2.87Å; P272-T277 VanDerWaalsContact O-O 3.1Å; M275-T277 VanDerWaalsContact C-N 3.34Å; M275-T277 PolarHBondContact O-N 3.37Å; T277-P279 VanDerWaalsContact O-CD 3.27Å; T277-P279 WeakPolarHBondContact O-CD 3.38Å
278	V	98.8	Very high	97.8	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.006	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	117.9	-176.7	-177.7	0	0	0	0	109.4	K251 F252 Y253 I299 Y324 Y327 F328	K251-V278 PolarHBondContact O-N 3.14Å; F252-V278 VanDerWaalsContact CA-O 3.29Å; F252-V278 WeakPolarHBondContact CA-O 3.47Å; F252-V278 HydrophobicContact CD1-CB 3.78Å; F252-V278 HydrophobicContact CD1-CG1 4.09Å; F252-V278 HydrophobicContact CE1-CB 4.02Å; F252-V278 HydrophobicContact CE1-CG1 4.21Å; F252-V278 HydrophobicContact CE1-CG2 4.44Å; Y253-V278 PolarHBondContact N-O 2.85Å; V278-I299 HydrophobicContact CG1-CD1 4.03Å; V278-I299 HydrophobicContact CG1-CG1 4.1Å; V278-Y324 HydrophobicContact CG2-CD2 4.39Å; V278-Y324 HydrophobicContact CG2-CE2 3.81Å; V278-Y327 HydrophobicContact CG1-CD1 3.7Å; V278-Y327 HydrophobicContact CG1-CE1 4.28Å; V278-Y327 HydrophobicContact CG1-CG 3.9Å; V278-Y327 HydrophobicContact CG2-CG 4.13Å; V278-F328 HydrophobicContact CG2-CE1 4.07Å; V278-F328 HydrophobicContact CG2-CE2 4.06Å; V278-F328 HydrophobicContact CG2-CZ 3.55Å
279	P	98.8	Very high	97.9	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	132.7	177.3	30.2	-33.7	0	0	0	111.4	S255 L269 P272 L273 T277 V281 A297 F298 I299	S255-P279 WeakPolarHBondContact OG-CB 3.49Å; L269-P279 HydrophobicContact CD1-CB 3.83Å; L269-P279 HydrophobicContact CD1-CG 3.6Å; P272-P279 HydrophobicContact CG-CB 4.1Å; L273-P279 HydrophobicContact CD2-CG 3.69Å; L273-P279 HydrophobicContact CG-CG 3.98Å; T277-P279 VanDerWaalsContact O-CD 3.27Å; T277-P279 WeakPolarHBondContact O-CD 3.38Å; P279-V281 HydrophobicContact CB-CG1 4.07Å; P279-A297 WeakPolarHBondContact CD-O 3.46Å; P279-F298 HydrophobicContact CG-CB 3.7Å; P279-F298 WeakPolarHBondContact O-CA 3Å; P279-I299 PolarHBondContact O-N 3.2Å
280	V	98.9	Very high	97.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	110.3	166.1	-176.6	0	0	0	0	107	F252 Y253 L254 S255 F256 I299 V301 L310 L314	F252-V280 HydrophobicContact CB-CG2 4.09Å; F252-V280 HydrophobicContact CD1-CG2 4.39Å; Y253-V280 PolarHBondContact O-N 3.46Å; L254-V280 CarbonylContact C-O 3.51Å; L254-V280 HydrophobicContact CD2-CB 3.93Å; L254-V280 HydrophobicContact CD2-CG1 4.14Å; L254-V280 HydrophobicContact CD2-CG2 4.42Å; S255-V280 PolarHBondContact N-O 3.17Å; F256-V280 WeakPolarHBondContact CD1-O 3.32Å; F256-V280 HydrophobicContact CE1-CG1 4.24Å; F256-V280 WeakPolarHBondContact CE1-O 3.48Å; V280-I299 CarbonylContact C-O 3.52Å; V280-I299 VanDerWaalsContact CA-O 3.31Å; V280-I299 WeakPolarHBondContact CA-O 3.46Å; V280-I299 HydrophobicContact CG1-CG2 4.5Å; V280-I299 HydrophobicContact CG2-CB 4.32Å; V280-I299 HydrophobicContact CG2-CD1 4.47Å; V280-V301 HydrophobicContact CG1-CG1 4.2Å; V280-L310 HydrophobicContact CG1-CD1 4.16Å; V280-L310 HydrophobicContact CG1-CD2 3.95Å; V280-L314 HydrophobicContact CG2-CD1 4.26Å; V280-L314 HydrophobicContact CG2-CD2 4.09Å
281	V	98.9	Very high	97.8	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	143.7	-164.9	-52.8	0	0	0	0	112.2	L269 P279 Y289 F298 I299 H300 V301	L269-V281 HydrophobicContact CD1-CG1 3.68Å; P279-V281 HydrophobicContact CB-CG1 4.07Å; V281-Y289 HydrophobicContact CB-CE1 4.02Å; V281-Y289 HydrophobicContact CB-CE2 4.1Å; V281-Y289 HydrophobicContact CG1-CE1 4.07Å; V281-Y289 HydrophobicContact CG2-CD1 4.41Å; V281-Y289 HydrophobicContact CG2-CD2 3.97Å; V281-Y289 HydrophobicContact CG2-CE1 4.19Å; V281-Y289 HydrophobicContact CG2-CE2 3.72Å; V281-Y289 HydrophobicContact CG2-CG 4.33Å; V281-F298 HydrophobicContact CG1-CB 4.23Å; V281-F298 HydrophobicContact CG1-CD2 4.2Å; V281-F298 HydrophobicContact CG2-CD2 3.51Å; V281-F298 HydrophobicContact CG2-CE2 3.86Å; V281-I299 PolarHBondContact N-O 3.31Å; V281-H300 HydrophobicContact CG2-CB 4.15Å; V281-H300 WeakPolarHBondContact CG2-CD2 3.48Å; V281-V301 WeakPolarHBondContact O-CG1 3.46Å; V281-V301 WeakPolarHBondContact O-CG2 3.29Å; V281-V301 PolarHBondContact O-N 2.78Å
282	L	98.6	Very high	97.8	Very high	31 Å²	31	28.4 Å²	28.4	16%	0.162	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	119.4	169.3	169	68	0	0	0	106.7	R214 Y217 F256 E257 V301	R214-L282 HydrophobicContact CB-CD2 4.14Å; Y217-L282 HydrophobicContact CG-CD2 4.24Å; F256-L282 HydrophobicContact CB-CB 4.31Å; F256-L282 HydrophobicContact CD1-CB 3.44Å; F256-L282 VanDerWaalsContact CD1-CB 3.44Å; F256-L282 HydrophobicContact CD2-CD2 4.17Å; F256-L282 HydrophobicContact CE1-CB 3.76Å; F256-L282 HydrophobicContact CE2-CD2 4.42Å; F256-L282 HydrophobicContact CG-CB 3.87Å; F256-L282 HydrophobicContact CG-CD2 4.2Å; F256-L282 HydrophobicContact CZ-CB 4.43Å; E257-L282 PolarHBondContact N-O 3.35Å; L282-V301 HydrophobicContact CB-CG1 4.24Å; L282-V301 HydrophobicContact CB-CG2 3.9Å; L282-V301 HydrophobicContact CD1-CG2 3.57Å; L282-V301 HydrophobicContact CG-CG2 4.27Å
283	G	97.6	Very high	97.8	Very high	13 Å²	13	28.6 Å²	28.6	13%	0.134	15%	0.149	C	C	.	.	S	Bend	trans	179.2	-110	-173.1	0	0	0	0	0	110.9	A260	A260-G283 WeakPolarHBondContact CA-O 3.47Å; A260-G283 WeakPolarHBondContact CB-O 3.27Å
284	T	97.8	Very high	97.7	Very high	15 Å²	15	30.2 Å²	30.2	9%	0.092	16%	0.16	C	C	.	.	S	Bend	trans	-76.7	-178.2	170.1	-166	0	0	0	0	111.6	H261 I265 N288 Y289 H300	H261-T284 WeakPolarHBondContact O-CB 3.38Å; I265-T284 HydrophobicContact CD1-CG2 4.08Å; I265-T284 HydrophobicContact CG1-CG2 4.03Å; T284-N288 WeakPolarHBondContact CB-OD1 3.46Å; T284-N288 HydrophobicContact CG2-CB 3.74Å; T284-N288 WeakPolarHBondContact CG2-OD1 3.28Å; T284-N288 WeakPolarHBondContact OG1-CB 3.22Å; T284-N288 PolarHBondContact OG1-OD1 2.9Å; T284-Y289 HydrophobicContact CG2-CD2 3.68Å; T284-Y289 HydrophobicContact CG2-CE2 3.64Å; T284-Y289 HydrophobicContact CG2-CG 4.28Å; T284-Y289 WeakPolarHBondContact O-CE2 3.26Å; T284-H300 PolarHBondContact O-NE2 2.66Å
285	T	98.3	Very high	97.8	Very high	80 Å²	80	36.3 Å²	36.3	49%	0.491	18%	0.179	S	C	.	.			trans	-68.3	156	179.6	67.5	0	0	0	0	112.7	E287 N288 Y289	T285-E287 PolarHBondContact O-N 3.25Å; T285-N288 WeakPolarHBondContact O-CA 2.98Å; T285-N288 WeakPolarHBondContact O-CB 3.05Å; T285-N288 PolarHBondContact O-N 2.86Å; T285-N288 VanDerWaalsContact OG1-CB 3.29Å; T285-N288 WeakPolarHBondContact OG1-CB 3.48Å; T285-N288 PolarHBondContact OG1-N 2.88Å; T285-Y289 WeakPolarHBondContact O-CD2 3.23Å; T285-Y289 PolarHBondContact O-N 3.13Å
286	R	98.1	Very high	97.8	Very high	44 Å²	44	39.2 Å²	39.2	17%	0.166	20%	0.195	C	C	.	.	H	α-helix	trans	-50.1	-52.5	174	177.1	48.2	148.2	133.8	-21	112.5	N288 Y289 E290 R295 F298 H300 D303	R286-N288 VanDerWaalsContact C-N 3.25Å; R286-N288 PolarHBondContact O-N 3.08Å; R286-Y289 WeakPolarHBondContact O-CB 3.43Å; R286-Y289 PolarHBondContact O-N 3.01Å; R286-Y289 VanDerWaalsContact O-N 3.12Å; R286-E290 IonicContact CZ-OE1 2.91Å; R286-E290 IonicContact NE-OE1 2.66Å; R286-E290 IonicContact NH1-OE1 2.9Å; R286-E290 PolarHBondContact NH1-OE1 2.83Å; R286-E290 PolarHBondContact O-N 3.45Å; R286-E290 VanDerWaalsContact O-N 3.15Å; R286-R295 PolarHBondContact NH1-O 3.46Å; R286-R295 PolarHBondContact NH2-O 3.15Å; R286-F298 VanDerWaalsContact CZ-CZ 3.47Å; R286-F298 PolarHBondContact NH2-O 2.99Å; R286-H300 HydrophobicContact CB-CB 4.31Å; R286-H300 HydrophobicContact CG-CB 4.32Å; R286-H300 PolarHBondContact N-NE2 3.08Å; R286-D303 IonicContact CZ-OD2 2.67Å; R286-D303 IonicContact NE-OD1 3.53Å; R286-D303 PolarHBondContact NE-OD1 3.16Å; R286-D303 IonicContact NE-OD2 3.39Å; R286-D303 PolarHBondContact NE-OD2 2.88Å; R286-D303 IonicContact NH2-OD2 3.53Å
287	E	98.3	Very high	97.9	Very high	146 Å²	146	39.2 Å²	39.2	68%	0.682	20%	0.196	S	C	*	.	H	α-helix	trans	-57.5	-39.1	176.4	-175.2	-172.8	174.9	0	0	111.8	T285 Y289 E290 N291	T285-E287 PolarHBondContact O-N 3.25Å; E287-Y289 PolarHBondContact O-N 3.17Å; E287-E290 PolarHBondContact O-N 3.18Å; E287-N291 PolarHBondContact O-N 2.04Å; E287-N291 PolarHBondContact O-ND2 3.29Å
288	N	98.3	Very high	97.9	Very high	13 Å²	13	39.2 Å²	39.2	7%	0.07	20%	0.196	C	C	.	.	H	α-helix	trans	-68.5	-34.2	179.2	-169.6	-161.9	0	0	0	112.2	D263 T284 T285 R286 N291 F292	D263-N288 PolarHBondContact N-OD1 3.11Å; D263-N288 PolarHBondContact OD1-ND2 2.02Å; T284-N288 WeakPolarHBondContact CB-OD1 3.46Å; T284-N288 HydrophobicContact CG2-CB 3.74Å; T284-N288 WeakPolarHBondContact CG2-OD1 3.28Å; T284-N288 WeakPolarHBondContact OG1-CB 3.22Å; T284-N288 PolarHBondContact OG1-OD1 2.9Å; T285-N288 WeakPolarHBondContact O-CA 2.98Å; T285-N288 WeakPolarHBondContact O-CB 3.05Å; T285-N288 PolarHBondContact O-N 2.86Å; T285-N288 VanDerWaalsContact OG1-CB 3.29Å; T285-N288 WeakPolarHBondContact OG1-CB 3.48Å; T285-N288 PolarHBondContact OG1-N 2.88Å; R286-N288 VanDerWaalsContact C-N 3.25Å; R286-N288 PolarHBondContact O-N 3.08Å; N288-N291 WeakPolarHBondContact O-CB 3.48Å; N288-N291 PolarHBondContact O-N 3.14Å; N288-F292 WeakPolarHBondContact O-CD2 3.49Å
289	Y	98.4	Very high	97.9	Very high	1 Å²	1	39.2 Å²	39.2	0%	0.004	20%	0.196	C	C	.	.	H	α-helix	trans	-64.1	-39.6	170.2	-82.3	-83.4	0	0	0	112.7	I265 L269 V281 T284 T285 R286 E287 N291 F292 V293 F298 H300	I265-Y289 HydrophobicContact CB-CE1 4.36Å; I265-Y289 HydrophobicContact CD1-CD1 3.51Å; I265-Y289 HydrophobicContact CD1-CE1 3.85Å; I265-Y289 HydrophobicContact CD1-CG 3.98Å; I265-Y289 HydrophobicContact CG1-CD1 3.89Å; I265-Y289 HydrophobicContact CG1-CE1 3.65Å; I265-Y289 HydrophobicContact CG2-CD1 4.26Å; I265-Y289 HydrophobicContact CG2-CE1 3.91Å; L269-Y289 HydrophobicContact CD2-CD1 3.93Å; L269-Y289 HydrophobicContact CD2-CE1 4.09Å; V281-Y289 HydrophobicContact CB-CE1 4.02Å; V281-Y289 HydrophobicContact CB-CE2 4.1Å; V281-Y289 HydrophobicContact CG1-CE1 4.07Å; V281-Y289 HydrophobicContact CG2-CD1 4.41Å; V281-Y289 HydrophobicContact CG2-CD2 3.97Å; V281-Y289 HydrophobicContact CG2-CE1 4.19Å; V281-Y289 HydrophobicContact CG2-CE2 3.72Å; V281-Y289 HydrophobicContact CG2-CG 4.33Å; T284-Y289 HydrophobicContact CG2-CD2 3.68Å; T284-Y289 HydrophobicContact CG2-CE2 3.64Å; T284-Y289 HydrophobicContact CG2-CG 4.28Å; T284-Y289 WeakPolarHBondContact O-CE2 3.26Å; T285-Y289 WeakPolarHBondContact O-CD2 3.23Å; T285-Y289 PolarHBondContact O-N 3.13Å; R286-Y289 WeakPolarHBondContact O-CB 3.43Å; R286-Y289 PolarHBondContact O-N 3.01Å; R286-Y289 VanDerWaalsContact O-N 3.12Å; E287-Y289 PolarHBondContact O-N 3.17Å; Y289-N291 PolarHBondContact O-N 2.98Å; Y289-N291 VanDerWaalsContact O-N 3.14Å; Y289-F292 PolarHBondContact O-N 3.17Å; Y289-V293 WeakPolarHBondContact O-CG2 3.43Å; Y289-V293 PolarHBondContact O-N 3.01Å; Y289-V293 VanDerWaalsContact O-N 3.09Å; Y289-F298 HydrophobicContact CD2-CE2 4.43Å; Y289-F298 HydrophobicContact CG-CE2 4.03Å; Y289-F298 HydrophobicContact CG-CZ 4.1Å; Y289-H300 AromaticContact CD2-CD2 3.68Å; Y289-H300 AromaticContact CD2-NE2 3.82Å; Y289-H300 AromaticContact CE2-CD2 3.97Å; Y289-H300 AromaticContact CE2-NE2 3.84Å
290	E	97.9	Very high	97.9	Very high	72 Å²	72	39.3 Å²	39.3	34%	0.336	20%	0.196	S	C	.	.	H	α-helix	trans	-63.7	-19.2	-179.8	-68.3	-177.1	179	0	0	113.7	R286 E287 F292 V293 R295 F298	R286-E290 IonicContact CZ-OE1 2.91Å; R286-E290 IonicContact NE-OE1 2.66Å; R286-E290 IonicContact NH1-OE1 2.9Å; R286-E290 PolarHBondContact NH1-OE1 2.83Å; R286-E290 PolarHBondContact O-N 3.45Å; R286-E290 VanDerWaalsContact O-N 3.15Å; E287-E290 PolarHBondContact O-N 3.18Å; E290-F292 PolarHBondContact O-N 2.94Å; E290-V293 WeakPolarHBondContact CA-O 3.06Å; E290-R295 HydrophobicContact CG-CB 3.89Å; E290-R295 WeakPolarHBondContact OE1-CB 3.42Å; E290-F298 HydrophobicContact CG-CE1 4.31Å; E290-F298 HydrophobicContact CG-CZ 4.1Å
291	N	97.1	Very high	97.9	Very high	79 Å²	79	39.4 Å²	39.4	42%	0.422	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-15.5	170.9	-76.7	-86.4	0	0	0	114.1	R172 E287 N288 Y289	R172-N291 VanDerWaalsContact NH1-CB 3.33Å; R172-N291 VanDerWaalsContact NH1-CG 3.29Å; R172-N291 PolarHBondContact NH1-OD1 3.05Å; R172-N291 PolarHBondContact NH2-OD1 3.1Å; E287-N291 PolarHBondContact O-N 2.04Å; E287-N291 PolarHBondContact O-ND2 3.29Å; N288-N291 WeakPolarHBondContact O-CB 3.48Å; N288-N291 PolarHBondContact O-N 3.14Å; Y289-N291 PolarHBondContact O-N 2.98Å; Y289-N291 VanDerWaalsContact O-N 3.14Å
292	F	96.8	Very high	97.8	Very high	31 Å²	31	44.8 Å²	44.8	14%	0.136	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.9	-29.3	-174.5	-64.5	-91.8	0	0	0	113.7	R172 D263 I265 N288 Y289 E290	R172-F292 VanDerWaalsContact CD-CZ 3.45Å; R172-F292 HydrophobicContact CG-CE1 3.73Å; R172-F292 HydrophobicContact CG-CZ 3.57Å; D263-F292 HydrophobicContact CB-CE2 4.14Å; D263-F292 HydrophobicContact CB-CZ 3.71Å; D263-F292 WeakPolarHBondContact OD1-CE2 3.37Å; D263-F292 WeakPolarHBondContact OD1-CZ 3.37Å; I265-F292 HydrophobicContact CD1-CB 4.4Å; I265-F292 HydrophobicContact CD1-CD2 3.55Å; I265-F292 HydrophobicContact CD1-CE2 4.01Å; I265-F292 HydrophobicContact CD1-CG 4.11Å; N288-F292 WeakPolarHBondContact O-CD2 3.49Å; Y289-F292 PolarHBondContact O-N 3.17Å; E290-F292 PolarHBondContact O-N 2.94Å
293	V	96.8	Very high	97.8	Very high	4 Å²	4	47 Å²	47	2%	0.024	24%	0.237	C	C	.	.	S	Bend	trans	-135.6	149.8	-178.2	-62	0	0	0	0	110.4	I183 L269 Y270 L273 Y289 E290 R295 F298	I183-V293 HydrophobicContact CD1-CG1 4.1Å; I183-V293 HydrophobicContact CG1-CB 4.2Å; I183-V293 HydrophobicContact CG1-CG1 3.73Å; L269-V293 HydrophobicContact CD2-CG1 3.66Å; L269-V293 HydrophobicContact CD2-CG2 4.06Å; Y270-V293 HydrophobicContact CE1-CG1 4.18Å; L273-V293 HydrophobicContact CD1-CG1 4.04Å; Y289-V293 WeakPolarHBondContact O-CG2 3.43Å; Y289-V293 PolarHBondContact O-N 3.01Å; Y289-V293 VanDerWaalsContact O-N 3.09Å; E290-V293 WeakPolarHBondContact CA-O 3.06Å; V293-R295 PolarHBondContact O-N 2.89Å; V293-F298 HydrophobicContact CG2-CD1 3.45Å; V293-F298 VanDerWaalsContact CG2-CD1 3.45Å; V293-F298 HydrophobicContact CG2-CE1 3.48Å; V293-F298 VanDerWaalsContact CG2-CE1 3.48Å; V293-F298 HydrophobicContact CG2-CG 4.46Å; V293-F298 HydrophobicContact CG2-CZ 4.49Å
294	P	97.1	Very high	97.9	Very high	39 Å²	39	47.9 Å²	47.9	25%	0.253	24%	0.238	S	C	.	.			trans	-52.5	139.8	174.5	-26.9	35	0	0	0	111.7	D296 A297 W330	P294-D296 PolarHBondContact O-N 2.83Å; P294-D296 VanDerWaalsContact O-N 3.08Å; P294-A297 HydrophobicContact CB-CB 4.27Å; P294-A297 VanDerWaalsContact O-CB 3.22Å; P294-A297 WeakPolarHBondContact O-CB 3.42Å; P294-A297 PolarHBondContact O-N 2.87Å; P294-W330 HydrophobicContact CB-CB 3.94Å; P294-W330 HydrophobicContact CB-CG 4.33Å; P294-W330 HydrophobicContact CG-CB 3.84Å; P294-W330 HydrophobicContact CG-CD2 4.45Å; P294-W330 HydrophobicContact CG-CG 4.18Å
295	R	96.7	Very high	97.9	Very high	152 Å²	152	56.7 Å²	56.7	57%	0.574	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-56.7	-30.8	-174.7	69.2	-179.9	-56.8	-176.7	4.3	114	R286 E290 V293	R286-R295 PolarHBondContact NH1-O 3.46Å; R286-R295 PolarHBondContact NH2-O 3.15Å; E290-R295 HydrophobicContact CG-CB 3.89Å; E290-R295 WeakPolarHBondContact OE1-CB 3.42Å; V293-R295 PolarHBondContact O-N 2.89Å
296	D	95.8	Very high	97.9	Very high	102 Å²	102	55 Å²	55	55%	0.545	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-94.6	10.3	-178.9	-54.3	-44.6	0	0	0	112.6	P294 Y327	P294-D296 PolarHBondContact O-N 2.83Å; P294-D296 VanDerWaalsContact O-N 3.08Å; D296-Y327 VanDerWaalsContact O-CA 3.31Å; D296-Y327 WeakPolarHBondContact O-CA 3.28Å; D296-Y327 WeakPolarHBondContact O-CD1 3.38Å
297	A	97.9	Very high	97.9	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.008	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-85.4	-12.1	176.7	0	0	0	0	0	113.2	L273 P279 P294 W330	L273-A297 HydrophobicContact CD2-CB 4.13Å; L273-A297 VanDerWaalsContact CD2-O 3.32Å; L273-A297 WeakPolarHBondContact CD2-O 3.46Å; P279-A297 WeakPolarHBondContact CD-O 3.46Å; P294-A297 HydrophobicContact CB-CB 4.27Å; P294-A297 VanDerWaalsContact O-CB 3.22Å; P294-A297 WeakPolarHBondContact O-CB 3.42Å; P294-A297 PolarHBondContact O-N 2.87Å; A297-W330 HydrophobicContact CB-CD2 4.21Å; A297-W330 HydrophobicContact CB-CG 4.13Å; A297-W330 HydrophobicContact CB-CZ2 4.46Å
298	F	98.8	Very high	98	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.255	C	S	.	.			trans	-149.5	162.3	-172.1	69.5	-83.2	0	0	0	112	L269 P279 V281 R286 Y289 E290 V293 H300	L269-F298 HydrophobicContact CD1-CB 4.47Å; P279-F298 HydrophobicContact CG-CB 3.7Å; P279-F298 WeakPolarHBondContact O-CA 3Å; V281-F298 HydrophobicContact CG1-CB 4.23Å; V281-F298 HydrophobicContact CG1-CD2 4.2Å; V281-F298 HydrophobicContact CG2-CD2 3.51Å; V281-F298 HydrophobicContact CG2-CE2 3.86Å; R286-F298 VanDerWaalsContact CZ-CZ 3.47Å; R286-F298 PolarHBondContact NH2-O 2.99Å; Y289-F298 HydrophobicContact CD2-CE2 4.43Å; Y289-F298 HydrophobicContact CG-CE2 4.03Å; Y289-F298 HydrophobicContact CG-CZ 4.1Å; E290-F298 HydrophobicContact CG-CE1 4.31Å; E290-F298 HydrophobicContact CG-CZ 4.1Å; V293-F298 HydrophobicContact CG2-CD1 3.45Å; V293-F298 VanDerWaalsContact CG2-CD1 3.45Å; V293-F298 HydrophobicContact CG2-CE1 3.48Å; V293-F298 VanDerWaalsContact CG2-CE1 3.48Å; V293-F298 HydrophobicContact CG2-CG 4.46Å; V293-F298 HydrophobicContact CG2-CZ 4.49Å; F298-H300 HydrophobicContact CD2-CB 4.37Å; F298-H300 HydrophobicContact CE2-CB 4.03Å
299	I	98.9	Very high	98	Very high	1 Å²	1	55 Å²	55	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	123.3	174.8	-61.5	172.2	0	0	0	107.7	F252 V278 P279 V280 V281 F304 L310 Y313 L314 L317 Y327	F252-I299 HydrophobicContact CD1-CD1 4.01Å; F252-I299 HydrophobicContact CE1-CD1 3.79Å; V278-I299 HydrophobicContact CG1-CD1 4.03Å; V278-I299 HydrophobicContact CG1-CG1 4.1Å; P279-I299 PolarHBondContact O-N 3.2Å; V280-I299 CarbonylContact C-O 3.52Å; V280-I299 VanDerWaalsContact CA-O 3.31Å; V280-I299 WeakPolarHBondContact CA-O 3.46Å; V280-I299 HydrophobicContact CG1-CG2 4.5Å; V280-I299 HydrophobicContact CG2-CB 4.32Å; V280-I299 HydrophobicContact CG2-CD1 4.47Å; V281-I299 PolarHBondContact N-O 3.31Å; I299-F304 HydrophobicContact CG2-CE2 3.57Å; I299-F304 HydrophobicContact CG2-CZ 4.04Å; I299-L310 HydrophobicContact CG2-CD1 3.77Å; I299-Y313 HydrophobicContact CD1-CD1 4.39Å; I299-Y313 HydrophobicContact CD1-CE1 4.01Å; I299-Y313 HydrophobicContact CG1-CE1 4.4Å; I299-L314 HydrophobicContact CD1-CD2 3.56Å; I299-L317 HydrophobicContact CD1-CD1 3.78Å; I299-Y327 HydrophobicContact CD1-CE1 4.19Å; I299-Y327 HydrophobicContact CD1-CE2 4.45Å; I299-Y327 HydrophobicContact CG1-CD1 4.34Å; I299-Y327 HydrophobicContact CG1-CE1 3.48Å; I299-Y327 VanDerWaalsContact CG1-CE1 3.48Å; I299-Y327 WeakPolarHBondContact CG1-OH 3.47Å
300	H	98.9	Very high	98	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	137	177.2	-161	-82.1	0	0	0	110.4	V281 T284 R286 Y289 F298 D302 D303	V281-H300 HydrophobicContact CG2-CB 4.15Å; V281-H300 WeakPolarHBondContact CG2-CD2 3.48Å; T284-H300 PolarHBondContact O-NE2 2.66Å; R286-H300 HydrophobicContact CB-CB 4.31Å; R286-H300 HydrophobicContact CG-CB 4.32Å; R286-H300 PolarHBondContact N-NE2 3.08Å; Y289-H300 AromaticContact CD2-CD2 3.68Å; Y289-H300 AromaticContact CD2-NE2 3.82Å; Y289-H300 AromaticContact CE2-CD2 3.97Å; Y289-H300 AromaticContact CE2-NE2 3.84Å; F298-H300 HydrophobicContact CD2-CB 4.37Å; F298-H300 HydrophobicContact CE2-CB 4.03Å; H300-D302 IonicContact CE1-OD2 2.73Å; H300-D302 PolarHBondContact CE1-OD2 3.13Å; H300-D302 VanDerWaalsContact CE1-OD2 3.23Å; H300-D302 WeakPolarHBondContact ND1-CB 3.32Å; H300-D302 PolarHBondContact ND1-N 2.81Å; H300-D302 VanDerWaalsContact ND1-N 3.14Å; H300-D302 IonicContact ND1-OD2 3.67Å; H300-D302 PolarHBondContact O-N 3.47Å; H300-D303 WeakPolarHBondContact CB-OD2 3.4Å; H300-D303 PolarHBondContact N-OD2 2.99Å; H300-D303 VanDerWaalsContact O-CB 3.31Å; H300-D303 WeakPolarHBondContact O-CB 3.47Å; H300-D303 PolarHBondContact O-N 3.45Å
301	V	98.7	Very high	98.1	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.012	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-61.8	-30.5	-179.4	-69.2	0	0	0	0	113.3	Y217 F256 V280 V281 L282 D303 F304 L310	Y217-V301 HydrophobicContact CD1-CG1 4.35Å; Y217-V301 HydrophobicContact CE1-CB 4.23Å; Y217-V301 HydrophobicContact CE1-CG1 3.69Å; Y217-V301 HydrophobicContact CE2-CB 3.8Å; Y217-V301 HydrophobicContact CE2-CG1 4.12Å; Y217-V301 HydrophobicContact CE2-CG2 4.26Å; Y217-V301 WeakPolarHBondContact OH-CB 3.4Å; F256-V301 HydrophobicContact CE1-CG1 3.85Å; F256-V301 HydrophobicContact CZ-CG1 4.05Å; V280-V301 HydrophobicContact CG1-CG1 4.2Å; V281-V301 WeakPolarHBondContact O-CG1 3.46Å; V281-V301 WeakPolarHBondContact O-CG2 3.29Å; V281-V301 PolarHBondContact O-N 2.78Å; L282-V301 HydrophobicContact CB-CG1 4.24Å; L282-V301 HydrophobicContact CB-CG2 3.9Å; L282-V301 HydrophobicContact CD1-CG2 3.57Å; L282-V301 HydrophobicContact CG-CG2 4.27Å; V301-D303 PolarHBondContact O-N 2.76Å; V301-F304 PolarHBondContact O-N 3.3Å; V301-L310 HydrophobicContact CG1-CD2 4Å
302	D	97.8	Very high	98.2	Very high	114 Å²	114	51.1 Å²	51.1	61%	0.61	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-77.4	-4	177.8	-59.3	-17.7	0	0	0	113.5	H300 F304	H300-D302 IonicContact CE1-OD2 2.73Å; H300-D302 PolarHBondContact CE1-OD2 3.13Å; H300-D302 VanDerWaalsContact CE1-OD2 3.23Å; H300-D302 WeakPolarHBondContact ND1-CB 3.32Å; H300-D302 PolarHBondContact ND1-N 2.81Å; H300-D302 VanDerWaalsContact ND1-N 3.14Å; H300-D302 IonicContact ND1-OD2 3.67Å; H300-D302 PolarHBondContact O-N 3.47Å; D302-F304 PolarHBondContact O-N 2.62Å
303	D	98.4	Very high	98.3	Very high	77 Å²	77	52.4 Å²	52.4	41%	0.412	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-70.8	-6.7	169.9	-61.1	-23.9	0	0	0	111.2	R286 H300 V301	R286-D303 IonicContact CZ-OD2 2.67Å; R286-D303 IonicContact NE-OD1 3.53Å; R286-D303 PolarHBondContact NE-OD1 3.16Å; R286-D303 IonicContact NE-OD2 3.39Å; R286-D303 PolarHBondContact NE-OD2 2.88Å; R286-D303 IonicContact NH2-OD2 3.53Å; H300-D303 WeakPolarHBondContact CB-OD2 3.4Å; H300-D303 PolarHBondContact N-OD2 2.99Å; H300-D303 VanDerWaalsContact O-CB 3.31Å; H300-D303 WeakPolarHBondContact O-CB 3.47Å; H300-D303 PolarHBondContact O-N 3.45Å; V301-D303 PolarHBondContact O-N 2.76Å
304	F	98.8	Very high	98.4	Very high	32 Å²	32	52.2 Å²	52.2	14%	0.14	25%	0.253	C	S	.	.	S	Bend	trans	-127.6	146.5	-174.7	-53.6	-83.8	0	0	0	111.6	I299 V301 D302 S306 E309 L310 Y313	I299-F304 HydrophobicContact CG2-CE2 3.57Å; I299-F304 HydrophobicContact CG2-CZ 4.04Å; V301-F304 PolarHBondContact O-N 3.3Å; D302-F304 PolarHBondContact O-N 2.62Å; F304-S306 VanDerWaalsContact C-N 3.26Å; F304-S306 PolarHBondContact O-N 3.08Å; F304-E309 HydrophobicContact CB-CB 4.24Å; F304-E309 HydrophobicContact CB-CG 4.44Å; F304-E309 HydrophobicContact CD1-CB 4.42Å; F304-E309 HydrophobicContact CD1-CG 4.01Å; F304-L310 HydrophobicContact CB-CB 4.25Å; F304-L310 HydrophobicContact CD1-CB 4.47Å; F304-L310 HydrophobicContact CD2-CB 3.85Å; F304-L310 HydrophobicContact CD2-CD1 3.73Å; F304-L310 HydrophobicContact CD2-CG 4.32Å; F304-L310 HydrophobicContact CE2-CB 4.4Å; F304-L310 HydrophobicContact CE2-CD1 3.47Å; F304-L310 VanDerWaalsContact CE2-CD1 3.47Å; F304-L310 HydrophobicContact CE2-CG 4.49Å; F304-L310 HydrophobicContact CG-CB 3.91Å; F304-L310 HydrophobicContact CG-CD1 4.5Å; F304-L310 HydrophobicContact CZ-CD1 4.03Å; F304-Y313 VanDerWaalsContact CE1-CB 3.44Å; F304-Y313 AromaticContact CE1-CD1 3.8Å; F304-Y313 HydrophobicContact CE1-CD1 3.8Å; F304-Y313 HydrophobicContact CE1-CD2 4.17Å; F304-Y313 AromaticContact CE1-CG 3.54Å; F304-Y313 HydrophobicContact CE1-CG 3.54Å; F304-Y313 HydrophobicContact CE2-CD1 4.45Å; F304-Y313 AromaticContact CZ-CD1 3.36Å; F304-Y313 HydrophobicContact CZ-CD1 3.36Å; F304-Y313 HydrophobicContact CZ-CD2 4.46Å; F304-Y313 AromaticContact CZ-CE1 3.97Å; F304-Y313 HydrophobicContact CZ-CE1 3.97Å; F304-Y313 AromaticContact CZ-CG 3.65Å; F304-Y313 HydrophobicContact CZ-CG 3.65Å
305	K	98.3	Very high	98.4	Very high	199 Å²	199	53.1 Å²	53.1	87%	0.865	26%	0.256	S	S	*	.	S	Bend	trans	-73.8	-19.5	178.5	-59.7	177.1	-179.9	174.8	0	112.6	E309	K305-E309 VanDerWaalsContact CB-OE2 3.25Å; K305-E309 WeakPolarHBondContact CB-OE2 3.49Å; K305-E309 PolarHBondContact N-OE2 3.13Å
306	S	98.6	Very high	98.5	Very high	46 Å²	46	49.9 Å²	49.9	32%	0.322	25%	0.25	S	C	.	.	S	Bend	trans	-155.4	159	-179.3	69.2	0	0	0	0	113.1	F304 K308 E309 L310	F304-S306 VanDerWaalsContact C-N 3.26Å; F304-S306 PolarHBondContact O-N 3.08Å; S306-K308 PolarHBondContact O-N 3.08Å; S306-E309 PolarHBondContact O-N 3.39Å; S306-E309 VanDerWaalsContact O-N 3.11Å; S306-E309 PolarHBondContact OG-N 3.42Å; S306-L310 PolarHBondContact O-N 3.08Å; S306-L310 VanDerWaalsContact O-N 3.13Å
307	P	98.8	Very high	98.7	Very high	28 Å²	28	45 Å²	45	18%	0.182	22%	0.224	C	C	.	.	H	α-helix	trans	-58.4	-28.4	170.7	-26	35.7	0	0	0	113.8	Y217 E220 L221 A311	Y217-P307 HydrophobicContact CE1-CB 4.26Å; Y217-P307 HydrophobicContact CE1-CG 4.26Å; Y217-P307 HydrophobicContact CE2-CG 4.11Å; E220-P307 HydrophobicContact CB-CB 4.12Å; E220-P307 HydrophobicContact CB-CG 3.83Å; L221-P307 HydrophobicContact CB-CB 4.12Å; L221-P307 HydrophobicContact CD1-CB 4.24Å; L221-P307 WeakPolarHBondContact CD1-O 3.49Å; P307-A311 WeakPolarHBondContact O-CB 3.47Å; P307-A311 PolarHBondContact O-N 2.89Å
308	K	98.8	Very high	98.7	Very high	97 Å²	97	48 Å²	48	42%	0.422	24%	0.239	S	C	.	.	H	α-helix	trans	-65.2	-45.8	174	-175.3	-175.3	178.5	-61.2	0	111.2	H224 S306 L310 A311 D312	H224-K308 HydrophobicContact CB-CG 4.49Å; S306-K308 PolarHBondContact O-N 3.08Å; K308-L310 VanDerWaalsContact C-N 3.33Å; K308-L310 PolarHBondContact O-N 2.89Å; K308-A311 WeakPolarHBondContact O-CB 3.41Å; K308-A311 PolarHBondContact O-N 2.78Å; K308-A311 VanDerWaalsContact O-N 3.12Å; K308-D312 IonicContact NZ-OD1 2.65Å; K308-D312 IonicContact NZ-OD2 3.07Å; K308-D312 PolarHBondContact NZ-OD2 2.86Å; K308-D312 VanDerWaalsContact O-CG 3.27Å; K308-D312 PolarHBondContact O-N 2.85Å
309	E	98.9	Very high	98.7	Very high	76 Å²	76	56.6 Å²	56.6	36%	0.355	28%	0.277	S	S	.	.	H	α-helix	trans	-65.2	-39	179.9	-167.8	-176.5	-175.9	0	0	111.4	F304 K305 S306 D312 Y313	F304-E309 HydrophobicContact CB-CB 4.24Å; F304-E309 HydrophobicContact CB-CG 4.44Å; F304-E309 HydrophobicContact CD1-CB 4.42Å; F304-E309 HydrophobicContact CD1-CG 4.01Å; K305-E309 VanDerWaalsContact CB-OE2 3.25Å; K305-E309 WeakPolarHBondContact CB-OE2 3.49Å; K305-E309 PolarHBondContact N-OE2 3.13Å; S306-E309 PolarHBondContact O-N 3.39Å; S306-E309 VanDerWaalsContact O-N 3.11Å; S306-E309 PolarHBondContact OG-N 3.42Å; E309-D312 PolarHBondContact O-N 3.2Å; E309-Y313 WeakPolarHBondContact O-CB 3.5Å; E309-Y313 PolarHBondContact O-N 2.96Å
310	L	98.9	Very high	98.6	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-58.6	-47.5	169	171.7	63	0	0	0	111.5	Y217 L221 V280 I299 V301 F304 S306 K308 D312 Y313 L314	Y217-L310 HydrophobicContact CE1-CD2 3.84Å; Y217-L310 WeakPolarHBondContact OH-CD2 3.28Å; L221-L310 HydrophobicContact CD1-CB 4.49Å; L221-L310 HydrophobicContact CD1-CD2 4.09Å; L221-L310 HydrophobicContact CD1-CG 4.25Å; L221-L310 HydrophobicContact CD2-CD2 4.22Å; V280-L310 HydrophobicContact CG1-CD1 4.16Å; V280-L310 HydrophobicContact CG1-CD2 3.95Å; I299-L310 HydrophobicContact CG2-CD1 3.77Å; V301-L310 HydrophobicContact CG1-CD2 4Å; F304-L310 HydrophobicContact CB-CB 4.25Å; F304-L310 HydrophobicContact CD1-CB 4.47Å; F304-L310 HydrophobicContact CD2-CB 3.85Å; F304-L310 HydrophobicContact CD2-CD1 3.73Å; F304-L310 HydrophobicContact CD2-CG 4.32Å; F304-L310 HydrophobicContact CE2-CB 4.4Å; F304-L310 HydrophobicContact CE2-CD1 3.47Å; F304-L310 VanDerWaalsContact CE2-CD1 3.47Å; F304-L310 HydrophobicContact CE2-CG 4.49Å; F304-L310 HydrophobicContact CG-CB 3.91Å; F304-L310 HydrophobicContact CG-CD1 4.5Å; F304-L310 HydrophobicContact CZ-CD1 4.03Å; S306-L310 PolarHBondContact O-N 3.08Å; S306-L310 VanDerWaalsContact O-N 3.13Å; K308-L310 VanDerWaalsContact C-N 3.33Å; K308-L310 PolarHBondContact O-N 2.89Å; L310-D312 PolarHBondContact O-N 2.83Å; L310-Y313 WeakPolarHBondContact O-CB 3.26Å; L310-Y313 PolarHBondContact O-N 2.68Å; L310-L314 HydrophobicContact CD1-CD1 4.31Å; L310-L314 HydrophobicContact CD1-CD2 4.28Å; L310-L314 HydrophobicContact CD1-CG 4.08Å; L310-L314 HydrophobicContact CG-CD1 4.39Å; L310-L314 HydrophobicContact CG-CG 4.48Å; L310-L314 WeakPolarHBondContact O-CG 3.28Å; L310-L314 PolarHBondContact O-N 3.08Å
311	A	98.9	Very high	98.5	Very high	0 Å²	0	66 Å²	66	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-59.1	-44.8	177.4	0	0	0	0	0	112.4	L221 H224 I225 P307 K308 Y313 L314 L315	L221-A311 HydrophobicContact CD1-CB 3.95Å; H224-A311 HydrophobicContact CB-CB 3.54Å; I225-A311 HydrophobicContact CB-CB 3.86Å; I225-A311 HydrophobicContact CG2-CB 3.98Å; P307-A311 WeakPolarHBondContact O-CB 3.47Å; P307-A311 PolarHBondContact O-N 2.89Å; K308-A311 WeakPolarHBondContact O-CB 3.41Å; K308-A311 PolarHBondContact O-N 2.78Å; K308-A311 VanDerWaalsContact O-N 3.12Å; A311-Y313 VanDerWaalsContact C-N 3.29Å; A311-Y313 PolarHBondContact O-N 2.83Å; A311-L314 PolarHBondContact O-N 2.94Å; A311-L315 WeakPolarHBondContact O-CG 3.43Å; A311-L315 PolarHBondContact O-N 2.9Å
312	D	98.9	Very high	98.4	Very high	72 Å²	72	73.4 Å²	73.4	39%	0.385	36%	0.357	S	S	.	.	H	α-helix	trans	-60.1	-40.8	176.9	-66.3	-26.9	0	0	0	110.8	K308 E309 L310 L315 L316	K308-D312 IonicContact NZ-OD1 2.65Å; K308-D312 IonicContact NZ-OD2 3.07Å; K308-D312 PolarHBondContact NZ-OD2 2.86Å; K308-D312 VanDerWaalsContact O-CG 3.27Å; K308-D312 PolarHBondContact O-N 2.85Å; E309-D312 PolarHBondContact O-N 3.2Å; L310-D312 PolarHBondContact O-N 2.83Å; D312-L315 PolarHBondContact O-N 3.49Å; D312-L316 PolarHBondContact O-N 3.33Å
313	Y	98.9	Very high	98.4	Very high	57 Å²	57	71.4 Å²	71.4	22%	0.224	35%	0.345	C	S	.	.	H	α-helix	trans	-65.8	-43.4	175.5	-176.1	-107.3	0	0	0	113.2	I299 F304 E309 L310 A311 L315 L316 L317 M323 Y327	I299-Y313 HydrophobicContact CD1-CD1 4.39Å; I299-Y313 HydrophobicContact CD1-CE1 4.01Å; I299-Y313 HydrophobicContact CG1-CE1 4.4Å; F304-Y313 VanDerWaalsContact CE1-CB 3.44Å; F304-Y313 AromaticContact CE1-CD1 3.8Å; F304-Y313 HydrophobicContact CE1-CD1 3.8Å; F304-Y313 HydrophobicContact CE1-CD2 4.17Å; F304-Y313 AromaticContact CE1-CG 3.54Å; F304-Y313 HydrophobicContact CE1-CG 3.54Å; F304-Y313 HydrophobicContact CE2-CD1 4.45Å; F304-Y313 AromaticContact CZ-CD1 3.36Å; F304-Y313 HydrophobicContact CZ-CD1 3.36Å; F304-Y313 HydrophobicContact CZ-CD2 4.46Å; F304-Y313 AromaticContact CZ-CE1 3.97Å; F304-Y313 HydrophobicContact CZ-CE1 3.97Å; F304-Y313 AromaticContact CZ-CG 3.65Å; F304-Y313 HydrophobicContact CZ-CG 3.65Å; E309-Y313 WeakPolarHBondContact O-CB 3.5Å; E309-Y313 PolarHBondContact O-N 2.96Å; L310-Y313 WeakPolarHBondContact O-CB 3.26Å; L310-Y313 PolarHBondContact O-N 2.68Å; A311-Y313 VanDerWaalsContact C-N 3.29Å; A311-Y313 PolarHBondContact O-N 2.83Å; Y313-L315 VanDerWaalsContact C-N 3.29Å; Y313-L315 PolarHBondContact O-N 2.92Å; Y313-L316 HydrophobicContact CD2-CD2 4.46Å; Y313-L316 WeakPolarHBondContact O-CB 3.11Å; Y313-L316 PolarHBondContact O-N 2.95Å; Y313-L317 HydrophobicContact CD1-CD1 4Å; Y313-L317 HydrophobicContact CD1-CG 4.37Å; Y313-L317 HydrophobicContact CE1-CD1 3.49Å; Y313-L317 VanDerWaalsContact CE1-CD1 3.49Å; Y313-L317 HydrophobicContact CE1-CD2 4.46Å; Y313-L317 HydrophobicContact CE1-CG 4.01Å; Y313-L317 HydrophobicContact CE2-CD2 4.49Å; Y313-L317 WeakPolarHBondContact O-CG 3.37Å; Y313-L317 PolarHBondContact O-N 3.17Å; Y313-M323 HydrophobicContact CE2-CE 4.3Å; Y313-Y327 WeakPolarHBondContact CE1-OH 3.47Å; Y313-Y327 PolarHBondContact OH-OH 3.13Å
314	L	98.9	Very high	98.4	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-63.4	-36.3	176	-63.6	-176.5	0	0	0	112	V201 I225 F252 V280 I299 L310 A311 L317 D318	V201-L314 HydrophobicContact CG2-CD1 3.96Å; I225-L314 HydrophobicContact CD1-CB 3.78Å; I225-L314 HydrophobicContact CD1-CD1 4.17Å; F252-L314 HydrophobicContact CD1-CD2 3.7Å; F252-L314 HydrophobicContact CD2-CB 4.3Å; F252-L314 HydrophobicContact CD2-CD2 4.03Å; F252-L314 HydrophobicContact CE1-CD2 3.82Å; F252-L314 HydrophobicContact CE2-CB 4.21Å; F252-L314 HydrophobicContact CE2-CD2 4.12Å; F252-L314 HydrophobicContact CG-CD2 3.84Å; F252-L314 HydrophobicContact CZ-CD2 4.03Å; V280-L314 HydrophobicContact CG2-CD1 4.26Å; V280-L314 HydrophobicContact CG2-CD2 4.09Å; I299-L314 HydrophobicContact CD1-CD2 3.56Å; L310-L314 HydrophobicContact CD1-CD1 4.31Å; L310-L314 HydrophobicContact CD1-CD2 4.28Å; L310-L314 HydrophobicContact CD1-CG 4.08Å; L310-L314 HydrophobicContact CG-CD1 4.39Å; L310-L314 HydrophobicContact CG-CG 4.48Å; L310-L314 WeakPolarHBondContact O-CG 3.28Å; L310-L314 PolarHBondContact O-N 3.08Å; A311-L314 PolarHBondContact O-N 2.94Å; L314-L317 PolarHBondContact O-N 2.82Å; L314-D318 PolarHBondContact O-N 3.35Å
315	L	98.8	Very high	98.3	Very high	59 Å²	59	69.8 Å²	69.8	31%	0.309	34%	0.336	S	S	.	.	H	α-helix	trans	-70.4	-33.3	174.5	-70.9	166.9	0	0	0	112.6	L200 I225 A311 D312 Y313 D318 K319	L200-L315 HydrophobicContact CD2-CD2 3.77Å; I225-L315 HydrophobicContact CD1-CD2 4.39Å; I225-L315 HydrophobicContact CD1-CG 4.14Å; I225-L315 HydrophobicContact CG1-CD2 4.49Å; A311-L315 WeakPolarHBondContact O-CG 3.43Å; A311-L315 PolarHBondContact O-N 2.9Å; D312-L315 PolarHBondContact O-N 3.49Å; Y313-L315 VanDerWaalsContact C-N 3.29Å; Y313-L315 PolarHBondContact O-N 2.92Å; L315-D318 WeakPolarHBondContact O-CB 3.22Å; L315-D318 PolarHBondContact O-N 2.78Å; L315-K319 WeakPolarHBondContact O-CG 3.44Å; L315-K319 PolarHBondContact O-N 3.26Å
316	L	98.7	Very high	98.2	Very high	84 Å²	84	61.1 Å²	61.1	44%	0.44	30%	0.304	S	S	.	.	H	α-helix	trans	-63.1	-49.3	171.2	173.7	64.7	0	0	0	110.8	D312 Y313 D318 K319 N320 M323	D312-L316 PolarHBondContact O-N 3.33Å; Y313-L316 HydrophobicContact CD2-CD2 4.46Å; Y313-L316 WeakPolarHBondContact O-CB 3.11Å; Y313-L316 PolarHBondContact O-N 2.95Å; L316-D318 PolarHBondContact O-N 3.42Å; L316-K319 PolarHBondContact O-N 3.04Å; L316-K319 VanDerWaalsContact O-N 3.14Å; L316-N320 PolarHBondContact O-N 2.72Å; L316-M323 HydrophobicContact CD2-CE 4.08Å; L316-M323 HydrophobicContact CD2-SD 4.33Å; L316-M323 HydrophobicContact CG-SD 4.35Å
317	L	98.5	Very high	98.2	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-62.2	-32.2	176.5	-66.8	-179	0	0	0	112.5	F252 I299 Y313 L314 K319 N320 M323 Y327	F252-L317 HydrophobicContact CE1-CD1 3.71Å; F252-L317 HydrophobicContact CE2-CB 4.39Å; F252-L317 HydrophobicContact CZ-CB 3.63Å; F252-L317 HydrophobicContact CZ-CD1 3.64Å; F252-L317 HydrophobicContact CZ-CG 4.31Å; I299-L317 HydrophobicContact CD1-CD1 3.78Å; Y313-L317 HydrophobicContact CD1-CD1 4Å; Y313-L317 HydrophobicContact CD1-CG 4.37Å; Y313-L317 HydrophobicContact CE1-CD1 3.49Å; Y313-L317 VanDerWaalsContact CE1-CD1 3.49Å; Y313-L317 HydrophobicContact CE1-CD2 4.46Å; Y313-L317 HydrophobicContact CE1-CG 4.01Å; Y313-L317 HydrophobicContact CE2-CD2 4.49Å; Y313-L317 WeakPolarHBondContact O-CG 3.37Å; Y313-L317 PolarHBondContact O-N 3.17Å; L314-L317 PolarHBondContact O-N 2.82Å; L317-K319 VanDerWaalsContact C-N 3.25Å; L317-K319 PolarHBondContact O-N 2.86Å; L317-N320 PolarHBondContact O-N 2.97Å; L317-M323 HydrophobicContact CD2-CB 3.49Å; L317-M323 VanDerWaalsContact CD2-CB 3.49Å; L317-M323 HydrophobicContact CD2-CE 4.07Å; L317-Y327 HydrophobicContact CD1-CD2 4.32Å; L317-Y327 HydrophobicContact CD1-CE2 3.61Å; L317-Y327 HydrophobicContact CD2-CE2 4.03Å; L317-Y327 HydrophobicContact CG-CE2 4.5Å
318	D	98.2	Very high	98.1	Very high	62 Å²	62	59.7 Å²	59.7	33%	0.332	29%	0.288	S	S	.	.	H	α-helix	trans	-61	-37.5	175.9	-169.4	42	0	0	0	112.3	L200 K251 L314 L315 L316	L200-D318 HydrophobicContact CD1-CB 3.68Å; K251-D318 VanDerWaalsContact CD-OD1 3.3Å; K251-D318 WeakPolarHBondContact CD-OD1 3.37Å; K251-D318 VanDerWaalsContact CE-OD1 3.31Å; K251-D318 WeakPolarHBondContact CE-OD1 2.96Å; K251-D318 PolarHBondContact NZ-O 2.65Å; K251-D318 IonicContact NZ-OD1 3.97Å; K251-D318 PolarHBondContact NZ-OD1 3.21Å; L314-D318 PolarHBondContact O-N 3.35Å; L315-D318 WeakPolarHBondContact O-CB 3.22Å; L315-D318 PolarHBondContact O-N 2.78Å; L316-D318 PolarHBondContact O-N 3.42Å
319	K	98.1	Very high	97.9	Very high	182 Å²	182	62.6 Å²	62.6	79%	0.791	30%	0.301	S	S	*	.	H	α-helix	trans	-87.7	-20	-178.9	-65.2	175.4	-178.6	179.4	0	113.7	L315 L316 L317	L315-K319 WeakPolarHBondContact O-CG 3.44Å; L315-K319 PolarHBondContact O-N 3.26Å; L316-K319 PolarHBondContact O-N 3.04Å; L316-K319 VanDerWaalsContact O-N 3.14Å; L317-K319 VanDerWaalsContact C-N 3.25Å; L317-K319 PolarHBondContact O-N 2.86Å
320	N	98.3	Very high	97.7	Very high	57 Å²	57	60 Å²	60	31%	0.305	29%	0.288	S	S	.	.			trans	-114.1	97.2	-178.5	-169.8	-41.2	0	0	0	111	L316 L317 E322 M323 Y324	L316-N320 PolarHBondContact O-N 2.72Å; L317-N320 PolarHBondContact O-N 2.97Å; N320-E322 VanDerWaalsContact C-N 3.33Å; N320-E322 PolarHBondContact O-N 2.78Å; N320-E322 PolarHBondContact OD1-N 3.18Å; N320-M323 HydrophobicContact CB-CB 4.22Å; N320-M323 HydrophobicContact CB-CG 4.2Å; N320-M323 HydrophobicContact CB-SD 4.08Å; N320-M323 PolarHBondContact O-N 3.23Å; N320-M323 PolarHBondContact OD1-N 2.88Å; N320-Y324 PolarHBondContact O-N 3.25Å
321	Q	95.9	Very high	97.5	Very high	142 Å²	142	62.3 Å²	62.3	66%	0.664	30%	0.297	S	S	*	.	H	α-helix	trans	-63.2	-36	-177.1	-176.2	170.9	-3.9	0	0	112.9	Y324 L325	Q321-Y324 PolarHBondContact O-N 2.77Å; Q321-L325 HydrophobicContact CG-CD1 3.81Å; Q321-L325 HydrophobicContact CG-CG 4.12Å; Q321-L325 WeakPolarHBondContact O-CB 3.43Å; Q321-L325 VanDerWaalsContact O-CG 3.25Å; Q321-L325 WeakPolarHBondContact O-CG 3.42Å; Q321-L325 PolarHBondContact O-N 2.91Å
322	E	96.9	Very high	97.2	Very high	158 Å²	158	68.3 Å²	68.3	74%	0.738	32%	0.319	S	S	*	.	H	α-helix	trans	-64.1	-48.1	179.1	-174.1	-175.8	172.5	0	0	111.2	N320 Y324 L325 G326	N320-E322 VanDerWaalsContact C-N 3.33Å; N320-E322 PolarHBondContact O-N 2.78Å; N320-E322 PolarHBondContact OD1-N 3.18Å; E322-Y324 VanDerWaalsContact C-N 3.34Å; E322-Y324 PolarHBondContact O-N 3.33Å; E322-L325 PolarHBondContact O-N 3.2Å; E322-G326 PolarHBondContact O-N 2.83Å
323	M	97.9	Very high	96.8	Very high	72 Å²	72	69.7 Å²	69.7	36%	0.355	32%	0.323	S	S	.	.	H	α-helix	trans	-62.1	-42.2	176.5	-67.1	-179.6	71.2	0	0	111.6	Y313 L316 L317 N320 G326	Y313-M323 HydrophobicContact CE2-CE 4.3Å; L316-M323 HydrophobicContact CD2-CE 4.08Å; L316-M323 HydrophobicContact CD2-SD 4.33Å; L316-M323 HydrophobicContact CG-SD 4.35Å; L317-M323 HydrophobicContact CD2-CB 3.49Å; L317-M323 VanDerWaalsContact CD2-CB 3.49Å; L317-M323 HydrophobicContact CD2-CE 4.07Å; N320-M323 HydrophobicContact CB-CB 4.22Å; N320-M323 HydrophobicContact CB-CG 4.2Å; N320-M323 HydrophobicContact CB-SD 4.08Å; N320-M323 PolarHBondContact O-N 3.23Å; N320-M323 PolarHBondContact OD1-N 2.88Å; M323-G326 PolarHBondContact O-N 3.24Å
324	Y	98.2	Very high	96.7	Very high	10 Å²	10	70.9 Å²	70.9	4%	0.039	33%	0.33	C	S	.	.	H	α-helix	trans	-61.6	-47	176.3	173.6	-112.1	0	0	0	112.2	P194 K197 K251 F252 V278 N320 Q321 E322 G326 Y327 F328	P194-Y324 HydrophobicContact CG-CE1 4.4Å; K197-Y324 WeakPolarHBondContact CE-OH 3.43Å; K251-Y324 HydrophobicContact CB-CE2 3.92Å; K251-Y324 HydrophobicContact CD-CE2 4.38Å; K251-Y324 HydrophobicContact CG-CE2 4.13Å; F252-Y324 HydrophobicContact CE1-CD2 4.27Å; F252-Y324 HydrophobicContact CE1-CE2 4.33Å; F252-Y324 AromaticContact CZ-CD2 3.99Å; F252-Y324 HydrophobicContact CZ-CD2 3.99Å; F252-Y324 HydrophobicContact CZ-CE2 4.27Å; V278-Y324 HydrophobicContact CG2-CD2 4.39Å; V278-Y324 HydrophobicContact CG2-CE2 3.81Å; N320-Y324 PolarHBondContact O-N 3.25Å; Q321-Y324 PolarHBondContact O-N 2.77Å; E322-Y324 VanDerWaalsContact C-N 3.34Å; E322-Y324 PolarHBondContact O-N 3.33Å; Y324-G326 PolarHBondContact O-N 3.09Å; Y324-Y327 PolarHBondContact O-N 3.18Å; Y324-F328 HydrophobicContact CD1-CE2 4.39Å; Y324-F328 AromaticContact CE1-CE2 3.8Å; Y324-F328 HydrophobicContact CE1-CE2 3.8Å; Y324-F328 HydrophobicContact CE2-CE2 4.05Å; Y324-F328 HydrophobicContact CE2-CZ 4.32Å; Y324-F328 AromaticContact CZ-CE2 3.6Å; Y324-F328 AromaticContact CZ-CZ 3.92Å
325	L	96.8	Very high	96.5	Very high	64 Å²	64	74.8 Å²	74.8	34%	0.335	35%	0.347	S	S	.	.	H	α-helix	trans	-66.7	-22.8	178.9	-69.9	178	0	0	0	112.7	P194 Q321 E322 Y327 F328	P194-L325 HydrophobicContact CG-CD2 3.66Å; Q321-L325 HydrophobicContact CG-CD1 3.81Å; Q321-L325 HydrophobicContact CG-CG 4.12Å; Q321-L325 WeakPolarHBondContact O-CB 3.43Å; Q321-L325 VanDerWaalsContact O-CG 3.25Å; Q321-L325 WeakPolarHBondContact O-CG 3.42Å; Q321-L325 PolarHBondContact O-N 2.91Å; E322-L325 PolarHBondContact O-N 3.2Å; L325-Y327 PolarHBondContact O-N 3.01Å; L325-F328 HydrophobicContact CD2-CD2 4.3Å; L325-F328 PolarHBondContact O-N 3.01Å
326	G	96.8	Very high	96.4	Very high	18 Å²	18	73.2 Å²	73.2	19%	0.186	34%	0.339	C	S	.	.	H	α-helix	trans	-50.4	-36.5	170.6	0	0	0	0	0	113.8	E322 M323 Y324 F328 K329	E322-G326 PolarHBondContact O-N 2.83Å; M323-G326 PolarHBondContact O-N 3.24Å; Y324-G326 PolarHBondContact O-N 3.09Å; G326-F328 PolarHBondContact O-N 2.96Å; G326-F328 VanDerWaalsContact O-N 3.12Å; G326-K329 WeakPolarHBondContact O-CG 3.45Å; G326-K329 PolarHBondContact O-N 3.07Å
327	Y	98	Very high	96.2	Very high	31 Å²	31	73.7 Å²	73.7	12%	0.122	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-6	179.5	-76.1	-86.8	0	0	0	114.9	V278 D296 I299 Y313 L317 Y324 L325 W330	V278-Y327 HydrophobicContact CG1-CD1 3.7Å; V278-Y327 HydrophobicContact CG1-CE1 4.28Å; V278-Y327 HydrophobicContact CG1-CG 3.9Å; V278-Y327 HydrophobicContact CG2-CG 4.13Å; D296-Y327 VanDerWaalsContact O-CA 3.31Å; D296-Y327 WeakPolarHBondContact O-CA 3.28Å; D296-Y327 WeakPolarHBondContact O-CD1 3.38Å; I299-Y327 HydrophobicContact CD1-CE1 4.19Å; I299-Y327 HydrophobicContact CD1-CE2 4.45Å; I299-Y327 HydrophobicContact CG1-CD1 4.34Å; I299-Y327 HydrophobicContact CG1-CE1 3.48Å; I299-Y327 VanDerWaalsContact CG1-CE1 3.48Å; I299-Y327 WeakPolarHBondContact CG1-OH 3.47Å; Y313-Y327 WeakPolarHBondContact CE1-OH 3.47Å; Y313-Y327 PolarHBondContact OH-OH 3.13Å; L317-Y327 HydrophobicContact CD1-CD2 4.32Å; L317-Y327 HydrophobicContact CD1-CE2 3.61Å; L317-Y327 HydrophobicContact CD2-CE2 4.03Å; L317-Y327 HydrophobicContact CG-CE2 4.5Å; Y324-Y327 PolarHBondContact O-N 3.18Å; L325-Y327 PolarHBondContact O-N 3.01Å; Y327-W330 PolarHBondContact O-NE1 3.16Å
328	F	96.5	Very high	96.1	Very high	13 Å²	13	77.4 Å²	77.4	6%	0.057	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	-1.4	178	-56.4	-69.2	0	0	0	113.7	F192 P194 G276 V278 Y324 L325 G326 W330 R331	F192-F328 HydrophobicContact CD1-CB 3.86Å; F192-F328 HydrophobicContact CD1-CD1 4.03Å; F192-F328 HydrophobicContact CD1-CG 4Å; F192-F328 HydrophobicContact CE1-CB 4.43Å; F192-F328 AromaticContact CE1-CD1 3.73Å; F192-F328 HydrophobicContact CE1-CD1 3.73Å; F192-F328 HydrophobicContact CE1-CE1 4.19Å; F192-F328 HydrophobicContact CE1-CG 4.09Å; P194-F328 HydrophobicContact CB-CD2 4.32Å; P194-F328 HydrophobicContact CB-CE2 3.92Å; P194-F328 HydrophobicContact CB-CZ 4.01Å; P194-F328 HydrophobicContact CG-CD2 4.06Å; P194-F328 HydrophobicContact CG-CE2 3.89Å; P194-F328 HydrophobicContact CG-CZ 4.48Å; G276-F328 VanDerWaalsContact C-CE1 3.48Å; G276-F328 WeakPolarHBondContact O-CE1 3.49Å; G276-F328 VanDerWaalsContact O-CZ 3.27Å; G276-F328 WeakPolarHBondContact O-CZ 3.35Å; V278-F328 HydrophobicContact CG2-CE1 4.07Å; V278-F328 HydrophobicContact CG2-CE2 4.06Å; V278-F328 HydrophobicContact CG2-CZ 3.55Å; Y324-F328 HydrophobicContact CD1-CE2 4.39Å; Y324-F328 AromaticContact CE1-CE2 3.8Å; Y324-F328 HydrophobicContact CE1-CE2 3.8Å; Y324-F328 HydrophobicContact CE2-CE2 4.05Å; Y324-F328 HydrophobicContact CE2-CZ 4.32Å; Y324-F328 AromaticContact CZ-CE2 3.6Å; Y324-F328 AromaticContact CZ-CZ 3.92Å; L325-F328 HydrophobicContact CD2-CD2 4.3Å; L325-F328 PolarHBondContact O-N 3.01Å; G326-F328 PolarHBondContact O-N 2.96Å; G326-F328 VanDerWaalsContact O-N 3.12Å; F328-W330 PolarHBondContact O-N 2.64Å; F328-W330 VanDerWaalsContact O-N 3.15Å; F328-R331 VanDerWaalsContact O-CB 3.31Å; F328-R331 WeakPolarHBondContact O-CB 3.32Å; F328-R331 PolarHBondContact O-N 3.47Å
329	K	95.2	Very high	95.8	Very high	157 Å²	157	75 Å²	75	68%	0.683	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-54.6	-36.6	-179.3	-74.2	179	177.1	178	0	112.9	G326 R331 R332	G326-K329 WeakPolarHBondContact O-CG 3.45Å; G326-K329 PolarHBondContact O-N 3.07Å; K329-R331 PolarHBondContact O-N 3.29Å; K329-R332 WeakPolarHBondContact O-CB 3.23Å; K329-R332 PolarHBondContact O-N 2.75Å
330	W	95.4	Very high	95.1	Very high	21 Å²	21	71.2 Å²	71.2	8%	0.08	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-60.1	-25.5	177.2	66.8	-90.8	0	0	0	113.4	I183 L273 P294 A297 Y327 F328 R332 H333 F334 V336	I183-W330 HydrophobicContact CD1-CH2 4.18Å; I183-W330 HydrophobicContact CD1-CZ3 3.94Å; I183-W330 HydrophobicContact CG2-CE3 4.41Å; I183-W330 HydrophobicContact CG2-CZ3 4.33Å; L273-W330 HydrophobicContact CB-CH2 4.42Å; L273-W330 HydrophobicContact CB-CZ2 4.34Å; L273-W330 HydrophobicContact CD2-CZ2 3.81Å; P294-W330 HydrophobicContact CB-CB 3.94Å; P294-W330 HydrophobicContact CB-CG 4.33Å; P294-W330 HydrophobicContact CG-CB 3.84Å; P294-W330 HydrophobicContact CG-CD2 4.45Å; P294-W330 HydrophobicContact CG-CG 4.18Å; A297-W330 HydrophobicContact CB-CD2 4.21Å; A297-W330 HydrophobicContact CB-CG 4.13Å; A297-W330 HydrophobicContact CB-CZ2 4.46Å; Y327-W330 PolarHBondContact O-NE1 3.16Å; F328-W330 PolarHBondContact O-N 2.64Å; F328-W330 VanDerWaalsContact O-N 3.15Å; W330-R332 PolarHBondContact O-N 2.95Å; W330-H333 PolarHBondContact O-N 3.48Å; W330-H333 VanDerWaalsContact O-N 3.16Å; W330-F334 HydrophobicContact CE3-CB 3.99Å; W330-F334 HydrophobicContact CZ3-CB 4.27Å; W330-F334 WeakPolarHBondContact O-CD2 3.45Å; W330-F334 PolarHBondContact O-N 3.38Å; W330-F334 VanDerWaalsContact O-N 3.13Å; W330-V336 HydrophobicContact CH2-CG2 3.72Å; W330-V336 HydrophobicContact CZ3-CG2 4.37Å
331	R	94.2	Very high	94.8	Very high	49 Å²	49	70.2 Å²	70.2	19%	0.185	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-69.2	-12	-180	-68.3	-175.9	105	-88.5	12.6	113.9	F192 F328 K329 H333 F334	F192-R331 HydrophobicContact CB-CB 3.75Å; F192-R331 HydrophobicContact CD1-CB 4.48Å; F192-R331 VanDerWaalsContact CD1-CD 3.41Å; F192-R331 VanDerWaalsContact CD2-CZ 3.45Å; F192-R331 HydrophobicContact CG-CB 4.14Å; F192-R331 VanDerWaalsContact CG-NH1 3.29Å; F328-R331 VanDerWaalsContact O-CB 3.31Å; F328-R331 WeakPolarHBondContact O-CB 3.32Å; F328-R331 PolarHBondContact O-N 3.47Å; K329-R331 PolarHBondContact O-N 3.29Å; R331-H333 PolarHBondContact O-N 2.74Å; R331-F334 WeakPolarHBondContact CA-O 3.33Å
332	R	91.8	Very high	94.8	Very high	127 Å²	127	66.4 Å²	66.4	48%	0.479	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-64	-29.4	171.7	-177.3	170.9	-178.3	178.9	2.5	112.7	V189 K329 W330	V189-R332 HydrophobicContact CG1-CG 3.55Å; V189-R332 VanDerWaalsContact CG1-NE 3.29Å; K329-R332 WeakPolarHBondContact O-CB 3.23Å; K329-R332 PolarHBondContact O-N 2.75Å; W330-R332 PolarHBondContact O-N 2.95Å
333	H	91.8	Very high	94.8	Very high	100 Å²	100	59.3 Å²	59.3	46%	0.463	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	-14	-175.5	-61.7	-64.2	0	0	0	113.3	A186 W330 R331	A186-H333 PolarHBondContact N-O 2.73Å; W330-H333 PolarHBondContact O-N 3.48Å; W330-H333 VanDerWaalsContact O-N 3.16Å; R331-H333 PolarHBondContact O-N 2.74Å
334	F	95.3	Very high	94.7	Very high	82 Å²	82	56.1 Å²	56.1	36%	0.36	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	153.8	-173.1	-50.9	-78.3	0	0	0	113.3	I183 V184 W330 R331	I183-F334 HydrophobicContact CG2-CB 3.35Å; I183-F334 HydrophobicContact CG2-CD1 4.03Å; I183-F334 HydrophobicContact CG2-CD2 4.41Å; I183-F334 HydrophobicContact CG2-CG 3.7Å; V184-F334 CarbonylContact O-C 3.6Å; V184-F334 WeakPolarHBondContact O-CA 3.35Å; V184-F334 WeakPolarHBondContact O-CB 3.48Å; W330-F334 HydrophobicContact CE3-CB 3.99Å; W330-F334 HydrophobicContact CZ3-CB 4.27Å; W330-F334 WeakPolarHBondContact O-CD2 3.45Å; W330-F334 PolarHBondContact O-N 3.38Å; W330-F334 VanDerWaalsContact O-N 3.13Å; R331-F334 WeakPolarHBondContact CA-O 3.33Å
335	K	95.1	Very high	94.7	Very high	82 Å²	82	56 Å²	56	36%	0.357	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	160.4	172.3	63	-173.2	174	-174.3	0	110.5	V184 A185 D187	V184-K335 HydrophobicContact CG2-CD 4.21Å; V184-K335 HydrophobicContact CG2-CG 3.46Å; V184-K335 VanDerWaalsContact CG2-CG 3.46Å; V184-K335 PolarHBondContact N-O 3.39Å; V184-K335 PolarHBondContact O-N 2.9Å; A185-K335 WeakPolarHBondContact O-CE 3.37Å; D187-K335 IonicContact OD1-NZ 2.66Å; D187-K335 IonicContact OD2-NZ 3.55Å; D187-K335 PolarHBondContact OD2-NZ 2.88Å
336	V	96.1	Very high	94.7	Very high	26 Å²	26	53 Å²	53	16%	0.158	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	124.3	175.1	-173.8	0	0	0	0	109.3	I183 Y270 L273 W330 R338	I183-V336 HydrophobicContact CD1-CG2 3.98Å; Y270-V336 HydrophobicContact CD1-CG1 4.04Å; Y270-V336 HydrophobicContact CG-CG1 4.47Å; L273-V336 HydrophobicContact CB-CG2 3.67Å; W330-V336 HydrophobicContact CH2-CG2 3.72Å; W330-V336 HydrophobicContact CZ3-CG2 4.37Å; V336-R338 HydrophobicContact CG1-CG 3.91Å
337	Y	95.8	Very high	94.8	Very high	95 Å²	95	52.2 Å²	52.2	37%	0.373	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	126.1	164.3	-175.9	-108.8	0	0	0	108.9	G181 S182 I339 E344	G181-Y337 CarbonylContact C-O 3.55Å; G181-Y337 WeakPolarHBondContact CA-O 3.42Å; S182-Y337 PolarHBondContact N-O 3.08Å; S182-Y337 PolarHBondContact O-N 2.9Å; Y337-I339 HydrophobicContact CD1-CD1 4.34Å; Y337-I339 HydrophobicContact CD1-CG1 3.86Å; Y337-I339 HydrophobicContact CE1-CD1 4.2Å; Y337-I339 HydrophobicContact CE1-CG1 3.7Å; Y337-E344 VanDerWaalsContact CE1-OE1 3.24Å; Y337-E344 WeakPolarHBondContact CE1-OE1 3.32Å; Y337-E344 PolarHBondContact OH-OE1 3.5Å
338	R	94.9	Very high	94.8	Very high	78 Å²	78	53.7 Å²	53.7	29%	0.294	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	127.6	-176.7	-64.5	-171.3	-66.3	164.8	-2.6	110.2	V336 N340	V336-R338 HydrophobicContact CG1-CG 3.91Å; R338-N340 WeakPolarHBondContact CB-OD1 3.3Å
339	I	92.7	Very high	94.9	Very high	10 Å²	10	53.1 Å²	53.1	5%	0.051	24%	0.236	C	C	.	.			trans	-103	89.8	-176.9	-54.7	-178.9	0	0	0	109.1	V178 P179 Y180 Y337 E344 R345	V178-I339 HydrophobicContact CG1-CD1 4.04Å; V178-I339 HydrophobicContact CG1-CG2 3.77Å; P179-I339 HydrophobicContact CG-CD1 4.37Å; P179-I339 WeakPolarHBondContact O-CB 3.35Å; Y180-I339 PolarHBondContact O-N 3.42Å; Y337-I339 HydrophobicContact CD1-CD1 4.34Å; Y337-I339 HydrophobicContact CD1-CG1 3.86Å; Y337-I339 HydrophobicContact CE1-CD1 4.2Å; Y337-I339 HydrophobicContact CE1-CG1 3.7Å; I339-E344 WeakPolarHBondContact CG1-OE1 3.4Å; I339-E344 HydrophobicContact CG2-CB 4.49Å; I339-E344 VanDerWaalsContact CG2-CD 3.48Å; I339-E344 HydrophobicContact CG2-CG 4.18Å; I339-E344 WeakPolarHBondContact CG2-OE1 3.27Å; I339-E344 WeakPolarHBondContact CG2-OE2 3.37Å; I339-R345 PolarHBondContact O-NH1 2.97Å; I339-R345 PolarHBondContact O-NH2 3.5Å
340	N	83.8	Confident	95	Very high	103 Å²	103	45.6 Å²	45.6	55%	0.551	20%	0.203	S	C	*	.			trans	-103.9	-11.2	-165.6	-53.4	-29.1	0	0	0	113.7	R338	R338-N340 WeakPolarHBondContact CB-OD1 3.3Å
341	S	92.1	Very high	95.1	Very high	37 Å²	37	46.1 Å²	46.1	26%	0.259	21%	0.208	S	C	.	.			trans	-111.5	145.7	-171.6	84	0	0	0	0	112.4	F98 A343 E344 R345	F98-S341 WeakPolarHBondContact CZ-OG 3.37Å; S341-A343 VanDerWaalsContact C-N 3.26Å; S341-E344 WeakPolarHBondContact OG-CB 3.33Å; S341-E344 PolarHBondContact OG-N 2.95Å; S341-R345 PolarHBondContact O-NH1 3.39Å
342	W	95.9	Very high	95.3	Very high	62 Å²	62	44.7 Å²	44.7	24%	0.235	20%	0.202	C	C	.	.	H	α-helix	trans	-72.6	-24.9	170.1	-63.4	114.7	0	0	0	112.2	P84 F85 Y89 M146 L148 R345 T346	P84-W342 HydrophobicContact CB-CD2 3.57Å; P84-W342 VanDerWaalsContact CB-CE2 3.45Å; P84-W342 HydrophobicContact CB-CE3 3.93Å; P84-W342 HydrophobicContact CB-CG 4.04Å; P84-W342 HydrophobicContact CB-CH2 4.09Å; P84-W342 HydrophobicContact CB-CZ2 3.75Å; P84-W342 HydrophobicContact CB-CZ3 4.17Å; P84-W342 HydrophobicContact CG-CB 4.28Å; P84-W342 HydrophobicContact CG-CD2 3.48Å; P84-W342 VanDerWaalsContact CG-CD2 3.48Å; P84-W342 HydrophobicContact CG-CE3 3.57Å; P84-W342 HydrophobicContact CG-CG 3.8Å; P84-W342 HydrophobicContact CG-CZ2 4.47Å; P84-W342 HydrophobicContact CG-CZ3 4.11Å; F85-W342 HydrophobicContact CD2-CZ2 4.23Å; F85-W342 HydrophobicContact CE2-CH2 4.36Å; F85-W342 AromaticContact CE2-CZ2 3.84Å; F85-W342 HydrophobicContact CE2-CZ2 3.84Å; Y89-W342 HydrophobicContact CD1-CB 3.38Å; Y89-W342 HydrophobicContact CD1-CG 4.17Å; Y89-W342 HydrophobicContact CD2-CB 4.46Å; Y89-W342 HydrophobicContact CE1-CB 3.23Å; Y89-W342 HydrophobicContact CE1-CG 4.14Å; Y89-W342 HydrophobicContact CE2-CB 4.37Å; Y89-W342 HydrophobicContact CG-CB 4Å; M146-W342 HydrophobicContact CE-CE3 4.36Å; M146-W342 HydrophobicContact SD-CE3 4.29Å; M146-W342 HydrophobicContact SD-CZ3 4.44Å; L148-W342 HydrophobicContact CB-CH2 4.22Å; L148-W342 HydrophobicContact CB-CZ3 4.34Å; L148-W342 HydrophobicContact CD2-CZ3 3.91Å; L148-W342 HydrophobicContact CG-CH2 4.45Å; L148-W342 HydrophobicContact CG-CZ3 4.09Å; W342-R345 PolarHBondContact O-N 3.27Å; W342-T346 PolarHBondContact O-N 2.96Å; W342-T346 VanDerWaalsContact O-N 3.13Å; W342-T346 PolarHBondContact O-OG1 2.95Å
343	A	96.8	Very high	95.5	Very high	8 Å²	8	38.8 Å²	38.8	7%	0.066	18%	0.18	C	C	.	.	H	α-helix	trans	-62.8	-48.5	174.9	0	0	0	0	0	111.2	Y89 E90 V93 F98 S341 R345 T346 C347	Y89-A343 HydrophobicContact CD2-CB 3.78Å; Y89-A343 HydrophobicContact CE2-CB 4.17Å; E90-A343 WeakPolarHBondContact O-CB 3.14Å; V93-A343 HydrophobicContact CG2-CB 3.64Å; F98-A343 HydrophobicContact CE2-CB 4.07Å; F98-A343 HydrophobicContact CZ-CB 4.45Å; S341-A343 VanDerWaalsContact C-N 3.26Å; A343-R345 VanDerWaalsContact C-N 3.28Å; A343-R345 PolarHBondContact O-N 2.89Å; A343-T346 PolarHBondContact O-N 3.27Å; A343-T346 VanDerWaalsContact O-N 3.1Å; A343-T346 PolarHBondContact O-OG1 3.44Å; A343-T346 VanDerWaalsContact O-OG1 3.05Å; A343-C347 PolarHBondContact O-N 2.85Å; A343-C347 PolarHBondContact O-SG 3.32Å
344	E	96.7	Very high	95.7	Very high	6 Å²	6	37.6 Å²	37.6	3%	0.028	17%	0.173	C	C	.	.	H	α-helix	trans	-56.4	-43.4	177	-170.5	178.2	161.7	0	0	111.9	F98 Y337 I339 S341 T346 C347 H348	F98-E344 HydrophobicContact CD1-CB 4.01Å; F98-E344 HydrophobicContact CD1-CG 3.7Å; F98-E344 HydrophobicContact CD2-CB 4.26Å; F98-E344 HydrophobicContact CD2-CG 4.49Å; F98-E344 HydrophobicContact CE1-CB 3.6Å; F98-E344 HydrophobicContact CE1-CG 3.74Å; F98-E344 VanDerWaalsContact CE2-CA 3.5Å; F98-E344 HydrophobicContact CE2-CB 3.87Å; F98-E344 HydrophobicContact CG-CB 4.34Å; F98-E344 HydrophobicContact CG-CG 4.12Å; F98-E344 HydrophobicContact CZ-CB 3.54Å; F98-E344 HydrophobicContact CZ-CG 4.18Å; Y337-E344 VanDerWaalsContact CE1-OE1 3.24Å; Y337-E344 WeakPolarHBondContact CE1-OE1 3.32Å; Y337-E344 PolarHBondContact OH-OE1 3.5Å; I339-E344 WeakPolarHBondContact CG1-OE1 3.4Å; I339-E344 HydrophobicContact CG2-CB 4.49Å; I339-E344 VanDerWaalsContact CG2-CD 3.48Å; I339-E344 HydrophobicContact CG2-CG 4.18Å; I339-E344 WeakPolarHBondContact CG2-OE1 3.27Å; I339-E344 WeakPolarHBondContact CG2-OE2 3.37Å; S341-E344 WeakPolarHBondContact OG-CB 3.33Å; S341-E344 PolarHBondContact OG-N 2.95Å; E344-T346 PolarHBondContact O-N 3.45Å; E344-C347 PolarHBondContact O-N 2.94Å; E344-H348 PolarHBondContact O-CD2 3.47Å; E344-H348 PolarHBondContact O-N 2.87Å
345	R	96.9	Very high	95.7	Very high	8 Å²	8	40.5 Å²	40.5	3%	0.03	18%	0.182	C	C	.	.	H	α-helix	trans	-59.5	-45.8	176.4	-72.2	168	175.7	80.3	2.7	111.6	M146 L168 V178 P179 I339 S341 W342 A343 H348 A349	M146-R345 HydrophobicContact SD-CB 4.45Å; L168-R345 HydrophobicContact CD1-CB 4.43Å; L168-R345 WeakPolarHBondContact CD1-O 3.18Å; L168-R345 HydrophobicContact CD2-CB 4.24Å; L168-R345 HydrophobicContact CD2-CG 4.44Å; V178-R345 HydrophobicContact CB-CG 4.16Å; V178-R345 HydrophobicContact CG1-CG 3.63Å; P179-R345 PolarHBondContact O-NH2 3.22Å; I339-R345 PolarHBondContact O-NH1 2.97Å; I339-R345 PolarHBondContact O-NH2 3.5Å; S341-R345 PolarHBondContact O-NH1 3.39Å; W342-R345 PolarHBondContact O-N 3.27Å; A343-R345 VanDerWaalsContact C-N 3.28Å; A343-R345 PolarHBondContact O-N 2.89Å; R345-H348 PolarHBondContact O-N 3.41Å; R345-A349 PolarHBondContact O-N 2.96Å
346	T	97.6	Very high	95.7	Very high	1 Å²	1	39 Å²	39	1%	0.006	18%	0.176	C	C	.	.	H	α-helix	trans	-74.3	-26.8	178.3	49	0	0	0	0	113.6	V80 Y89 V119 W342 A343 E344 A349 C350	V80-T346 HydrophobicContact CG2-CG2 4.17Å; Y89-T346 WeakPolarHBondContact OH-CG2 3.19Å; Y89-T346 PolarHBondContact OH-OG1 3.46Å; V119-T346 HydrophobicContact CB-CG2 4.41Å; V119-T346 HydrophobicContact CG1-CG2 4.07Å; V119-T346 HydrophobicContact CG2-CG2 4.24Å; W342-T346 PolarHBondContact O-N 2.96Å; W342-T346 VanDerWaalsContact O-N 3.13Å; W342-T346 PolarHBondContact O-OG1 2.95Å; A343-T346 PolarHBondContact O-N 3.27Å; A343-T346 VanDerWaalsContact O-N 3.1Å; A343-T346 PolarHBondContact O-OG1 3.44Å; A343-T346 VanDerWaalsContact O-OG1 3.05Å; E344-T346 PolarHBondContact O-N 3.45Å; T346-A349 WeakPolarHBondContact O-CB 3.45Å; T346-A349 PolarHBondContact O-N 3.4Å; T346-C350 PolarHBondContact O-N 3.42Å
347	C	97.9	Very high	95.3	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.007	19%	0.193	C	C	.	.	H	α-helix	trans	-65.5	-41	168.4	-62.6	0	0	0	0	111.6	C94 F98 I100 A343 E344 A349 C350 D351	C94-C347 WeakPolarHBondContact CA-SG 3.45Å; C94-C347 HydrophobicContact CB-CB 3.75Å; C94-C347 WeakPolarHBondContact CB-SG 3.49Å; C94-C347 VanDerWaalsContact SG-CA 3.52Å; C94-C347 WeakPolarHBondContact SG-CB 3.41Å; C94-C347 CovalentContact SG-SG 2.04Å; C94-C347 PolarHBondContact SG-SG 3.03Å; F98-C347 HydrophobicContact CD2-CB 4.09Å; I100-C347 HydrophobicContact CD1-CB 3.82Å; A343-C347 PolarHBondContact O-N 2.85Å; A343-C347 PolarHBondContact O-SG 3.32Å; E344-C347 PolarHBondContact O-N 2.94Å; C347-A349 VanDerWaalsContact C-N 3.31Å; C347-A349 PolarHBondContact O-N 2.82Å; C347-C350 WeakPolarHBondContact O-CB 3.37Å; C347-C350 PolarHBondContact O-N 3.44Å; C347-D351 PolarHBondContact O-N 3.48Å
348	H	97.9	Very high	95.1	Very high	62 Å²	62	42.7 Å²	42.7	29%	0.287	19%	0.193	S	C	.	.	H	α-helix	trans	-63.7	-35.8	171.2	-79.1	-67.7	0	0	0	112.8	I176 V178 E344 R345 C350 D351 Y352	I176-H348 HydrophobicContact CG2-CB 4.28Å; V178-H348 HydrophobicContact CG2-CB 3.76Å; E344-H348 PolarHBondContact O-CD2 3.47Å; E344-H348 PolarHBondContact O-N 2.87Å; R345-H348 PolarHBondContact O-N 3.41Å; H348-C350 VanDerWaalsContact C-N 3.34Å; H348-D351 PolarHBondContact O-N 2.83Å; H348-Y352 WeakPolarHBondContact O-CB 3.49Å; H348-Y352 PolarHBondContact O-N 2.98Å
349	A	98.2	Very high	94.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.5	-44.5	172.2	0	0	0	0	0	111.5	V119 L168 I176 R345 T346 C347 Y352 L353	V119-A349 HydrophobicContact CG2-CB 4.13Å; L168-A349 HydrophobicContact CD1-CB 3.89Å; I176-A349 HydrophobicContact CD1-CB 4.19Å; R345-A349 PolarHBondContact O-N 2.96Å; T346-A349 WeakPolarHBondContact O-CB 3.45Å; T346-A349 PolarHBondContact O-N 3.4Å; C347-A349 VanDerWaalsContact C-N 3.31Å; C347-A349 PolarHBondContact O-N 2.82Å; A349-Y352 PolarHBondContact O-N 3.07Å; A349-L353 WeakPolarHBondContact O-CB 3.42Å; A349-L353 WeakPolarHBondContact O-CD1 3.28Å; A349-L353 WeakPolarHBondContact O-CG 3.26Å; A349-L353 PolarHBondContact O-N 3.45Å
350	C	98.1	Very high	94.3	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.1	-49.1	174.8	173.8	0	0	0	0	111.9	V78 C103 I105 T346 C347 H348 Y352 L353 K354	V78-C350 HydrophobicContact CG2-CB 3.61Å; C103-C350 WeakPolarHBondContact CA-SG 3.46Å; C103-C350 HydrophobicContact CB-CB 3.89Å; C103-C350 WeakPolarHBondContact CB-SG 3.45Å; C103-C350 WeakPolarHBondContact SG-CB 3.35Å; C103-C350 CovalentContact SG-SG 2.02Å; C103-C350 PolarHBondContact SG-SG 3.07Å; I105-C350 HydrophobicContact CD1-CB 3.82Å; T346-C350 PolarHBondContact O-N 3.42Å; C347-C350 WeakPolarHBondContact O-CB 3.37Å; C347-C350 PolarHBondContact O-N 3.44Å; H348-C350 VanDerWaalsContact C-N 3.34Å; C350-Y352 VanDerWaalsContact C-N 3.27Å; C350-Y352 PolarHBondContact O-N 2.71Å; C350-L353 PolarHBondContact O-N 2.91Å; C350-L353 VanDerWaalsContact O-N 3.11Å; C350-K354 WeakPolarHBondContact O-CB 3.4Å; C350-K354 PolarHBondContact O-N 3.25Å
351	D	97.8	Very high	94.4	Very high	32 Å²	32	49 Å²	49	17%	0.171	22%	0.22	C	C	.	.	H	α-helix	trans	-60.4	-39.3	-179.3	-170.7	59.1	0	0	0	112.2	I100 C347 H348 K354 R355	I100-D351 HydrophobicContact CG2-CB 3.81Å; C347-D351 PolarHBondContact O-N 3.48Å; H348-D351 PolarHBondContact O-N 2.83Å; D351-K354 WeakPolarHBondContact O-CB 3.34Å; D351-K354 PolarHBondContact O-N 3.34Å; D351-K354 WeakPolarHBondContact OD1-CE 3.35Å; D351-K354 IonicContact OD1-NZ 2.88Å; D351-K354 PolarHBondContact OD1-NZ 2.84Å; D351-R355 WeakPolarHBondContact O-CG 3.49Å; D351-R355 PolarHBondContact O-N 2.95Å; D351-R355 PolarHBondContact O-NE 3.46Å; D351-R355 IonicContact OD1-NE 3.68Å; D351-R355 IonicContact OD2-CZ 3.58Å; D351-R355 IonicContact OD2-NE 3.72Å; D351-R355 PolarHBondContact OD2-NE 2.98Å; D351-R355 IonicContact OD2-NH2 3.28Å; D351-R355 PolarHBondContact OD2-NH2 2.9Å
352	Y	97.9	Very high	94.3	Very high	19 Å²	19	48.7 Å²	48.7	8%	0.075	21%	0.214	C	C	.	.	H	α-helix	trans	-61.4	-51.4	172.1	-173.6	-83.1	0	0	0	111.6	L166 D175 I176 H348 A349 C350 K354 R355 H356 R360	L166-Y352 HydrophobicContact CD1-CD1 3.74Å; L166-Y352 HydrophobicContact CD1-CE1 3.63Å; L166-Y352 HydrophobicContact CD2-CE1 3.65Å; L166-Y352 HydrophobicContact CG-CE1 4.3Å; D175-Y352 WeakPolarHBondContact O-CE2 3.14Å; I176-Y352 HydrophobicContact CD1-CD1 4.15Å; I176-Y352 HydrophobicContact CD1-CG 4.12Å; I176-Y352 HydrophobicContact CG1-CD1 3.91Å; I176-Y352 HydrophobicContact CG1-CD2 3.74Å; I176-Y352 HydrophobicContact CG1-CE1 4.45Å; I176-Y352 HydrophobicContact CG1-CE2 4.29Å; I176-Y352 HydrophobicContact CG1-CG 3.53Å; H348-Y352 WeakPolarHBondContact O-CB 3.49Å; H348-Y352 PolarHBondContact O-N 2.98Å; A349-Y352 PolarHBondContact O-N 3.07Å; C350-Y352 VanDerWaalsContact C-N 3.27Å; C350-Y352 PolarHBondContact O-N 2.71Å; Y352-K354 PolarHBondContact O-N 2.99Å; Y352-R355 PolarHBondContact O-N 3.38Å; Y352-H356 HydrophobicContact CD1-CB 4Å; Y352-H356 AromaticContact CD1-CD2 3.94Å; Y352-H356 AromaticContact CD2-CD2 3.61Å; Y352-H356 HydrophobicContact CE1-CB 3.66Å; Y352-H356 AromaticContact CE1-CD2 3.92Å; Y352-H356 AromaticContact CE1-CG 3.83Å; Y352-H356 AromaticContact CE2-CD2 3.6Å; Y352-H356 AromaticContact CE2-NE2 3.87Å; Y352-H356 AromaticContact CG-CD2 3.78Å; Y352-H356 AromaticContact CZ-CD2 3.76Å; Y352-H356 AromaticContact CZ-CG 3.8Å; Y352-H356 WeakPolarHBondContact O-CB 3.26Å; Y352-H356 PolarHBondContact O-CD2 2.96Å; Y352-H356 PolarHBondContact O-N 3.24Å; Y352-R360 PolarHBondContact OH-NH1 3.2Å; Y352-R360 VanDerWaalsContact OH-NH1 3.08Å
353	L	97.2	Very high	94	Very high	2 Å²	2	53 Å²	53	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-63.2	-28.2	-179	-70.6	164.2	0	0	0	113.5	T76 V78 G117 K142 V144 L166 A349 C350 K357	T76-L353 HydrophobicContact CG2-CB 3.79Å; V78-L353 HydrophobicContact CG2-CD1 3.82Å; G117-L353 VanDerWaalsContact CA-CD1 3.48Å; K142-L353 HydrophobicContact CB-CD2 3.8Å; K142-L353 HydrophobicContact CD-CD2 3.8Å; K142-L353 HydrophobicContact CG-CD2 4.2Å; V144-L353 HydrophobicContact CG2-CD1 4.48Å; L166-L353 HydrophobicContact CD1-CD2 3.73Å; L166-L353 HydrophobicContact CD1-CG 4.47Å; A349-L353 WeakPolarHBondContact O-CB 3.42Å; A349-L353 WeakPolarHBondContact O-CD1 3.28Å; A349-L353 WeakPolarHBondContact O-CG 3.26Å; A349-L353 PolarHBondContact O-N 3.45Å; C350-L353 PolarHBondContact O-N 2.91Å; C350-L353 VanDerWaalsContact O-N 3.11Å; L353-K357 WeakPolarHBondContact O-CD 3.46Å; L353-K357 VanDerWaalsContact O-CE 3.26Å; L353-K357 WeakPolarHBondContact O-CE 3.23Å; L353-K357 PolarHBondContact O-NZ 3.06Å
354	K	95.4	Very high	93.7	Very high	75 Å²	75	56.6 Å²	56.6	33%	0.326	25%	0.253	S	S	.	.	H	α-helix	trans	-66.2	-44	173	-176.9	177.7	61.4	-173.6	0	111	T76 E101 C350 D351 Y352	T76-K354 WeakPolarHBondContact OG1-CB 3.22Å; E101-K354 PolarHBondContact O-NZ 3.34Å; C350-K354 WeakPolarHBondContact O-CB 3.4Å; C350-K354 PolarHBondContact O-N 3.25Å; D351-K354 WeakPolarHBondContact O-CB 3.34Å; D351-K354 PolarHBondContact O-N 3.34Å; D351-K354 WeakPolarHBondContact OD1-CE 3.35Å; D351-K354 IonicContact OD1-NZ 2.88Å; D351-K354 PolarHBondContact OD1-NZ 2.84Å; Y352-K354 PolarHBondContact O-N 2.99Å
355	R	95.1	Very high	93.7	Very high	143 Å²	143	56.4 Å²	56.4	54%	0.54	25%	0.252	S	S	.	.	H	α-helix	trans	-82.8	-23.2	-177.6	-67.5	-176.4	-77	109.6	-7.9	114.2	D351 Y352	D351-R355 WeakPolarHBondContact O-CG 3.49Å; D351-R355 PolarHBondContact O-N 2.95Å; D351-R355 PolarHBondContact O-NE 3.46Å; D351-R355 IonicContact OD1-NE 3.68Å; D351-R355 IonicContact OD2-CZ 3.58Å; D351-R355 IonicContact OD2-NE 3.72Å; D351-R355 PolarHBondContact OD2-NE 2.98Å; D351-R355 IonicContact OD2-NH2 3.28Å; D351-R355 PolarHBondContact OD2-NH2 2.9Å; Y352-R355 PolarHBondContact O-N 3.38Å
356	H	94.7	Very high	93.6	Very high	51 Å²	51	56.1 Å²	56.1	24%	0.236	25%	0.251	C	S	.	.			trans	-122.3	90.2	-171.2	-64.2	-80.7	0	0	0	111.4	K142 Y352 E358	K142-H356 PolarHBondContact NZ-O 2.98Å; Y352-H356 HydrophobicContact CD1-CB 4Å; Y352-H356 AromaticContact CD1-CD2 3.94Å; Y352-H356 AromaticContact CD2-CD2 3.61Å; Y352-H356 HydrophobicContact CE1-CB 3.66Å; Y352-H356 AromaticContact CE1-CD2 3.92Å; Y352-H356 AromaticContact CE1-CG 3.83Å; Y352-H356 AromaticContact CE2-CD2 3.6Å; Y352-H356 AromaticContact CE2-NE2 3.87Å; Y352-H356 AromaticContact CG-CD2 3.78Å; Y352-H356 AromaticContact CZ-CD2 3.76Å; Y352-H356 AromaticContact CZ-CG 3.8Å; Y352-H356 WeakPolarHBondContact O-CB 3.26Å; Y352-H356 PolarHBondContact O-CD2 2.96Å; Y352-H356 PolarHBondContact O-N 3.24Å; H356-E358 WeakPolarHBondContact CA-OE2 3.13Å; H356-E358 WeakPolarHBondContact CB-OE2 3.35Å; H356-E358 IonicContact CG-OE1 3.67Å; H356-E358 IonicContact ND1-OE1 2.93Å; H356-E358 PolarHBondContact ND1-OE1 3.41Å; H356-E358 IonicContact ND1-OE2 2.68Å
357	K	88.6	Confident	93.5	Very high	115 Å²	115	62.8 Å²	62.8	50%	0.5	28%	0.279	S	S	.	.			trans	-94.8	-9.8	-178.2	-62.4	-59.7	-174.3	-170.8	0	113.8	D116 K142 L353	D116-K357 IonicContact OD1-NZ 3.97Å; D116-K357 PolarHBondContact OD1-NZ 2.98Å; K142-K357 PolarHBondContact NZ-O 3.43Å; L353-K357 WeakPolarHBondContact O-CD 3.46Å; L353-K357 VanDerWaalsContact O-CE 3.26Å; L353-K357 WeakPolarHBondContact O-CE 3.23Å; L353-K357 PolarHBondContact O-NZ 3.06Å
358	E	90.6	Very high	93.3	Very high	83 Å²	83	64.8 Å²	64.8	39%	0.388	29%	0.287	S	S	.	.	S	Bend	trans	-59.5	154.6	179.2	72.4	-77.5	-175.2	0	0	113.2	K142 H356 R360	K142-E358 WeakPolarHBondContact CE-O 3.35Å; K142-E358 PolarHBondContact NZ-O 3.34Å; H356-E358 WeakPolarHBondContact CA-OE2 3.13Å; H356-E358 WeakPolarHBondContact CB-OE2 3.35Å; H356-E358 IonicContact CG-OE1 3.67Å; H356-E358 IonicContact ND1-OE1 2.93Å; H356-E358 PolarHBondContact ND1-OE1 3.41Å; H356-E358 IonicContact ND1-OE2 2.68Å; E358-R360 PolarHBondContact O-N 3.01Å; E358-R360 IonicContact OE1-NH1 2.69Å
359	Y	85.2	Confident	93.3	Very high	188 Å²	188	62 Å²	62	74%	0.737	27%	0.274	S	S	*	.			trans	-67.1	132.9	170.3	178	-92.8	0	0	0	109.9	A361	Y359-A361 HydrophobicContact CE1-CB 4.24Å
360	R	85.8	Confident	93.1	Very high	91 Å²	91	64.7 Å²	64.7	34%	0.343	28%	0.284	S	S	.	.			trans	-143.3	143.1	179.6	-165.2	157	176.5	145.5	3.2	109.9	N165 L166 D175 Y352 E358	N165-R360 WeakPolarHBondContact CB-O 3.39Å; N165-R360 PolarHBondContact ND2-O 3.45Å; L166-R360 HydrophobicContact CD2-CB 4.44Å; L166-R360 HydrophobicContact CD2-CG 4.16Å; D175-R360 IonicContact OD1-CZ 2.71Å; D175-R360 IonicContact OD1-NE 3.05Å; D175-R360 PolarHBondContact OD1-NE 3.37Å; D175-R360 IonicContact OD1-NH2 3.75Å; D175-R360 PolarHBondContact OD1-NH2 2.93Å; Y352-R360 PolarHBondContact OH-NH1 3.2Å; Y352-R360 VanDerWaalsContact OH-NH1 3.08Å; E358-R360 PolarHBondContact O-N 3.01Å; E358-R360 IonicContact OE1-NH1 2.69Å
361	A	85.9	Confident	92.8	Very high	45 Å²	45	68.7 Å²	68.7	37%	0.372	33%	0.326	S	S	.	.			trans	-138.2	125.1	174.5	0	0	0	0	0	108.9	Y359 K363	Y359-A361 HydrophobicContact CE1-CB 4.24Å; A361-K363 PolarHBondContact O-N 3.42Å
362	F	89.8	Confident	92.6	Very high	30 Å²	30	70.6 Å²	70.6	13%	0.132	33%	0.334	C	S	.	.			trans	-85.3	111.1	176.7	-162.6	-80	0	0	0	109.1	F164 N165 T167 D175 L365 W368	F164-F362 WeakPolarHBondContact O-CB 3.43Å; F164-F362 PolarHBondContact O-N 3.05Å; N165-F362 PolarHBondContact O-N 3.49Å; T167-F362 HydrophobicContact CG2-CD1 4.23Å; T167-F362 HydrophobicContact CG2-CD2 3.65Å; T167-F362 HydrophobicContact CG2-CE1 4.25Å; T167-F362 HydrophobicContact CG2-CE2 3.63Å; T167-F362 HydrophobicContact CG2-CG 3.95Å; T167-F362 HydrophobicContact CG2-CZ 3.95Å; D175-F362 WeakPolarHBondContact OD2-CD2 3.29Å; F362-L365 HydrophobicContact CD1-CB 4.11Å; F362-L365 HydrophobicContact CD1-CD1 3.94Å; F362-L365 HydrophobicContact CE1-CB 4.27Å; F362-L365 HydrophobicContact CE1-CD1 3.87Å; F362-W368 HydrophobicContact CE1-CB 3.93Å; F362-W368 HydrophobicContact CE1-CD2 4.25Å; F362-W368 HydrophobicContact CE1-CE3 4.26Å; F362-W368 HydrophobicContact CE1-CG 4.13Å; F362-W368 HydrophobicContact CZ-CB 3.89Å; F362-W368 AromaticContact CZ-CD2 3.66Å; F362-W368 HydrophobicContact CZ-CD2 3.66Å; F362-W368 AromaticContact CZ-CE3 3.97Å; F362-W368 HydrophobicContact CZ-CE3 3.97Å; F362-W368 AromaticContact CZ-CG 3.61Å; F362-W368 HydrophobicContact CZ-CG 3.61Å
363	K	90.1	Very high	92.3	Very high	152 Å²	152	73.3 Å²	73.3	66%	0.661	35%	0.347	S	S	*	.			trans	-89	145.2	178.6	-63.4	-176.4	-178.6	178.9	0	109.9	A361 L365	A361-K363 PolarHBondContact O-N 3.42Å; K363-L365 PolarHBondContact O-N 3.42Å
364	N	91.4	Very high	92	Very high	85 Å²	85	77.2 Å²	77.2	46%	0.455	37%	0.366	S	S	.	.			trans	56.6	45.6	170.5	-57.2	-41.7	0	0	0	115.5	N366 K367 W368	N364-N366 PolarHBondContact O-N 3.04Å; N364-N366 VanDerWaalsContact O-N 3.14Å; N364-K367 HydrophobicContact CB-CB 4.08Å; N364-K367 PolarHBondContact O-N 3.43Å; N364-W368 PolarHBondContact O-N 2.96Å
365	L	95.3	Very high	91.8	Very high	2 Å²	2	77.4 Å²	77.4	1%	0.01	37%	0.368	C	S	.	.	H	α-helix	trans	-48.6	-41	175	-172.8	69.8	0	0	0	113	W145 I160 N161 F164 T167 F362 K363 K367 W368 Y369	W145-L365 HydrophobicContact CB-CD2 4.36Å; W145-L365 HydrophobicContact CD2-CD1 4.03Å; W145-L365 HydrophobicContact CD2-CD2 3.87Å; W145-L365 HydrophobicContact CD2-CG 4.48Å; W145-L365 HydrophobicContact CE3-CD1 3.98Å; W145-L365 HydrophobicContact CG-CD1 4.4Å; W145-L365 HydrophobicContact CG-CD2 3.73Å; W145-L365 HydrophobicContact CZ3-CD1 4.37Å; I160-L365 HydrophobicContact CD1-CD2 3.79Å; I160-L365 HydrophobicContact CG1-CD2 3.87Å; I160-L365 HydrophobicContact CG2-CB 4.47Å; I160-L365 HydrophobicContact CG2-CD2 4.03Å; N161-L365 PolarHBondContact OD1-N 2.96Å; N161-L365 VanDerWaalsContact OD1-N 3.16Å; F164-L365 HydrophobicContact CD2-CD2 4.09Å; T167-L365 HydrophobicContact CG2-CD1 3.68Å; F362-L365 HydrophobicContact CD1-CB 4.11Å; F362-L365 HydrophobicContact CD1-CD1 3.94Å; F362-L365 HydrophobicContact CE1-CB 4.27Å; F362-L365 HydrophobicContact CE1-CD1 3.87Å; K363-L365 PolarHBondContact O-N 3.42Å; L365-K367 PolarHBondContact O-N 2.99Å; L365-W368 HydrophobicContact CD1-CE3 3.83Å; L365-W368 HydrophobicContact CD1-CZ3 4.01Å; L365-W368 PolarHBondContact O-N 3.19Å; L365-Y369 WeakPolarHBondContact O-CB 3.28Å; L365-Y369 PolarHBondContact O-N 3.47Å
366	N	94.8	Very high	91.6	Very high	2 Å²	2	73.3 Å²	73.3	1%	0.011	36%	0.358	C	S	.	.	H	α-helix	trans	-61.3	-45.1	178.5	-82.9	-31.1	0	0	0	112.9	R156 L157 I160 N161 N364 W370	R156-N366 WeakPolarHBondContact CG-OD1 3.28Å; L157-N366 PolarHBondContact O-ND2 3.4Å; L157-N366 PolarHBondContact O-OD1 3.07Å; I160-N366 WeakPolarHBondContact CG2-OD1 3.47Å; N161-N366 WeakPolarHBondContact OD1-CB 3.19Å; N161-N366 PolarHBondContact OD1-N 3.08Å; N364-N366 PolarHBondContact O-N 3.04Å; N364-N366 VanDerWaalsContact O-N 3.14Å; N366-W370 HydrophobicContact CB-CE3 4.48Å; N366-W370 PolarHBondContact O-N 3.41Å; N366-W370 WeakPolarHBondContact OD1-CZ3 3.4Å
367	K	95	Very high	91.4	Very high	140 Å²	140	74.7 Å²	74.7	61%	0.609	37%	0.366	S	S	*	.	H	α-helix	trans	-67.9	-45.7	179.1	-174.1	-179.4	179.6	176	0	110.6	N364 L365 Y369 G371	N364-K367 HydrophobicContact CB-CB 4.08Å; N364-K367 PolarHBondContact O-N 3.43Å; L365-K367 PolarHBondContact O-N 2.99Å; K367-Y369 PolarHBondContact O-N 3.26Å; K367-G371 WeakPolarHBondContact CG-OXT 3.23Å; K367-G371 CarbonylContact O-C 3.59Å; K367-G371 VanDerWaalsContact O-CA 3.29Å; K367-G371 WeakPolarHBondContact O-CA 3.43Å; K367-G371 PolarHBondContact O-N 3.45Å
368	W	95.8	Very high	91.6	Very high	44 Å²	44	71.9 Å²	71.9	17%	0.167	36%	0.356	C	S	.	.	H	α-helix	trans	-59.9	-47.2	178.9	169.8	81.5	0	0	0	111.4	W145 T167 N169 R171 D173 F362 N364 L365	W145-W368 HydrophobicContact CE3-CZ3 4.27Å; W145-W368 HydrophobicContact CH2-CZ3 4.31Å; W145-W368 HydrophobicContact CZ3-CH2 4.24Å; W145-W368 AromaticContact CZ3-CZ3 3.64Å; W145-W368 HydrophobicContact CZ3-CZ3 3.64Å; T167-W368 HydrophobicContact CG2-CE3 4.41Å; T167-W368 HydrophobicContact CG2-CH2 4.22Å; T167-W368 HydrophobicContact CG2-CZ3 3.94Å; N169-W368 HydrophobicContact CB-CH2 3.94Å; R171-W368 HydrophobicContact CB-CZ2 4.12Å; R171-W368 PolarHBondContact NH1-O 3.43Å; D173-W368 PolarHBondContact OD1-NE1 3.35Å; D173-W368 VanDerWaalsContact OD1-NE1 3.08Å; F362-W368 HydrophobicContact CE1-CB 3.93Å; F362-W368 HydrophobicContact CE1-CD2 4.25Å; F362-W368 HydrophobicContact CE1-CE3 4.26Å; F362-W368 HydrophobicContact CE1-CG 4.13Å; F362-W368 HydrophobicContact CZ-CB 3.89Å; F362-W368 AromaticContact CZ-CD2 3.66Å; F362-W368 HydrophobicContact CZ-CD2 3.66Å; F362-W368 AromaticContact CZ-CE3 3.97Å; F362-W368 HydrophobicContact CZ-CE3 3.97Å; F362-W368 AromaticContact CZ-CG 3.61Å; F362-W368 HydrophobicContact CZ-CG 3.61Å; N364-W368 PolarHBondContact O-N 2.96Å; L365-W368 HydrophobicContact CD1-CE3 3.83Å; L365-W368 HydrophobicContact CD1-CZ3 4.01Å; L365-W368 PolarHBondContact O-N 3.19Å
369	Y	96.2	Very high	91.7	Very high	4 Å²	4	71 Å²	71	2%	0.016	35%	0.354	C	S	.	.	H	α-helix	trans	-84.3	-42.3	-171.1	-164.1	-116.4	0	0	0	114.6	W145 N147 E149 P151 N169 Y170 L365 K367	W145-Y369 AromaticContact CH2-CD1 3.75Å; W145-Y369 HydrophobicContact CH2-CD1 3.75Å; W145-Y369 AromaticContact CH2-CD2 3.74Å; W145-Y369 HydrophobicContact CH2-CD2 3.74Å; W145-Y369 AromaticContact CH2-CE1 3.9Å; W145-Y369 HydrophobicContact CH2-CE1 3.9Å; W145-Y369 AromaticContact CH2-CE2 3.92Å; W145-Y369 HydrophobicContact CH2-CE2 3.92Å; W145-Y369 AromaticContact CH2-CG 3.68Å; W145-Y369 HydrophobicContact CH2-CG 3.68Å; W145-Y369 HydrophobicContact CZ2-CD1 4.2Å; W145-Y369 HydrophobicContact CZ2-CE1 4.42Å; W145-Y369 HydrophobicContact CZ2-CG 4.43Å; W145-Y369 HydrophobicContact CZ3-CD2 4.18Å; W145-Y369 HydrophobicContact CZ3-CE2 4.42Å; W145-Y369 HydrophobicContact CZ3-CG 4.45Å; N147-Y369 WeakPolarHBondContact ND2-CE1 3.47Å; E149-Y369 VanDerWaalsContact C-OH 3.32Å; E149-Y369 PolarHBondContact O-OH 3.09Å; P151-Y369 HydrophobicContact CB-CD1 4.42Å; P151-Y369 HydrophobicContact CB-CE1 4.19Å; P151-Y369 HydrophobicContact CG-CD1 4.19Å; P151-Y369 HydrophobicContact CG-CE1 3.87Å; P151-Y369 HydrophobicContact CG-CE2 4.23Å; P151-Y369 WeakPolarHBondContact CG-O 3.48Å; N169-Y369 WeakPolarHBondContact ND2-CE2 3.37Å; Y170-Y369 HydrophobicContact CE1-CE2 4.41Å; Y170-Y369 WeakPolarHBondContact CE1-OH 3.46Å; Y170-Y369 PolarHBondContact OH-OH 3.48Å; L365-Y369 WeakPolarHBondContact O-CB 3.28Å; L365-Y369 PolarHBondContact O-N 3.47Å; K367-Y369 PolarHBondContact O-N 3.26Å
370	W	95.4	Very high	92.2	Very high	55 Å²	55	61.3 Å²	61.3	21%	0.208	32%	0.322	C	S	.	.	H	α-helix	trans	-101.7	-10.6	-175.8	-71.4	-90.9	0	0	0	114.5	H122 W145 P151 S154 G155 R156 N366	H122-W370 AromaticContact CE1-CH2 3.51Å; H122-W370 AromaticContact CE1-CZ2 3.9Å; H122-W370 AromaticContact NE2-CH2 3.75Å; H122-W370 AromaticContact NE2-CZ2 3.66Å; W145-W370 HydrophobicContact CZ2-CH2 4.31Å; P151-W370 HydrophobicContact CB-CG 4.27Å; P151-W370 PolarHBondContact O-NE1 2.97Å; S154-W370 WeakPolarHBondContact O-CZ2 3.47Å; S154-W370 PolarHBondContact O-NE1 3.5Å; G155-W370 WeakPolarHBondContact O-CZ2 3.34Å; R156-W370 HydrophobicContact CB-CD2 4.21Å; R156-W370 HydrophobicContact CB-CZ2 4.37Å; R156-W370 HydrophobicContact CG-CD2 4.17Å; R156-W370 HydrophobicContact CG-CE3 4.29Å; N366-W370 HydrophobicContact CB-CE3 4.48Å; N366-W370 PolarHBondContact O-N 3.41Å; N366-W370 WeakPolarHBondContact OD1-CZ3 3.4Å
371	G	91.4	Very high	92.8	Very high	85 Å²	85	58.5 Å²	58.5	88%	0.876	32%	0.32	S	S	*	.			trans	103.2	0	-171.9	0	0	0	0	0	113.1	K367	K367-G371 WeakPolarHBondContact CG-OXT 3.23Å; K367-G371 CarbonylContact O-C 3.59Å; K367-G371 VanDerWaalsContact O-CA 3.29Å; K367-G371 WeakPolarHBondContact O-CA 3.43Å; K367-G371 PolarHBondContact O-N 3.45Å

Retrieved 371 of 371 residues in 119 ms (Link to these results)

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