A0A087Y0Z4_POEFO Loading...

Sulfotransferase

AlphaFold DB (A0A3B3ULR0), UniProt , Accession A0A087Y0Z4, 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	43.8	Very low	46.8	Very low	242 Å²	242	153.1 Å²	153.1	100%	1.192	79%	0.792	S	S	*	*				0	158.1	0	-165.7	175.8	-87.2	0	0	107.8
2	A	35.7	Very low	47.8	Very low	80 Å²	80	147 Å²	147	66%	0.661	77%	0.766	S	S	*	*			trans	63.1	122.1	-157.2	0	0	0	0	0	112.4
3	Q	40.4	Very low	48.8	Very low	180 Å²	180	142.2 Å²	142.2	84%	0.841	75%	0.753	S	S	*	*			cis	74.8	106.6	47.4	-63.6	171.9	-53.7	0	0	112.2
4	R	49.4	Very low	49.8	Very low	243 Å²	243	136.4 Å²	136.4	92%	0.917	74%	0.735	S	S	*	*				64.6	86.5	76.5	-82.3	-164.1	173.3	-166.8	1.5	113.8
5	L	42.3	Very low	51	Low	172 Å²	172	139.7 Å²	139.7	90%	0.901	73%	0.733	S	S	*	*			trans	-141.1	92	151.9	-87	175.2	0	0	0	109.7
6	L	43.1	Very low	52.1	Low	175 Å²	175	140 Å²	140	92%	0.916	73%	0.727	S	S	*	*			trans	-86.6	120.7	167.4	-97.9	163.5	0	0	0	108.5
7	T	47.6	Very low	53	Low	105 Å²	105	135.1 Å²	135.1	64%	0.644	71%	0.712	S	S	*	*			trans	-77.8	147.7	-168.4	50.2	0	0	0	0	113.4	A9	T7-A9 PolarHBondContact O-N 3.19Å; T7-A9 VanDerWaalsContact O-N 3.17Å
8	S	53.8	Low	54.2	Low	100 Å²	100	135.5 Å²	135.5	70%	0.699	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	-27.7	-171.8	-165.8	0	0	0	0	114.5	N10 R11	S8-N10 VanDerWaalsContact C-N 3.33Å; S8-N10 PolarHBondContact O-N 3.5Å; S8-R11 PolarHBondContact O-N 3.18Å
9	A	51.1	Low	55.5	Low	66 Å²	66	134.2 Å²	134.2	55%	0.545	70%	0.699	S	S	.	*	H	α-helix	trans	-53.5	-40.9	-170.3	0	0	0	0	0	114.6	T7 R11 V12 S13	T7-A9 PolarHBondContact O-N 3.19Å; T7-A9 VanDerWaalsContact O-N 3.17Å; A9-R11 VanDerWaalsContact C-N 3.25Å; A9-R11 PolarHBondContact O-N 3.26Å; A9-V12 PolarHBondContact O-N 3.07Å; A9-V12 VanDerWaalsContact O-N 3.12Å; A9-S13 PolarHBondContact O-N 3.15Å
10	N	53.3	Low	56.4	Low	116 Å²	116	134.8 Å²	134.8	62%	0.62	70%	0.696	S	S	*	*	H	α-helix	trans	-65.6	-24.9	-174.7	-77.3	-3.2	0	0	0	113.6	S8 A14	S8-N10 VanDerWaalsContact C-N 3.33Å; S8-N10 PolarHBondContact O-N 3.5Å; N10-A14 WeakPolarHBondContact O-CB 3.31Å; N10-A14 PolarHBondContact O-N 3.21Å
11	R	54.6	Low	57.2	Low	205 Å²	205	132.4 Å²	132.4	77%	0.774	69%	0.688	S	S	*	*	H	α-helix	trans	-73.5	-25.9	176.5	-74.9	-175	171.8	-173.7	-2.8	113.3	S8 A9 R15	S8-R11 PolarHBondContact O-N 3.18Å; A9-R11 VanDerWaalsContact C-N 3.25Å; A9-R11 PolarHBondContact O-N 3.26Å; R11-R15 VanDerWaalsContact O-CG 3.31Å; R11-R15 WeakPolarHBondContact O-CG 3.43Å; R11-R15 PolarHBondContact O-N 3.17Å
12	V	58	Low	59	Low	80 Å²	80	125.8 Å²	125.8	49%	0.485	66%	0.657	S	S	.	*	H	α-helix	trans	-79.2	-48	178.6	-179.7	0	0	0	0	110	A9 A14 R15 F16	A9-V12 PolarHBondContact O-N 3.07Å; A9-V12 VanDerWaalsContact O-N 3.12Å; V12-A14 PolarHBondContact O-N 3.11Å; V12-R15 PolarHBondContact O-N 3.43Å; V12-R15 VanDerWaalsContact O-N 3.15Å; V12-F16 HydrophobicContact CG1-CD2 3.82Å; V12-F16 HydrophobicContact CG1-CE2 3.67Å; V12-F16 WeakPolarHBondContact O-CD2 3.49Å; V12-F16 PolarHBondContact O-N 3.07Å; V12-F16 VanDerWaalsContact O-N 3.07Å
13	S	60.8	Low	61.2	Low	84 Å²	84	125.6 Å²	125.6	59%	0.587	65%	0.651	S	S	*	*	H	α-helix	trans	-57.2	-47.7	177.3	-175.6	0	0	0	0	112.5	A9 R15 F16 A17	A9-S13 PolarHBondContact O-N 3.15Å; S13-R15 VanDerWaalsContact C-N 3.29Å; S13-R15 PolarHBondContact O-N 3.39Å; S13-F16 PolarHBondContact O-N 3.12Å; S13-A17 PolarHBondContact O-N 3.43Å
14	A	62.8	Low	62.9	Low	62 Å²	62	122 Å²	122	51%	0.512	64%	0.637	S	S	.	*	H	α-helix	trans	-61.4	-34.1	177.7	0	0	0	0	0	113.4	N10 V12 F18	N10-A14 WeakPolarHBondContact O-CB 3.31Å; N10-A14 PolarHBondContact O-N 3.21Å; V12-A14 PolarHBondContact O-N 3.11Å; A14-F18 WeakPolarHBondContact O-CB 3.28Å; A14-F18 PolarHBondContact O-N 3.22Å; A14-F18 VanDerWaalsContact O-N 3.12Å
15	R	67.9	Low	64.5	Low	186 Å²	186	113 Å²	113	70%	0.702	61%	0.612	S	S	*	*	H	α-helix	trans	-70	-42.8	175.7	-78.4	175.9	171.7	-165.3	-4.3	112	R11 V12 S13 F18 I19	R11-R15 VanDerWaalsContact O-CG 3.31Å; R11-R15 WeakPolarHBondContact O-CG 3.43Å; R11-R15 PolarHBondContact O-N 3.17Å; V12-R15 PolarHBondContact O-N 3.43Å; V12-R15 VanDerWaalsContact O-N 3.15Å; S13-R15 VanDerWaalsContact C-N 3.29Å; S13-R15 PolarHBondContact O-N 3.39Å; R15-F18 PolarHBondContact O-N 3.3Å; R15-I19 WeakPolarHBondContact O-CD1 3.42Å; R15-I19 VanDerWaalsContact O-CG1 3.28Å; R15-I19 WeakPolarHBondContact O-CG1 3.46Å; R15-I19 PolarHBondContact O-N 3.01Å
16	F	68.7	Low	66.3	Low	144 Å²	144	108.2 Å²	108.2	63%	0.632	59%	0.591	S	S	*	*	H	α-helix	trans	-63.2	-43.1	174.8	-83.4	-70.7	0	0	0	112.1	V12 S13 F18 I19 F20	V12-F16 HydrophobicContact CG1-CD2 3.82Å; V12-F16 HydrophobicContact CG1-CE2 3.67Å; V12-F16 WeakPolarHBondContact O-CD2 3.49Å; V12-F16 PolarHBondContact O-N 3.07Å; V12-F16 VanDerWaalsContact O-N 3.07Å; S13-F16 PolarHBondContact O-N 3.12Å; F16-F18 PolarHBondContact O-N 3.37Å; F16-I19 PolarHBondContact O-N 2.96Å; F16-F20 WeakPolarHBondContact O-CB 3.4Å; F16-F20 PolarHBondContact O-N 3.42Å
17	A	67.8	Low	68.1	Low	57 Å²	57	102.7 Å²	102.7	47%	0.471	57%	0.571	S	S	.	*	H	α-helix	trans	-57.8	-46.1	175.6	0	0	0	0	0	112.1	S13 F20 T21	S13-A17 PolarHBondContact O-N 3.43Å; A17-F20 PolarHBondContact O-N 3.35Å; A17-T21 PolarHBondContact O-N 2.85Å; A17-T21 PolarHBondContact O-OG1 2.98Å
18	F	75	Confident	69.7	Low	142 Å²	142	105 Å²	105	62%	0.623	57%	0.569	S	S	*	*	H	α-helix	trans	-66.1	-38.5	178.8	-172.7	-95.1	0	0	0	113.3	A14 R15 F16 F20 T21 L22	A14-F18 WeakPolarHBondContact O-CB 3.28Å; A14-F18 PolarHBondContact O-N 3.22Å; A14-F18 VanDerWaalsContact O-N 3.12Å; R15-F18 PolarHBondContact O-N 3.3Å; F16-F18 PolarHBondContact O-N 3.37Å; F18-F20 VanDerWaalsContact C-N 3.33Å; F18-T21 PolarHBondContact O-OG1 3.12Å; F18-T21 VanDerWaalsContact O-OG1 3.11Å; F18-L22 VanDerWaalsContact O-CB 3.31Å; F18-L22 WeakPolarHBondContact O-CB 3.31Å; F18-L22 PolarHBondContact O-N 3.33Å
19	I	78.4	Confident	71	Confident	110 Å²	110	105.3 Å²	105.3	56%	0.564	56%	0.562	S	S	*	*	H	α-helix	trans	-65.7	-38.8	174.8	-69	164.9	0	0	0	110.6	R15 F16 L22 S23	R15-I19 WeakPolarHBondContact O-CD1 3.42Å; R15-I19 VanDerWaalsContact O-CG1 3.28Å; R15-I19 WeakPolarHBondContact O-CG1 3.46Å; R15-I19 PolarHBondContact O-N 3.01Å; F16-I19 PolarHBondContact O-N 2.96Å; I19-L22 PolarHBondContact O-N 3.39Å; I19-S23 WeakPolarHBondContact O-CB 3.42Å; I19-S23 PolarHBondContact O-N 2.98Å
20	F	72.9	Confident	72.3	Confident	146 Å²	146	105.2 Å²	105.2	64%	0.64	56%	0.557	S	S	*	*	H	α-helix	trans	-70.6	-41.2	-178.9	-151.6	-95.7	0	0	0	112.6	F16 A17 F18 S23 L24	F16-F20 WeakPolarHBondContact O-CB 3.4Å; F16-F20 PolarHBondContact O-N 3.42Å; A17-F20 PolarHBondContact O-N 3.35Å; F18-F20 VanDerWaalsContact C-N 3.33Å; F20-S23 PolarHBondContact O-N 3.28Å; F20-L24 HydrophobicContact CD1-CD1 3.79Å; F20-L24 HydrophobicContact CD1-CG 4.49Å; F20-L24 HydrophobicContact CE1-CD1 3.93Å; F20-L24 PolarHBondContact O-N 3.41Å
21	T	74.8	Confident	73.4	Confident	86 Å²	86	106.2 Å²	106.2	53%	0.528	55%	0.553	S	S	.	*	H	α-helix	trans	-67.1	-38.2	174	54.3	0	0	0	0	112.2	A17 F18 L24 S25	A17-T21 PolarHBondContact O-N 2.85Å; A17-T21 PolarHBondContact O-OG1 2.98Å; F18-T21 PolarHBondContact O-OG1 3.12Å; F18-T21 VanDerWaalsContact O-OG1 3.11Å; T21-L24 PolarHBondContact O-N 3.49Å; T21-S25 PolarHBondContact O-N 3.44Å; T21-S25 PolarHBondContact O-OG 3.45Å
22	L	80.4	Confident	74.1	Confident	102 Å²	102	98.8 Å²	98.8	53%	0.534	53%	0.529	S	S	.	.	H	α-helix	trans	-63.7	-42.5	175.2	-170.6	65.1	0	0	0	111.4	F18 I19 S25 C26	F18-L22 VanDerWaalsContact O-CB 3.31Å; F18-L22 WeakPolarHBondContact O-CB 3.31Å; F18-L22 PolarHBondContact O-N 3.33Å; I19-L22 PolarHBondContact O-N 3.39Å; L22-S25 PolarHBondContact O-N 2.96Å; L22-S25 PolarHBondContact O-OG 3.29Å; L22-C26 WeakPolarHBondContact O-CB 3.3Å; L22-C26 PolarHBondContact O-N 2.91Å
23	S	82.1	Confident	74.9	Confident	76 Å²	76	101 Å²	101	53%	0.531	54%	0.536	S	S	.	.	H	α-helix	trans	-59.1	-47.4	174.3	-173.2	0	0	0	0	112.4	I19 F20 S25 C26 A27	I19-S23 WeakPolarHBondContact O-CB 3.42Å; I19-S23 PolarHBondContact O-N 2.98Å; F20-S23 PolarHBondContact O-N 3.28Å; S23-S25 PolarHBondContact O-N 3.02Å; S23-C26 PolarHBondContact O-N 2.94Å; S23-A27 WeakPolarHBondContact O-CB 3.42Å; S23-A27 PolarHBondContact O-N 3.3Å
24	L	77.1	Confident	75.3	Confident	104 Å²	104	102.6 Å²	102.6	55%	0.545	54%	0.537	S	S	.	.	H	α-helix	trans	-61.8	-42	176.8	-78.8	163.6	0	0	0	112.7	F20 T21 A27 Y28	F20-L24 HydrophobicContact CD1-CD1 3.79Å; F20-L24 HydrophobicContact CD1-CG 4.49Å; F20-L24 HydrophobicContact CE1-CD1 3.93Å; F20-L24 PolarHBondContact O-N 3.41Å; T21-L24 PolarHBondContact O-N 3.49Å; L24-A27 PolarHBondContact O-N 3.46Å; L24-Y28 WeakPolarHBondContact O-CB 3.42Å; L24-Y28 PolarHBondContact O-N 3.21Å
25	S	81.4	Confident	74.9	Confident	56 Å²	56	105.9 Å²	105.9	39%	0.392	54%	0.54	S	S	.	.	H	α-helix	trans	-67.1	-37.5	177.8	71.7	0	0	0	0	112.5	T21 L22 S23 Y28 L29	T21-S25 PolarHBondContact O-N 3.44Å; T21-S25 PolarHBondContact O-OG 3.45Å; L22-S25 PolarHBondContact O-N 2.96Å; L22-S25 PolarHBondContact O-OG 3.29Å; S23-S25 PolarHBondContact O-N 3.02Å; S25-Y28 PolarHBondContact O-N 3Å; S25-L29 WeakPolarHBondContact O-CG 3.28Å; S25-L29 PolarHBondContact O-N 3.44Å
26	C	80.8	Confident	73.9	Confident	70 Å²	70	106.4 Å²	106.4	47%	0.473	54%	0.543	S	S	.	.	H	α-helix	trans	-66.3	-44.8	174.8	-167	0	0	0	0	111.5	L22 S23 Y28 L29 C30	L22-C26 WeakPolarHBondContact O-CB 3.3Å; L22-C26 PolarHBondContact O-N 2.91Å; S23-C26 PolarHBondContact O-N 2.94Å; C26-Y28 VanDerWaalsContact C-N 3.31Å; C26-Y28 PolarHBondContact O-N 3.38Å; C26-L29 PolarHBondContact O-N 2.93Å; C26-C30 PolarHBondContact O-N 3Å; C26-C30 PolarHBondContact O-SG 3.25Å; C26-C30 VanDerWaalsContact O-SG 3.41Å
27	A	81.7	Confident	72.7	Confident	59 Å²	59	111 Å²	111	49%	0.488	56%	0.557	S	S	.	*	H	α-helix	trans	-59.7	-40.1	174.5	0	0	0	0	0	112.4	S23 L24 C30 Y31	S23-A27 WeakPolarHBondContact O-CB 3.42Å; S23-A27 PolarHBondContact O-N 3.3Å; L24-A27 PolarHBondContact O-N 3.46Å; A27-C30 PolarHBondContact O-N 3.4Å; A27-Y31 WeakPolarHBondContact O-CB 3.48Å; A27-Y31 PolarHBondContact O-N 2.97Å
28	Y	81.3	Confident	71.4	Confident	154 Å²	154	111.9 Å²	111.9	60%	0.604	57%	0.571	S	S	*	*	H	α-helix	trans	-66.1	-40	175.7	-175.7	-103.7	0	0	0	112.7	L24 S25 C26 Y31 N32	L24-Y28 WeakPolarHBondContact O-CB 3.42Å; L24-Y28 PolarHBondContact O-N 3.21Å; S25-Y28 PolarHBondContact O-N 3Å; C26-Y28 VanDerWaalsContact C-N 3.31Å; C26-Y28 PolarHBondContact O-N 3.38Å; Y28-Y31 PolarHBondContact O-N 3.4Å; Y28-N32 VanDerWaalsContact CE1-ND2 3.28Å; Y28-N32 WeakPolarHBondContact CE1-ND2 3.46Å; Y28-N32 VanDerWaalsContact CZ-ND2 3.33Å; Y28-N32 PolarHBondContact O-N 3Å; Y28-N32 PolarHBondContact O-ND2 3.34Å
29	L	80.8	Confident	69.7	Low	107 Å²	107	109.3 Å²	109.3	56%	0.56	58%	0.576	S	S	*	*	H	α-helix	trans	-64.5	-44.7	173.9	-74.8	166.2	0	0	0	111.7	S25 C26 Y31 N32 I33	S25-L29 WeakPolarHBondContact O-CG 3.28Å; S25-L29 PolarHBondContact O-N 3.44Å; C26-L29 PolarHBondContact O-N 2.93Å; L29-Y31 PolarHBondContact O-N 3.31Å; L29-N32 PolarHBondContact O-N 2.97Å; L29-I33 VanDerWaalsContact O-CG1 3.3Å; L29-I33 WeakPolarHBondContact O-CG1 3.35Å; L29-I33 PolarHBondContact O-N 2.82Å
30	C	76.9	Confident	67.7	Low	63 Å²	63	110 Å²	110	43%	0.426	59%	0.585	S	S	.	*	H	α-helix	trans	-60.1	-42.7	174.1	-69.8	0	0	0	0	112.2	C26 A27 I33 I34	C26-C30 PolarHBondContact O-N 3Å; C26-C30 PolarHBondContact O-SG 3.25Å; C26-C30 VanDerWaalsContact O-SG 3.41Å; A27-C30 PolarHBondContact O-N 3.4Å; C30-I33 PolarHBondContact O-N 3.05Å; C30-I34 WeakPolarHBondContact O-CB 3.48Å; C30-I34 WeakPolarHBondContact O-CD1 3.44Å; C30-I34 VanDerWaalsContact O-CG1 3.25Å; C30-I34 WeakPolarHBondContact O-CG1 3.37Å; C30-I34 PolarHBondContact O-N 3.47Å
31	Y	77.8	Confident	65.6	Low	137 Å²	137	112.1 Å²	112.1	54%	0.537	60%	0.599	S	S	.	*	H	α-helix	trans	-59	-48.9	175.1	-177.2	-91.1	0	0	0	111.4	A27 Y28 L29 I33 I34 F35	A27-Y31 WeakPolarHBondContact O-CB 3.48Å; A27-Y31 PolarHBondContact O-N 2.97Å; Y28-Y31 PolarHBondContact O-N 3.4Å; L29-Y31 PolarHBondContact O-N 3.31Å; Y31-I33 PolarHBondContact O-N 2.98Å; Y31-I34 PolarHBondContact O-N 3.38Å; Y31-F35 HydrophobicContact CD1-CD2 4.27Å; Y31-F35 AromaticContact CD2-CD2 3.65Å; Y31-F35 HydrophobicContact CD2-CD2 3.65Å; Y31-F35 AromaticContact CD2-CE2 3.66Å; Y31-F35 HydrophobicContact CD2-CE2 3.66Å; Y31-F35 HydrophobicContact CE1-CD2 4.11Å; Y31-F35 HydrophobicContact CE1-CG 4.49Å; Y31-F35 AromaticContact CE2-CD2 3.46Å; Y31-F35 HydrophobicContact CE2-CD2 3.46Å; Y31-F35 VanDerWaalsContact CE2-CD2 3.46Å; Y31-F35 AromaticContact CE2-CE2 3.35Å; Y31-F35 HydrophobicContact CE2-CE2 3.35Å; Y31-F35 HydrophobicContact CE2-CG 4.37Å; Y31-F35 HydrophobicContact CE2-CZ 4.18Å; Y31-F35 HydrophobicContact CG-CD2 4.05Å; Y31-F35 HydrophobicContact CG-CE2 4.5Å; Y31-F35 AromaticContact CZ-CD2 3.7Å; Y31-F35 AromaticContact CZ-CE2 3.98Å; Y31-F35 WeakPolarHBondContact O-CD2 3.47Å; Y31-F35 PolarHBondContact O-N 3.45Å
32	N	69.3	Low	63.4	Low	50 Å²	50	113.1 Å²	113.1	27%	0.267	61%	0.605	S	S	.	*	H	α-helix	trans	-60.1	-46	177.2	-80.5	-86	0	0	0	111.8	Y28 L29 I34 F35 Y36	Y28-N32 VanDerWaalsContact CE1-ND2 3.28Å; Y28-N32 WeakPolarHBondContact CE1-ND2 3.46Å; Y28-N32 VanDerWaalsContact CZ-ND2 3.33Å; Y28-N32 PolarHBondContact O-N 3Å; Y28-N32 PolarHBondContact O-ND2 3.34Å; L29-N32 PolarHBondContact O-N 2.97Å; N32-I34 VanDerWaalsContact C-N 3.33Å; N32-I34 PolarHBondContact O-N 3.32Å; N32-F35 PolarHBondContact O-N 2.89Å; N32-Y36 WeakPolarHBondContact O-CB 3.25Å; N32-Y36 PolarHBondContact O-N 3.35Å
33	I	74.3	Confident	60.9	Low	126 Å²	126	116.1 Å²	116.1	65%	0.646	62%	0.622	S	S	*	*	H	α-helix	trans	-61.7	-38.6	179.4	-69.5	164.2	0	0	0	112.2	L29 C30 Y31	L29-I33 VanDerWaalsContact O-CG1 3.3Å; L29-I33 WeakPolarHBondContact O-CG1 3.35Å; L29-I33 PolarHBondContact O-N 2.82Å; C30-I33 PolarHBondContact O-N 3.05Å; Y31-I33 PolarHBondContact O-N 2.98Å
34	I	69.9	Low	58.3	Low	118 Å²	118	120.5 Å²	120.5	61%	0.605	63%	0.634	S	S	*	*	H	α-helix	trans	-69.9	-45	178	-69.8	165.5	0	0	0	111	C30 Y31 N32	C30-I34 WeakPolarHBondContact O-CB 3.48Å; C30-I34 WeakPolarHBondContact O-CD1 3.44Å; C30-I34 VanDerWaalsContact O-CG1 3.25Å; C30-I34 WeakPolarHBondContact O-CG1 3.37Å; C30-I34 PolarHBondContact O-N 3.47Å; Y31-I34 PolarHBondContact O-N 3.38Å; N32-I34 VanDerWaalsContact C-N 3.33Å; N32-I34 PolarHBondContact O-N 3.32Å
35	F	53.7	Low	55.8	Low	131 Å²	131	122 Å²	122	58%	0.575	65%	0.648	S	S	*	*	H	α-helix	trans	-88.6	-18.8	-172.3	-75.8	-82.6	0	0	0	115	Y31 N32 R37	Y31-F35 HydrophobicContact CD1-CD2 4.27Å; Y31-F35 AromaticContact CD2-CD2 3.65Å; Y31-F35 HydrophobicContact CD2-CD2 3.65Å; Y31-F35 AromaticContact CD2-CE2 3.66Å; Y31-F35 HydrophobicContact CD2-CE2 3.66Å; Y31-F35 HydrophobicContact CE1-CD2 4.11Å; Y31-F35 HydrophobicContact CE1-CG 4.49Å; Y31-F35 AromaticContact CE2-CD2 3.46Å; Y31-F35 HydrophobicContact CE2-CD2 3.46Å; Y31-F35 VanDerWaalsContact CE2-CD2 3.46Å; Y31-F35 AromaticContact CE2-CE2 3.35Å; Y31-F35 HydrophobicContact CE2-CE2 3.35Å; Y31-F35 HydrophobicContact CE2-CG 4.37Å; Y31-F35 HydrophobicContact CE2-CZ 4.18Å; Y31-F35 HydrophobicContact CG-CD2 4.05Å; Y31-F35 HydrophobicContact CG-CE2 4.5Å; Y31-F35 AromaticContact CZ-CD2 3.7Å; Y31-F35 AromaticContact CZ-CE2 3.98Å; Y31-F35 WeakPolarHBondContact O-CD2 3.47Å; Y31-F35 PolarHBondContact O-N 3.45Å; N32-F35 PolarHBondContact O-N 2.89Å; F35-R37 PolarHBondContact O-N 2.91Å
36	Y	46.6	Very low	53.2	Low	197 Å²	197	129.4 Å²	129.4	77%	0.773	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-13.5	175.1	-119.7	-93.5	0	0	0	114.4	N32 G38	N32-Y36 WeakPolarHBondContact O-CB 3.25Å; N32-Y36 PolarHBondContact O-N 3.35Å; Y36-G38 VanDerWaalsContact C-N 3.33Å
37	R	43.9	Very low	50.6	Low	241 Å²	241	133.6 Å²	133.6	91%	0.909	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	8.2	-178.5	-116.9	-178.9	-177.9	-161.8	-0.5	114.8	F35	F35-R37 PolarHBondContact O-N 2.91Å
38	G	41.1	Very low	48	Very low	74 Å²	74	133.9 Å²	133.9	76%	0.763	70%	0.695	S	S	*	*			trans	-102.9	36.6	-175.5	0	0	0	0	0	116.3	Y36	Y36-G38 VanDerWaalsContact C-N 3.33Å
39	A	39.5	Very low	45.4	Very low	88 Å²	88	136.1 Å²	136.1	73%	0.727	71%	0.708	S	S	*	*			trans	-138.8	51.6	-169.2	0	0	0	0	0	116
40	V	34.9	Very low	42.8	Very low	126 Å²	126	142.6 Å²	142.6	76%	0.764	73%	0.725	S	S	*	*			trans	-139.9	110.2	159	-174.7	0	0	0	0	110.3
41	M	29.4	Very low	40.4	Very low	189 Å²	189	145.5 Å²	145.5	93%	0.931	74%	0.744	S	S	*	*			trans	-135.7	132.4	156.8	-96.4	-65.7	143.8	0	0	108.5
42	T	29.3	Very low	38.5	Very low	108 Å²	108	144.2 Å²	144.2	66%	0.663	75%	0.752	S	S	*	*			trans	-89	147.3	-162.3	46.8	0	0	0	0	113.2	Q44	T42-Q44 PolarHBondContact O-N 3.16Å
43	N	27.6	Very low	37.1	Very low	165 Å²	165	148.1 Å²	148.1	88%	0.882	78%	0.781	S	S	*	*			trans	-54	123.2	164.3	-77.5	-27.7	0	0	0	110.4
44	Q	27	Very low	34.8	Very low	167 Å²	167	147.9 Å²	147.9	78%	0.78	79%	0.79	S	S	*	*			trans	-120.6	107.5	158.7	-81.3	-168	-22.7	0	0	109.6	T42	T42-Q44 PolarHBondContact O-N 3.16Å
45	T	24.4	Very low	32.9	Very low	136 Å²	136	151 Å²	151	83%	0.834	80%	0.799	S	S	*	*			trans	-66.7	131.8	165.2	46.1	0	0	0	0	110
46	Y	26.5	Very low	31.7	Very low	212 Å²	212	151.9 Å²	151.9	83%	0.831	81%	0.81	S	S	*	*			trans	-121	122.3	161.3	-108.6	-86.7	0	0	0	109.7
47	D	26.9	Very low	30.9	Very low	157 Å²	157	147.4 Å²	147.4	84%	0.84	81%	0.814	S	S	*	*			trans	-78.1	149.8	175.4	-175.3	17	0	0	0	110.7
48	G	26.9	Very low	30	Very low	65 Å²	65	140 Å²	140	67%	0.67	81%	0.812	S	S	*	*			trans	-155.7	15	-158.2	0	0	0	0	0	117.1
49	K	26.5	Very low	29.4	Very low	201 Å²	201	140.3 Å²	140.3	87%	0.874	82%	0.815	S	S	*	*			trans	63.2	114.2	167.8	-60	176.6	178.8	176.9	0	117.7
50	R	26	Very low	29.1	Very low	244 Å²	244	145.7 Å²	145.7	92%	0.921	82%	0.823	S	S	*	*			trans	-101.4	148.4	156.9	-90.6	-177.4	174.7	172.3	0.3	110.6
51	C	27.5	Very low	28.8	Very low	124 Å²	124	149 Å²	149	84%	0.838	83%	0.827	S	S	*	*			trans	178.3	159.2	143.8	-108.3	0	0	0	0	110.5
52	P	37.3	Very low	28.8	Very low	109 Å²	109	146.8 Å²	146.8	71%	0.708	82%	0.818	S	S	*	*				-126.9	168.7	-62.4	33.9	-17.4	0	0	0	112.1
53	P	39.7	Very low	28.7	Very low	132 Å²	132	149.4 Å²	149.4	86%	0.857	83%	0.827	S	S	*	*			trans	-77.4	142.3	172.2	32.4	-33.9	0	0	0	111.6
54	S	27.1	Very low	28.5	Very low	121 Å²	121	144.6 Å²	144.6	85%	0.846	82%	0.816	S	S	*	*			trans	-122.3	138.6	171.6	-173.4	0	0	0	0	111.6
55	K	29.2	Very low	28.5	Very low	183 Å²	183	145.3 Å²	145.3	80%	0.796	82%	0.816	S	S	*	*			trans	-114.6	134.9	170.2	-63.3	175	176.6	177.1	0	108.1
56	N	29.2	Very low	28.5	Very low	151 Å²	151	144.4 Å²	144.4	81%	0.807	81%	0.806	S	S	*	*				163.4	158.3	118.8	-87.4	-16.6	0	0	0	113.9
57	A	29.9	Very low	28.6	Very low	102 Å²	102	139.9 Å²	139.9	84%	0.843	80%	0.796	S	S	*	*			trans	59.5	133.8	151.5	0	0	0	0	0	119.9
58	G	25.3	Very low	28.6	Very low	85 Å²	85	138.7 Å²	138.7	88%	0.876	79%	0.79	S	S	*	*			trans	-96.1	160.4	162.8	0	0	0	0	0	111.8
59	G	27.7	Very low	28.5	Very low	81 Å²	81	141 Å²	141	84%	0.835	80%	0.795	S	S	*	*			trans	-157.5	161.2	176.6	0	0	0	0	0	110.7
60	K	32.4	Very low	28.5	Very low	202 Å²	202	135.1 Å²	135.1	88%	0.878	78%	0.783	S	S	*	*			trans	-110.8	151.8	-176.1	-72	175.6	177.6	170.6	0	112
61	K	30.2	Very low	28.4	Very low	195 Å²	195	128.4 Å²	128.4	85%	0.848	77%	0.774	S	S	*	*			trans	83.1	151.7	142.9	-101.2	-176.9	177.7	-173	0	120.6
62	L	27.5	Very low	28.3	Very low	142 Å²	142	129.7 Å²	129.7	74%	0.743	77%	0.771	S	S	*	*			trans	94.1	85.1	148.2	-73.3	157.4	0	0	0	122.2
63	L	27.4	Very low	27.7	Very low	164 Å²	164	131.2 Å²	131.2	86%	0.859	77%	0.774	S	S	*	*				71.8	141.4	121.1	-116.2	91.6	0	0	0	123.7
64	G	24.7	Very low	26.9	Very low	63 Å²	63	130.5 Å²	130.5	65%	0.649	77%	0.766	S	S	*	*			trans	137	91.2	172.2	0	0	0	0	0	110.3
65	K	26.9	Very low	26.8	Very low	182 Å²	182	136.8 Å²	136.8	79%	0.791	77%	0.772	S	S	*	*				62.2	129.1	78.9	-72	-149.8	159.6	-167.4	0	113.3
66	L	24.9	Very low	26.6	Very low	118 Å²	118	133.4 Å²	133.4	62%	0.618	77%	0.771	S	S	*	*			cis	-158.3	170.4	-0.5	-150.8	68.6	0	0	0	111.9
67	D	27.3	Very low	26.4	Very low	116 Å²	116	130.2 Å²	130.2	62%	0.62	77%	0.766	S	S	*	*			trans	68.8	145.2	157.6	-58.3	-32.8	0	0	0	119.9
68	N	27.1	Very low	26.1	Very low	133 Å²	133	134.2 Å²	134.2	71%	0.711	76%	0.764	S	S	*	*			cis	-168.1	173	-18.6	-100.9	-25.3	0	0	0	107.2
69	C	25.4	Very low	26	Very low	114 Å²	114	137.1 Å²	137.1	77%	0.77	76%	0.755	S	S	*	*			cis	-160.5	174.7	-6	-114.3	0	0	0	0	105.1
70	A	26.3	Very low	25.9	Very low	76 Å²	76	144.7 Å²	144.7	63%	0.628	76%	0.759	S	S	*	*			cis	-158.5	148.9	-14.4	0	0	0	0	0	104.4
71	S	24.5	Very low	25.6	Very low	104 Å²	104	139 Å²	139	73%	0.727	76%	0.757	S	S	*	*				47.5	131	66	77.9	0	0	0	0	113.5
72	L	25	Very low	25.4	Very low	150 Å²	150	135.3 Å²	135.3	79%	0.785	76%	0.756	S	S	*	*			cis	-147.2	-175.3	31.9	-74	156.8	0	0	0	109.9
73	N	24.3	Very low	25.4	Very low	141 Å²	141	134 Å²	134	75%	0.754	76%	0.759	S	S	*	*			cis	-152.8	172.8	7.7	-144.9	-20.5	0	0	0	113.1
74	V	23.6	Very low	25.5	Very low	117 Å²	117	132.3 Å²	132.3	71%	0.709	75%	0.751	S	S	*	*			trans	-94	147.5	176.6	174.7	0	0	0	0	112
75	R	23.7	Very low	26.1	Very low	253 Å²	253	134.8 Å²	134.8	96%	0.955	76%	0.756	S	S	*	*			trans	-136.5	147.6	146.1	-84.6	-165.4	174.2	-179.8	-0.9	110.9
76	S	24.8	Very low	26.1	Very low	112 Å²	112	136.7 Å²	136.7	78%	0.783	76%	0.758	S	S	*	*			trans	-138.8	164.4	177.1	57.2	0	0	0	0	110.4
77	A	24.9	Very low	26.3	Very low	84 Å²	84	138.8 Å²	138.8	69%	0.694	77%	0.77	S	S	*	*			trans	120.6	149.4	145	0	0	0	0	0	118.4
78	F	23.7	Very low	26.4	Very low	186 Å²	186	141.9 Å²	141.9	82%	0.816	78%	0.78	S	S	*	*			trans	79.4	115.7	163.8	-81.3	-76.8	0	0	0	123.6
79	Q	24.6	Very low	26.5	Very low	147 Å²	147	141.5 Å²	141.5	69%	0.687	79%	0.788	S	S	*	*			trans	-32.2	149.1	156.9	-51.1	163.7	-16.3	0	0	116.6
80	R	25.6	Very low	26.7	Very low	239 Å²	239	146.2 Å²	146.2	90%	0.902	80%	0.796	S	S	*	*				172.4	169.6	97.2	-90.5	-176.7	-173.6	-173.1	2.2	110.3
81	G	24.4	Very low	26.8	Very low	83 Å²	83	147.7 Å²	147.7	86%	0.856	81%	0.808	S	S	*	*			trans	120.3	106.3	160.5	0	0	0	0	0	114.8
82	S	26	Very low	27	Very low	117 Å²	117	152.4 Å²	152.4	82%	0.818	82%	0.818	S	S	*	*			trans	-116.9	132.6	169.8	55.4	0	0	0	0	110.1
83	S	28.7	Very low	27.1	Very low	116 Å²	116	149 Å²	149	81%	0.811	82%	0.819	S	S	*	*			trans	-163.9	129.2	149.4	39.9	0	0	0	0	111.9
84	D	29.7	Very low	27.5	Very low	127 Å²	127	148 Å²	148	68%	0.679	82%	0.823	S	S	*	*			trans	-75.7	151.1	153.6	-165.5	26.6	0	0	0	107.2
85	P	35.8	Very low	28.4	Very low	116 Å²	116	148.9 Å²	148.9	75%	0.753	83%	0.831	S	S	*	*				-138	141.9	123.2	36.3	-25.9	0	0	0	114
86	R	28	Very low	28.7	Very low	221 Å²	221	140.4 Å²	140.4	83%	0.834	82%	0.823	S	S	*	*			trans	-73	150.3	160.4	-50.3	169.7	-167.1	169.2	1.8	109.1
87	D	28.7	Very low	29.6	Very low	163 Å²	163	139.8 Å²	139.8	87%	0.872	82%	0.824	S	S	*	*			trans	-139.5	157.5	152.6	-157.5	0.4	0	0	0	110.6
88	Q	29.1	Very low	30.3	Very low	180 Å²	180	145.2 Å²	145.2	84%	0.841	84%	0.835	S	S	*	*			trans	-120	135.5	-178.3	-63.4	-175.8	8.9	0	0	110.7
89	S	29.1	Very low	31	Very low	126 Å²	126	139.1 Å²	139.1	88%	0.881	82%	0.824	S	S	*	*			trans	-143.6	134.3	156.4	47.9	0	0	0	0	111.4
90	K	30.2	Very low	32.1	Very low	213 Å²	213	137.1 Å²	137.1	93%	0.926	82%	0.822	S	S	*	*			trans	-97.3	138	163.7	-72.2	177.3	177.3	175	0	107.9
91	A	27.6	Very low	33.1	Very low	106 Å²	106	131 Å²	131	88%	0.876	81%	0.807	S	S	*	*			trans	-145.6	143.8	157.2	0	0	0	0	0	109.5
92	Q	29.2	Very low	34.3	Very low	204 Å²	204	130.6 Å²	130.6	95%	0.953	80%	0.796	S	S	*	*			trans	-99.7	162.5	171	-63.3	165.1	-73.2	0	0	108.9
93	G	28.3	Very low	35.4	Very low	77 Å²	77	131 Å²	131	79%	0.794	79%	0.789	S	S	*	*			trans	127.1	99.1	160.3	0	0	0	0	0	116
94	S	31.3	Very low	36.5	Very low	122 Å²	122	128.8 Å²	128.8	85%	0.853	77%	0.768	S	S	*	*			trans	-75.4	149.4	138	-62.8	0	0	0	0	107.4
95	P	44	Very low	37.6	Very low	135 Å²	135	131.1 Å²	131.1	88%	0.877	77%	0.772	S	S	*	*			cis	-141	175.6	49.9	40.8	-23.3	0	0	0	116.1
96	G	29.1	Very low	38.8	Very low	75 Å²	75	133 Å²	133	77%	0.773	78%	0.776	S	S	*	*			trans	151.2	120.5	168.1	0	0	0	0	0	113.1	H98	G96-H98 PolarHBondContact O-N 3.4Å
97	A	44.6	Very low	40.7	Very low	99 Å²	99	126.1 Å²	126.1	82%	0.818	75%	0.754	S	S	*	*			trans	-97.9	85.7	-174	0	0	0	0	0	113.2
98	H	39.7	Very low	43.1	Very low	198 Å²	198	121.4 Å²	121.4	92%	0.917	73%	0.734	S	S	*	*			trans	-142.9	94.8	163.7	-80.2	-61.5	0	0	0	110.8	G96	G96-H98 PolarHBondContact O-N 3.4Å
99	G	37.6	Very low	45.4	Very low	57 Å²	57	117.3 Å²	117.3	59%	0.588	72%	0.721	S	S	*	*			trans	-155.8	11.2	-173.5	0	0	0	0	0	117
100	T	47.4	Very low	47.6	Very low	106 Å²	106	111.6 Å²	111.6	65%	0.65	68%	0.681	S	S	*	*	S	Bend	trans	-84.4	-45	-173.6	40.6	0	0	0	0	113.9	A102	T100-A102 PolarHBondContact O-N 3.17Å
101	D	47.4	Very low	50	Low	109 Å²	109	105.5 Å²	105.5	58%	0.583	66%	0.656	S	S	*	*	H	α-helix	trans	-71.2	-28.6	-170.5	-78.5	-43.7	0	0	0	115.1	N103 L104 K105	D101-N103 VanDerWaalsContact C-N 3.34Å; D101-N103 PolarHBondContact O-N 3.11Å; D101-L104 PolarHBondContact O-N 2.7Å; D101-K105 PolarHBondContact O-N 2.83Å
102	A	48	Very low	52.5	Low	75 Å²	75	105.2 Å²	105.2	62%	0.62	64%	0.635	S	S	*	*	H	α-helix	trans	-63.2	-39.8	-179.4	0	0	0	0	0	112.1	T100	T100-A102 PolarHBondContact O-N 3.17Å
103	N	50.5	Low	55.2	Low	127 Å²	127	102.9 Å²	102.9	68%	0.679	62%	0.619	S	S	*	*	H	α-helix	trans	-70.1	-33.9	177.9	-96.1	-45.1	0	0	0	112.7	D101 K105 M107	D101-N103 VanDerWaalsContact C-N 3.34Å; D101-N103 PolarHBondContact O-N 3.11Å; N103-K105 VanDerWaalsContact C-N 3.31Å; N103-K105 PolarHBondContact O-N 2.75Å; N103-M107 WeakPolarHBondContact O-CG 3.5Å
104	L	50.8	Low	58.2	Low	69 Å²	69	99.3 Å²	99.3	36%	0.361	58%	0.582	S	S	.	*	H	α-helix	trans	-69	-26.4	-177.9	-74.4	168	0	0	0	113.5	D101 N106 M107	D101-L104 PolarHBondContact O-N 2.7Å; L104-N106 VanDerWaalsContact C-N 3.35Å; L104-N106 PolarHBondContact O-N 3.36Å; L104-M107 HydrophobicContact CD2-SD 3.94Å; L104-M107 PolarHBondContact O-N 2.9Å
105	K	54.1	Low	61.2	Low	175 Å²	175	98.3 Å²	98.3	76%	0.761	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-26.9	-176.7	-72.6	177.7	-178.7	-179.7	0	114.1	D101 N103	D101-K105 PolarHBondContact O-N 2.83Å; N103-K105 VanDerWaalsContact C-N 3.31Å; N103-K105 PolarHBondContact O-N 2.75Å
106	N	59.4	Low	63.7	Low	156 Å²	156	96.3 Å²	96.3	83%	0.834	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	7.1	-179.3	-73	-18.7	0	0	0	113.9	L104	L104-N106 VanDerWaalsContact C-N 3.35Å; L104-N106 PolarHBondContact O-N 3.36Å
107	M	69.4	Low	66.9	Low	76 Å²	76	95.4 Å²	95.4	37%	0.374	52%	0.519	S	S	.	.	S	Bend	trans	-87.9	126	179.4	-70.8	172.2	68.6	0	0	111.4	N103 L104 Q111	N103-M107 WeakPolarHBondContact O-CG 3.5Å; L104-M107 HydrophobicContact CD2-SD 3.94Å; L104-M107 PolarHBondContact O-N 2.9Å; M107-Q111 HydrophobicContact CB-CB 4.49Å; M107-Q111 HydrophobicContact CE-CB 4.33Å; M107-Q111 HydrophobicContact CE-CG 3.62Å
108	S	78.3	Confident	69.5	Low	64 Å²	64	92.7 Å²	92.7	45%	0.448	49%	0.491	S	S	.	.			trans	-56.2	145.8	173.3	62	0	0	0	0	111.6	A110 Q111 K112	S108-A110 VanDerWaalsContact C-N 3.28Å; S108-A110 PolarHBondContact O-N 3.35Å; S108-A110 VanDerWaalsContact O-N 3.12Å; S108-Q111 WeakPolarHBondContact O-CA 3.46Å; S108-Q111 VanDerWaalsContact O-CB 3.25Å; S108-Q111 WeakPolarHBondContact O-CB 3.37Å; S108-Q111 PolarHBondContact O-N 3.48Å; S108-K112 PolarHBondContact O-N 3.44Å
109	V	78.3	Confident	72.2	Confident	94 Å²	94	83.4 Å²	83.4	57%	0.57	45%	0.448	S	S	*	.	H	α-helix	trans	-46.6	-47.7	-177.4	-175.5	0	0	0	0	113	Q111 K112 Y113 L173	V109-Q111 PolarHBondContact O-N 2.63Å; V109-K112 PolarHBondContact O-N 3.04Å; V109-Y113 HydrophobicContact CG1-CD2 3.93Å; V109-Y113 PolarHBondContact O-N 3.48Å; V109-L173 HydrophobicContact CG1-CD1 4.22Å
110	A	75.2	Confident	74.9	Confident	6 Å²	6	84.7 Å²	84.7	5%	0.05	44%	0.441	C	S	.	.	H	α-helix	trans	-61.1	-26.9	177.5	0	0	0	0	0	114.2	S108 G114 R171 L173	S108-A110 VanDerWaalsContact C-N 3.28Å; S108-A110 PolarHBondContact O-N 3.35Å; S108-A110 VanDerWaalsContact O-N 3.12Å; A110-G114 WeakPolarHBondContact O-CA 3.48Å; A110-G114 PolarHBondContact O-N 3.22Å; A110-R171 WeakPolarHBondContact O-CB 3.39Å; A110-L173 HydrophobicContact CB-CD2 4.5Å; A110-L173 HydrophobicContact CB-CG 4.08Å
111	Q	79.2	Confident	77.3	Confident	85 Å²	85	79.7 Å²	79.7	40%	0.397	41%	0.411	S	S	.	.	H	α-helix	trans	-78.7	-28.6	175.7	-166.1	73.7	2	0	0	112.3	M107 S108 V109 R171	M107-Q111 HydrophobicContact CB-CB 4.49Å; M107-Q111 HydrophobicContact CE-CB 4.33Å; M107-Q111 HydrophobicContact CE-CG 3.62Å; S108-Q111 WeakPolarHBondContact O-CA 3.46Å; S108-Q111 VanDerWaalsContact O-CB 3.25Å; S108-Q111 WeakPolarHBondContact O-CB 3.37Å; S108-Q111 PolarHBondContact O-N 3.48Å; V109-Q111 PolarHBondContact O-N 2.63Å; Q111-R171 WeakPolarHBondContact O-CD 3.37Å
112	K	80.7	Confident	79.8	Confident	101 Å²	101	74.5 Å²	74.5	44%	0.439	38%	0.383	S	S	.	.	H	α-helix	trans	-87.9	-37.8	-179.4	-171.8	176.5	176.7	-162.2	0	112.9	S108 V109	S108-K112 PolarHBondContact O-N 3.44Å; V109-K112 PolarHBondContact O-N 3.04Å
113	Y	86.4	Confident	82.2	Confident	154 Å²	154	70.9 Å²	70.9	60%	0.604	35%	0.353	S	S	*	.	H	α-helix	trans	-121.6	-15.8	-173.8	-57.4	-77.4	0	0	0	114.7	V109	V109-Y113 HydrophobicContact CG1-CD2 3.93Å; V109-Y113 PolarHBondContact O-N 3.48Å
114	G	90.4	Very high	84.5	Confident	2 Å²	2	64.9 Å²	64.9	2%	0.021	32%	0.321	C	S	.	.			trans	-82.2	160.5	-178.3	0	0	0	0	0	113.6	A110 R171 T172	A110-G114 WeakPolarHBondContact O-CA 3.48Å; A110-G114 PolarHBondContact O-N 3.22Å; G114-R171 WeakPolarHBondContact O-CB 3.37Å; G114-R171 WeakPolarHBondContact O-CD 3.41Å; G114-R171 WeakPolarHBondContact O-CG 3.34Å; G114-R171 PolarHBondContact O-NH1 3.41Å; G114-T172 CarbonylContact C-O 3.58Å; G114-T172 WeakPolarHBondContact CA-O 3.42Å
115	N	94.5	Very high	86.8	Confident	101 Å²	101	61.6 Å²	61.6	54%	0.54	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	158.3	-178.5	-74.6	-44.2	0	0	0	112.5	R171 T172	N115-R171 WeakPolarHBondContact O-CA 3.47Å; N115-R171 PolarHBondContact OD1-NH1 3.2Å; N115-T172 PolarHBondContact N-O 2.88Å; N115-T172 PolarHBondContact O-N 3.14Å; N115-T172 PolarHBondContact O-OG1 3.15Å
116	K	96.9	Very high	88.9	Confident	94 Å²	94	53.2 Å²	53.2	41%	0.409	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	114.9	174.7	-68.4	-167.6	173.6	-176.8	0	109.3	R166 G167 M169 R171	K116-R166 WeakPolarHBondContact O-CD 3.22Å; K116-R166 WeakPolarHBondContact O-CG 3.36Å; K116-G167 PolarHBondContact NZ-O 3.24Å; K116-M169 WeakPolarHBondContact CD-O 3.4Å; K116-M169 WeakPolarHBondContact CE-O 3.31Å; K116-M169 WeakPolarHBondContact CG-O 3.36Å; K116-R171 HydrophobicContact CG-CG 3.96Å
117	K	96	Very high	90.8	Very high	55 Å²	55	49.3 Å²	49.3	24%	0.239	24%	0.243	C	C	.	.			trans	-108.7	162.1	179.9	-62.4	-179.9	-177.7	176.9	0	110.1	M169 L173 D174	K117-M169 VanDerWaalsContact O-CB 3.31Å; K117-M169 WeakPolarHBondContact O-CB 3.31Å; K117-M169 VanDerWaalsContact O-CG 3.31Å; K117-M169 WeakPolarHBondContact O-CG 3.39Å; K117-L173 PolarHBondContact NZ-O 2.92Å; K117-D174 IonicContact NZ-OD1 2.67Å; K117-D174 PolarHBondContact NZ-OD1 2.91Å
118	L	97.9	Very high	92.1	Very high	43 Å²	43	47.5 Å²	47.5	23%	0.225	23%	0.233	C	C	.	.			trans	-70.9	149	164.9	-69.9	170.2	0	0	0	109	N120 L162 Y165 R166 M198	L118-N120 PolarHBondContact O-N 2.97Å; L118-L162 HydrophobicContact CD1-CD2 4.49Å; L118-L162 HydrophobicContact CD2-CD2 4.27Å; L118-Y165 HydrophobicContact CD2-CD1 3.72Å; L118-Y165 HydrophobicContact CD2-CE1 4.33Å; L118-R166 HydrophobicContact CD2-CB 3.83Å; L118-R166 HydrophobicContact CD2-CG 4.27Å; L118-R166 HydrophobicContact CG-CB 4.35Å; L118-R166 HydrophobicContact CG-CG 4.27Å; L118-M198 HydrophobicContact CB-SD 4.09Å; L118-M198 HydrophobicContact CD1-CG 3.93Å; L118-M198 HydrophobicContact CD1-SD 4.12Å; L118-M198 HydrophobicContact CD2-SD 4Å; L118-M198 HydrophobicContact CG-SD 4.29Å
119	P	97.6	Very high	93.1	Very high	3 Å²	3	44.7 Å²	44.7	2%	0.019	21%	0.214	C	C	.	.			trans	-67.3	126.7	-177.9	26.1	-33.3	0	0	0	111.9	A121 L122 Y165 M169 T178 E180 M198	P119-A121 VanDerWaalsContact C-N 3.27Å; P119-L122 HydrophobicContact CB-CD2 3.87Å; P119-L122 HydrophobicContact CG-CD2 3.59Å; P119-Y165 HydrophobicContact CG-CE1 3.8Å; P119-Y165 WeakPolarHBondContact CG-OH 3.5Å; P119-M169 HydrophobicContact CG-CE 4.09Å; P119-M169 HydrophobicContact CG-SD 4.49Å; P119-T178 CarbonylContact C-O 3.36Å; P119-T178 VanDerWaalsContact CA-O 3.26Å; P119-T178 WeakPolarHBondContact CA-O 2.8Å; P119-T178 HydrophobicContact CB-CG2 4.23Å; P119-T178 WeakPolarHBondContact CB-O 3.49Å; P119-E180 HydrophobicContact CG-CG 4.43Å; P119-M198 HydrophobicContact CG-CE 4.39Å
120	N	94.1	Very high	94	Very high	83 Å²	83	41.3 Å²	41.3	44%	0.444	20%	0.198	S	C	.	.	S	Bend	trans	-74.3	-22.5	176	-44.7	90.4	0	0	0	111.7	L118 I177 T178 K203	L118-N120 PolarHBondContact O-N 2.97Å; N120-I177 HydrophobicContact CB-CG2 4.35Å; N120-T178 PolarHBondContact N-O 3.44Å; N120-T178 PolarHBondContact OD1-N 2.87Å; N120-T178 VanDerWaalsContact OD1-N 3.1Å; N120-K203 PolarHBondContact O-N 2.96Å
121	A	98.4	Very high	95.1	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.008	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	150.4	176.6	0	0	0	0	0	113.1	P119 L179 K203 L296	P119-A121 VanDerWaalsContact C-N 3.27Å; A121-L179 HydrophobicContact CB-CD2 3.59Å; A121-L179 WeakPolarHBondContact O-CD2 3.46Å; A121-K203 CarbonylContact C-O 3.53Å; A121-K203 WeakPolarHBondContact CA-O 3.38Å; A121-K203 HydrophobicContact CB-CB 3.81Å; A121-K203 VanDerWaalsContact CB-O 3.31Å; A121-K203 WeakPolarHBondContact CB-O 3.29Å; A121-L296 HydrophobicContact CB-CD2 3.53Å
122	L	98.9	Very high	95.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	130	-170.8	-59.6	176.5	0	0	0	111.4	P119 V124 F154 E180 I195 T202 K203 L204 I205	P119-L122 HydrophobicContact CB-CD2 3.87Å; P119-L122 HydrophobicContact CG-CD2 3.59Å; L122-V124 HydrophobicContact CB-CG1 3.62Å; L122-V124 HydrophobicContact CD1-CG1 4.37Å; L122-V124 PolarHBondContact O-N 2.77Å; L122-F154 HydrophobicContact CD1-CE2 4.09Å; L122-E180 HydrophobicContact CD2-CG 3.39Å; L122-I195 HydrophobicContact CD1-CB 4.38Å; L122-I195 HydrophobicContact CD1-CD1 3.73Å; L122-I195 HydrophobicContact CD1-CG1 3.86Å; L122-I195 HydrophobicContact CD1-CG2 3.51Å; L122-T202 HydrophobicContact CD1-CG2 3.9Å; L122-T202 HydrophobicContact CG-CG2 3.9Å; L122-K203 PolarHBondContact N-O 2.97Å; L122-L204 HydrophobicContact CB-CD2 4.23Å; L122-L204 HydrophobicContact CD1-CD2 4.31Å; L122-I205 PolarHBondContact O-N 3.12Å
123	I	98.9	Very high	96.7	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	86.6	167.2	-50.5	178.1	0	0	0	108.6	T131 V134 L135 E180 K181 T182 I205 V207	I123-T131 HydrophobicContact CG2-CG2 3.77Å; I123-V134 HydrophobicContact CD1-CB 4.21Å; I123-V134 HydrophobicContact CD1-CG1 3.9Å; I123-L135 HydrophobicContact CD1-CB 4.08Å; I123-L135 HydrophobicContact CD1-CD1 4.04Å; I123-E180 PolarHBondContact N-O 3.11Å; I123-K181 HydrophobicContact CB-CB 3.87Å; I123-K181 HydrophobicContact CB-CG 3.79Å; I123-K181 HydrophobicContact CD1-CB 4.4Å; I123-K181 HydrophobicContact CD1-CG 4.48Å; I123-K181 HydrophobicContact CG1-CB 4.49Å; I123-K181 HydrophobicContact CG2-CG 3.92Å; I123-K181 WeakPolarHBondContact O-CA 3.36Å; I123-T182 PolarHBondContact O-N 2.94Å; I123-T182 VanDerWaalsContact O-N 3.17Å; I123-I205 CarbonylContact C-O 3.59Å; I123-I205 WeakPolarHBondContact CA-O 3.34Å; I123-I205 HydrophobicContact CB-CB 4.48Å; I123-I205 HydrophobicContact CG1-CB 4.1Å; I123-I205 HydrophobicContact CG1-CD1 4.3Å; I123-I205 HydrophobicContact CG1-CG2 4.32Å; I123-I205 HydrophobicContact CG2-CG2 4.3Å; I123-V207 HydrophobicContact CG2-CG2 4.08Å
124	V	98.9	Very high	97.3	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	-19.3	-168.5	-57.7	0	0	0	0	114.4	L122 P183 Y185 F186 I195 L204 I205 V206 W264	L122-V124 HydrophobicContact CB-CG1 3.62Å; L122-V124 HydrophobicContact CD1-CG1 4.37Å; L122-V124 PolarHBondContact O-N 2.77Å; V124-P183 CarbonylContact O-C 3.59Å; V124-P183 WeakPolarHBondContact O-CA 3.33Å; V124-Y185 HydrophobicContact CG1-CD2 4.24Å; V124-F186 HydrophobicContact CG2-CD2 4.33Å; V124-F186 WeakPolarHBondContact O-CB 3.31Å; V124-F186 PolarHBondContact O-N 2.85Å; V124-I195 HydrophobicContact CG1-CD1 4.43Å; V124-L204 HydrophobicContact CG1-CD2 3.95Å; V124-I205 PolarHBondContact N-O 2.81Å; V124-V206 HydrophobicContact CG2-CG2 3.88Å; V124-W264 HydrophobicContact CB-CH2 3.87Å; V124-W264 HydrophobicContact CB-CZ2 4.03Å; V124-W264 HydrophobicContact CG1-CH2 3.73Å; V124-W264 HydrophobicContact CG1-CZ2 4.4Å; V124-W264 HydrophobicContact CG1-CZ3 4.28Å; V124-W264 HydrophobicContact CG2-CH2 4.05Å; V124-W264 HydrophobicContact CG2-CZ2 4.01Å
125	G	98.6	Very high	97.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.6	178.7	-174.8	0	0	0	0	0	114.1	T131 V206 V207	G125-T131 VanDerWaalsContact C-CG2 3.42Å; G125-T131 WeakPolarHBondContact O-CG2 3.45Å; G125-V206 CarbonylContact O-C 3.05Å; G125-V206 WeakPolarHBondContact O-CA 3.44Å; G125-V207 PolarHBondContact O-N 3.13Å
126	V	98.7	Very high	97.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.126	C	C	.	.			cis	-98.1	156.7	-10.7	-49.3	0	0	0	0	111.1	K128 G129 F186 V206 V207 V208 R214 Y257	V126-K128 PolarHBondContact O-N 3.23Å; V126-G129 PolarHBondContact O-N 3.07Å; V126-F186 HydrophobicContact CG1-CD1 3.66Å; V126-F186 HydrophobicContact CG1-CE1 3.83Å; V126-F186 HydrophobicContact CG1-CG 4.23Å; V126-V206 HydrophobicContact CG1-CG1 3.79Å; V126-V207 WeakPolarHBondContact CG2-O 3.34Å; V126-V207 PolarHBondContact N-O 3.3Å; V126-V208 HydrophobicContact CG1-CG1 4.29Å; V126-R214 HydrophobicContact CG2-CG 4.28Å; V126-Y257 HydrophobicContact CB-CE1 4.17Å; V126-Y257 HydrophobicContact CG1-CD1 3.99Å; V126-Y257 HydrophobicContact CG1-CE1 3.78Å; V126-Y257 HydrophobicContact CG2-CE1 3.84Å
127	K	98.6	Very high	97.7	Very high	74 Å²	74	20.8 Å²	20.8	32%	0.322	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	124.1	169.1	-171.2	-170	173.8	-144.5	0	109	G129 P183 R214 D218 I254	K127-G129 VanDerWaalsContact C-N 3.33Å; K127-G129 PolarHBondContact O-N 3.44Å; K127-P183 HydrophobicContact CB-CB 4.49Å; K127-P183 PolarHBondContact N-O 2.81Å; K127-R214 PolarHBondContact O-NH1 2.97Å; K127-D218 WeakPolarHBondContact CD-OD2 3.41Å; K127-D218 WeakPolarHBondContact CE-OD1 3.35Å; K127-D218 WeakPolarHBondContact CE-OD2 3.25Å; K127-D218 IonicContact NZ-OD1 3.57Å; K127-D218 PolarHBondContact NZ-OD1 3.09Å; K127-D218 IonicContact NZ-OD2 2.65Å; K127-D218 PolarHBondContact NZ-OD2 3.03Å; K127-I254 HydrophobicContact CB-CD1 4.41Å; K127-I254 HydrophobicContact CB-CG2 4.41Å; K127-I254 HydrophobicContact CD-CD1 3.71Å
128	K	98	Very high	97.8	Very high	37 Å²	37	18.2 Å²	18.2	16%	0.161	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	-8	-174.1	-47.4	-58.2	-50.7	-143.1	0	118.1	V126 G130 R214 S217 D218 Q221	V126-K128 PolarHBondContact O-N 3.23Å; K128-G130 PolarHBondContact O-N 3.44Å; K128-R214 HydrophobicContact CB-CG 4.15Å; K128-S217 WeakPolarHBondContact CE-O 3.34Å; K128-S217 VanDerWaalsContact CE-OG 3.29Å; K128-S217 WeakPolarHBondContact CE-OG 3.39Å; K128-S217 PolarHBondContact NZ-O 3.21Å; K128-S217 PolarHBondContact NZ-OG 2.98Å; K128-D218 HydrophobicContact CD-CB 4.34Å; K128-D218 HydrophobicContact CG-CB 3.7Å; K128-Q221 VanDerWaalsContact NZ-CB 3.34Å
129	G	97.8	Very high	97.7	Very high	5 Å²	5	21.3 Å²	21.3	5%	0.052	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-38.7	-174.8	0	0	0	0	0	114.7	V126 K127 V207	V126-G129 PolarHBondContact O-N 3.07Å; K127-G129 VanDerWaalsContact C-N 3.33Å; K127-G129 PolarHBondContact O-N 3.44Å; G129-V207 WeakPolarHBondContact CA-O 3.4Å
130	G	97.5	Very high	97.5	Very high	23 Å²	23	24 Å²	24	24%	0.237	12%	0.119	C	C	.	.	S	Bend	trans	154.7	-10.1	178.8	0	0	0	0	0	114.7	K128 R132 A133	K128-G130 PolarHBondContact O-N 3.44Å; G130-R132 VanDerWaalsContact C-N 3.27Å; G130-R132 PolarHBondContact O-N 3.15Å; G130-A133 WeakPolarHBondContact O-CB 3.34Å; G130-A133 PolarHBondContact O-N 2.98Å
131	T	98.2	Very high	97.6	Very high	11 Å²	11	20.2 Å²	20.2	7%	0.067	10%	0.098	C	C	.	.	H	α-helix	trans	-29.3	-43.5	-177.2	59.4	0	0	0	0	118.4	I123 G125 L135 K181 P183 V207	I123-T131 HydrophobicContact CG2-CG2 3.77Å; G125-T131 VanDerWaalsContact C-CG2 3.42Å; G125-T131 WeakPolarHBondContact O-CG2 3.45Å; T131-L135 PolarHBondContact O-N 3.46Å; T131-K181 VanDerWaalsContact C-CD 3.47Å; T131-K181 WeakPolarHBondContact O-CD 3.28Å; T131-P183 HydrophobicContact CG2-CB 4.2Å; T131-P183 HydrophobicContact CG2-CG 4.1Å; T131-P183 WeakPolarHBondContact OG1-CG 3.22Å; T131-V207 HydrophobicContact CG2-CB 3.99Å; T131-V207 HydrophobicContact CG2-CG2 4Å
132	R	97.3	Very high	97.5	Very high	41 Å²	41	23.7 Å²	23.7	16%	0.155	12%	0.121	C	C	.	.	H	α-helix	trans	-68.3	-34.6	177.5	178.8	59.2	66.7	171	-0.7	112.7	G130 E136 G148 E150 L330	G130-R132 VanDerWaalsContact C-N 3.27Å; G130-R132 PolarHBondContact O-N 3.15Å; R132-E136 WeakPolarHBondContact CD-OE1 3.38Å; R132-E136 HydrophobicContact CG-CG 4.44Å; R132-E136 IonicContact CZ-OE1 3.31Å; R132-E136 IonicContact NE-OE1 3.3Å; R132-E136 IonicContact NH1-OE1 3.14Å; R132-E136 PolarHBondContact NH1-OE1 2.56Å; R132-E136 WeakPolarHBondContact O-CG 3.34Å; R132-E136 PolarHBondContact O-N 3.23Å; R132-G148 VanDerWaalsContact CZ-O 3.3Å; R132-G148 PolarHBondContact NH1-O 2.93Å; R132-G148 PolarHBondContact NH2-O 3.45Å; R132-E150 IonicContact NH2-OE1 3.64Å; R132-E150 PolarHBondContact NH2-OE1 3.07Å; R132-L330 HydrophobicContact CG-CD2 4.34Å
133	A	97	Very high	97.4	Very high	14 Å²	14	25.9 Å²	25.9	12%	0.116	13%	0.133	C	C	.	.	H	α-helix	trans	-63.2	-53.8	173.9	0	0	0	0	0	110.4	G130 L135 E136 F137 L281 L330	G130-A133 WeakPolarHBondContact O-CB 3.34Å; G130-A133 PolarHBondContact O-N 2.98Å; A133-L135 VanDerWaalsContact C-N 3.26Å; A133-L135 PolarHBondContact O-N 2.86Å; A133-E136 PolarHBondContact O-N 3.25Å; A133-E136 VanDerWaalsContact O-N 3.12Å; A133-F137 HydrophobicContact CB-CD2 4.5Å; A133-F137 HydrophobicContact CB-CE1 4.39Å; A133-F137 HydrophobicContact CB-CE2 4.04Å; A133-F137 HydrophobicContact CB-CZ 3.99Å; A133-F137 WeakPolarHBondContact O-CB 3.5Å; A133-F137 WeakPolarHBondContact O-CD1 3.34Å; A133-F137 WeakPolarHBondContact O-CG 3.43Å; A133-F137 PolarHBondContact O-N 2.75Å; A133-L281 HydrophobicContact CB-CD2 3.9Å; A133-L330 HydrophobicContact CB-CD1 3.92Å
134	V	98.3	Very high	97.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-52.2	-45.6	175.8	-178.2	0	0	0	0	111.4	I123 F137 I138 V207 V276 L281 M289 V292	I123-V134 HydrophobicContact CD1-CB 4.21Å; I123-V134 HydrophobicContact CD1-CG1 3.9Å; V134-F137 PolarHBondContact O-N 2.66Å; V134-I138 WeakPolarHBondContact O-CB 3.42Å; V134-I138 VanDerWaalsContact O-CG2 3.25Å; V134-I138 WeakPolarHBondContact O-CG2 3.27Å; V134-I138 PolarHBondContact O-N 3.11Å; V134-V207 HydrophobicContact CB-CG2 4.19Å; V134-V207 HydrophobicContact CG2-CG1 4.18Å; V134-V207 HydrophobicContact CG2-CG2 3.53Å; V134-V276 HydrophobicContact CG2-CG1 4Å; V134-L281 HydrophobicContact CG2-CD1 4.13Å; V134-L281 HydrophobicContact CG2-CD2 3.4Å; V134-L281 HydrophobicContact CG2-CG 4.43Å; V134-M289 HydrophobicContact CG1-CE 4.28Å; V134-M289 HydrophobicContact CG1-SD 4.17Å; V134-V292 HydrophobicContact CG1-CG1 4.43Å; V134-V292 HydrophobicContact CG1-CG2 4.43Å
135	L	98.1	Very high	97.3	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.1	-47.8	178	-169.8	73.4	0	0	0	113.1	I123 T131 A133 F137 R139 A146 K181	I123-L135 HydrophobicContact CD1-CB 4.08Å; I123-L135 HydrophobicContact CD1-CD1 4.04Å; T131-L135 PolarHBondContact O-N 3.46Å; A133-L135 VanDerWaalsContact C-N 3.26Å; A133-L135 PolarHBondContact O-N 2.86Å; L135-F137 VanDerWaalsContact C-N 3.29Å; L135-F137 PolarHBondContact O-N 2.99Å; L135-R139 WeakPolarHBondContact O-CB 3.38Å; L135-R139 VanDerWaalsContact O-CD 3.23Å; L135-R139 WeakPolarHBondContact O-CD 3.48Å; L135-R139 WeakPolarHBondContact O-CG 3.22Å; L135-R139 PolarHBondContact O-N 3.02Å; L135-A146 HydrophobicContact CD1-CB 3.71Å; L135-A146 HydrophobicContact CG-CB 4.47Å; L135-K181 HydrophobicContact CB-CD 4.07Å; L135-K181 HydrophobicContact CD1-CB 4.09Å; L135-K181 HydrophobicContact CD2-CB 3.95Å; L135-K181 HydrophobicContact CD2-CD 4.02Å; L135-K181 HydrophobicContact CG-CB 4.43Å
136	E	96.4	Very high	97.2	Very high	43 Å²	43	30 Å²	30	20%	0.201	15%	0.151	C	C	.	.	H	α-helix	trans	-71.3	-26.7	178.8	-57.8	-40.8	144.1	0	0	112.6	R132 A133 R139 L330	R132-E136 WeakPolarHBondContact CD-OE1 3.38Å; R132-E136 HydrophobicContact CG-CG 4.44Å; R132-E136 IonicContact CZ-OE1 3.31Å; R132-E136 IonicContact NE-OE1 3.3Å; R132-E136 IonicContact NH1-OE1 3.14Å; R132-E136 PolarHBondContact NH1-OE1 2.56Å; R132-E136 WeakPolarHBondContact O-CG 3.34Å; R132-E136 PolarHBondContact O-N 3.23Å; A133-E136 PolarHBondContact O-N 3.25Å; A133-E136 VanDerWaalsContact O-N 3.12Å; E136-R139 IonicContact OE1-NH1 2.64Å; E136-R139 IonicContact OE2-CZ 3.73Å; E136-R139 IonicContact OE2-NH1 2.68Å; E136-R139 PolarHBondContact OE2-NH1 2.77Å; E136-L330 HydrophobicContact CB-CD2 4.25Å; E136-L330 HydrophobicContact CG-CD2 3.81Å
137	F	97.1	Very high	97.1	Very high	4 Å²	4	30.9 Å²	30.9	2%	0.018	16%	0.156	C	C	.	.	H	α-helix	trans	-75.6	-48.7	178.2	-63.1	-3.4	0	0	0	111.1	A133 V134 L135 R139 I140 L281 P285 M289 I302 F307 P316 L318	A133-F137 HydrophobicContact CB-CD2 4.5Å; A133-F137 HydrophobicContact CB-CE1 4.39Å; A133-F137 HydrophobicContact CB-CE2 4.04Å; A133-F137 HydrophobicContact CB-CZ 3.99Å; A133-F137 WeakPolarHBondContact O-CB 3.5Å; A133-F137 WeakPolarHBondContact O-CD1 3.34Å; A133-F137 WeakPolarHBondContact O-CG 3.43Å; A133-F137 PolarHBondContact O-N 2.75Å; V134-F137 PolarHBondContact O-N 2.66Å; L135-F137 VanDerWaalsContact C-N 3.29Å; L135-F137 PolarHBondContact O-N 2.99Å; F137-R139 PolarHBondContact O-N 3.46Å; F137-I140 WeakPolarHBondContact O-CB 3.38Å; F137-I140 PolarHBondContact O-N 2.92Å; F137-I140 VanDerWaalsContact O-N 3.12Å; F137-L281 HydrophobicContact CD2-CD1 3.96Å; F137-L281 HydrophobicContact CE2-CD1 4Å; F137-L281 HydrophobicContact CE2-CG 4.3Å; F137-P285 HydrophobicContact CE2-CB 4.02Å; F137-M289 HydrophobicContact CB-CE 4.25Å; F137-M289 HydrophobicContact CB-CG 3.99Å; F137-M289 HydrophobicContact CB-SD 3.87Å; F137-M289 HydrophobicContact CD2-CG 4.08Å; F137-M289 HydrophobicContact CD2-SD 4.19Å; F137-I302 VanDerWaalsContact O-CD1 3.29Å; F137-I302 WeakPolarHBondContact O-CD1 3.36Å; F137-F307 HydrophobicContact CB-CE1 4.22Å; F137-F307 HydrophobicContact CB-CZ 4.31Å; F137-F307 AromaticContact CD1-CE1 3.95Å; F137-F307 HydrophobicContact CD1-CE1 3.95Å; F137-F307 AromaticContact CD2-CE1 3.57Å; F137-F307 HydrophobicContact CD2-CE1 3.57Å; F137-F307 HydrophobicContact CD2-CZ 4.01Å; F137-F307 HydrophobicContact CE1-CE1 4.14Å; F137-F307 HydrophobicContact CE2-CD1 4.44Å; F137-F307 AromaticContact CE2-CE1 3.79Å; F137-F307 HydrophobicContact CE2-CE1 3.79Å; F137-F307 AromaticContact CG-CE1 3.65Å; F137-F307 HydrophobicContact CG-CE1 3.65Å; F137-F307 HydrophobicContact CG-CZ 4.16Å; F137-F307 HydrophobicContact CZ-CD1 4.44Å; F137-F307 HydrophobicContact CZ-CE1 4.06Å; F137-P316 HydrophobicContact CZ-CG 4.42Å; F137-L318 HydrophobicContact CD1-CD1 4.31Å; F137-L318 HydrophobicContact CD1-CD2 3.46Å; F137-L318 VanDerWaalsContact CD1-CD2 3.46Å; F137-L318 HydrophobicContact CD1-CG 4.04Å; F137-L318 HydrophobicContact CE1-CD2 3.78Å; F137-L318 HydrophobicContact CE1-CG 4.18Å; F137-L318 HydrophobicContact CG-CD2 4.24Å
138	I	97.5	Very high	96.8	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-65.6	-26.9	-179.2	-160.7	54.8	0	0	0	112.5	V134 I140 H141 V144 L179 M289 V292 Q293 L296 L298 I302	V134-I138 WeakPolarHBondContact O-CB 3.42Å; V134-I138 VanDerWaalsContact O-CG2 3.25Å; V134-I138 WeakPolarHBondContact O-CG2 3.27Å; V134-I138 PolarHBondContact O-N 3.11Å; I138-I140 PolarHBondContact O-N 3.17Å; I138-I140 VanDerWaalsContact O-N 3.12Å; I138-H141 WeakPolarHBondContact O-CB 3.43Å; I138-H141 PolarHBondContact O-N 2.89Å; I138-V144 HydrophobicContact CD1-CG2 4.48Å; I138-V144 HydrophobicContact CG1-CG1 4.2Å; I138-V144 HydrophobicContact CG1-CG2 4.14Å; I138-V144 HydrophobicContact CG2-CG1 4.19Å; I138-L179 HydrophobicContact CG1-CD1 4.27Å; I138-L179 HydrophobicContact CG2-CD1 3.62Å; I138-M289 HydrophobicContact CB-CE 3.64Å; I138-M289 HydrophobicContact CD1-CE 3.7Å; I138-M289 HydrophobicContact CG1-CE 4.12Å; I138-V292 HydrophobicContact CD1-CG1 4.08Å; I138-V292 HydrophobicContact CG1-CG1 4.35Å; I138-Q293 HydrophobicContact CD1-CG 4.04Å; I138-L296 HydrophobicContact CD1-CD1 4.2Å; I138-L296 HydrophobicContact CG1-CD1 4.05Å; I138-L298 HydrophobicContact CD1-CD1 4.09Å; I138-I302 HydrophobicContact CD1-CD1 3.97Å
139	R	95.6	Very high	96.7	Very high	108 Å²	108	31.3 Å²	31.3	41%	0.408	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-4.4	173.2	-75.2	171.3	88.6	-159	7	114.9	L135 E136 F137 A146	L135-R139 WeakPolarHBondContact O-CB 3.38Å; L135-R139 VanDerWaalsContact O-CD 3.23Å; L135-R139 WeakPolarHBondContact O-CD 3.48Å; L135-R139 WeakPolarHBondContact O-CG 3.22Å; L135-R139 PolarHBondContact O-N 3.02Å; E136-R139 IonicContact OE1-NH1 2.64Å; E136-R139 IonicContact OE2-CZ 3.73Å; E136-R139 IonicContact OE2-NH1 2.68Å; E136-R139 PolarHBondContact OE2-NH1 2.77Å; F137-R139 PolarHBondContact O-N 3.46Å; R139-A146 HydrophobicContact CG-CB 3.64Å
140	I	94.4	Very high	96.8	Very high	59 Å²	59	34.3 Å²	34.3	30%	0.303	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-31.5	167.3	-68.6	165.6	0	0	0	111	F137 I138 I302 H306 L318	F137-I140 WeakPolarHBondContact O-CB 3.38Å; F137-I140 PolarHBondContact O-N 2.92Å; F137-I140 VanDerWaalsContact O-N 3.12Å; I138-I140 PolarHBondContact O-N 3.17Å; I138-I140 VanDerWaalsContact O-N 3.12Å; I140-I302 HydrophobicContact CB-CD1 4.34Å; I140-I302 HydrophobicContact CB-CG1 4.17Å; I140-I302 HydrophobicContact CG2-CG1 4.2Å; I140-H306 HydrophobicContact CD1-CB 4.38Å; I140-L318 HydrophobicContact CD1-CD1 3.83Å; I140-L318 HydrophobicContact CD1-CD2 3.49Å; I140-L318 VanDerWaalsContact CD1-CD2 3.49Å; I140-L318 HydrophobicContact CD1-CG 4.15Å; I140-L318 HydrophobicContact CG1-CD1 4.32Å
141	H	96.4	Very high	96.8	Very high	3 Å²	3	33.7 Å²	33.7	1%	0.014	18%	0.178	C	C	.	.	S	Bend	trans	-65.9	129.7	-176.4	-168.3	-76.7	0	0	0	110.5	I138 D143 V144 K299 I302	I138-H141 WeakPolarHBondContact O-CB 3.43Å; I138-H141 PolarHBondContact O-N 2.89Å; H141-D143 VanDerWaalsContact C-N 3.27Å; H141-D143 IonicContact CE1-OD2 3.84Å; H141-D143 PolarHBondContact CE1-OD2 2.92Å; H141-D143 VanDerWaalsContact CE1-OD2 3.3Å; H141-D143 PolarHBondContact ND1-N 2.88Å; H141-D143 VanDerWaalsContact ND1-N 3.14Å; H141-D143 IonicContact ND1-OD2 3.82Å; H141-D143 PolarHBondContact O-N 3.43Å; H141-V144 HydrophobicContact CB-CB 4.15Å; H141-V144 HydrophobicContact CB-CG2 3.81Å; H141-V144 PolarHBondContact O-N 2.86Å; H141-K299 PolarHBondContact CD2-O 3.21Å; H141-K299 PolarHBondContact NE2-O 3.49Å; H141-I302 HydrophobicContact CB-CD1 4.06Å
142	P	95.8	Very high	96.8	Very high	75 Å²	75	34.7 Å²	34.7	49%	0.487	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-36.6	-174.8	22.3	-33.5	0	0	0	112.9	V144 Q176 I301	P142-V144 PolarHBondContact O-N 3.3Å; P142-Q176 PolarHBondContact O-NE2 3.18Å; P142-I301 HydrophobicContact CG-CD1 3.87Å
143	D	97.3	Very high	96.9	Very high	46 Å²	46	32.8 Å²	32.8	25%	0.246	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	18.6	177.2	-53.6	-75.7	0	0	0	114.7	H141 S175 Q176 I177 L298	H141-D143 VanDerWaalsContact C-N 3.27Å; H141-D143 IonicContact CE1-OD2 3.84Å; H141-D143 PolarHBondContact CE1-OD2 2.92Å; H141-D143 VanDerWaalsContact CE1-OD2 3.3Å; H141-D143 PolarHBondContact ND1-N 2.88Å; H141-D143 VanDerWaalsContact ND1-N 3.14Å; H141-D143 IonicContact ND1-OD2 3.82Å; H141-D143 PolarHBondContact O-N 3.43Å; D143-S175 PolarHBondContact OD1-OG 2.96Å; D143-Q176 CarbonylContact O-C 3.46Å; D143-Q176 VanDerWaalsContact O-CA 3.31Å; D143-Q176 WeakPolarHBondContact O-CA 3.46Å; D143-I177 PolarHBondContact O-N 3.12Å; D143-L298 HydrophobicContact CB-CD2 4.13Å
144	V	97.3	Very high	97	Very high	6 Å²	6	32.1 Å²	32.1	4%	0.036	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	125.6	178.6	175.2	0	0	0	0	111.8	I138 H141 P142 L179 L298	I138-V144 HydrophobicContact CD1-CG2 4.48Å; I138-V144 HydrophobicContact CG1-CG1 4.2Å; I138-V144 HydrophobicContact CG1-CG2 4.14Å; I138-V144 HydrophobicContact CG2-CG1 4.19Å; H141-V144 HydrophobicContact CB-CB 4.15Å; H141-V144 HydrophobicContact CB-CG2 3.81Å; H141-V144 PolarHBondContact O-N 2.86Å; P142-V144 PolarHBondContact O-N 3.3Å; V144-L179 HydrophobicContact CG1-CD1 3.53Å; V144-L179 HydrophobicContact CG1-CG 4.16Å; V144-L298 HydrophobicContact CG2-CD1 3.41Å; V144-L298 VanDerWaalsContact CG2-CD1 3.41Å; V144-L298 HydrophobicContact CG2-CD2 4.33Å
145	R	97.2	Very high	97	Very high	70 Å²	70	33.6 Å²	33.6	26%	0.264	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	116.7	178.6	-59.4	-66.3	-70	158.6	-5.4	108.7	P170 R171 T172 Q176 I177 T178 L179	R145-P170 HydrophobicContact CB-CB 4.39Å; R145-P170 HydrophobicContact CB-CG 3.94Å; R145-R171 PolarHBondContact NE-O 3.39Å; R145-T172 HydrophobicContact CB-CG2 3.51Å; R145-T172 HydrophobicContact CG-CG2 3.82Å; R145-Q176 HydrophobicContact CG-CB 4.13Å; R145-Q176 HydrophobicContact CG-CG 4.5Å; R145-I177 PolarHBondContact N-O 3.24Å; R145-T178 WeakPolarHBondContact O-CA 3.47Å; R145-L179 PolarHBondContact O-N 2.87Å
146	A	96.8	Very high	97	Very high	9 Å²	9	41 Å²	41	7%	0.074	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	141.3	-172.9	0	0	0	0	0	113.4	L135 R139 G148 L179	L135-A146 HydrophobicContact CD1-CB 3.71Å; L135-A146 HydrophobicContact CG-CB 4.47Å; R139-A146 HydrophobicContact CG-CB 3.64Å; A146-G148 PolarHBondContact O-N 3.3Å; A146-L179 CarbonylContact C-O 3.54Å; A146-L179 VanDerWaalsContact CA-O 3.27Å; A146-L179 WeakPolarHBondContact CA-O 3.49Å; A146-L179 HydrophobicContact CB-CB 3.82Å
147	L	96.9	Very high	97.1	Very high	20 Å²	20	40.8 Å²	40.8	11%	0.105	21%	0.205	C	C	.	.			trans	-66	127.2	168.5	-178.4	54.2	0	0	0	110	T149 P151 L168 M169 L179 E180	L147-T149 WeakPolarHBondContact CD1-OG1 3.34Å; L147-P151 HydrophobicContact CD2-CB 3.84Å; L147-P151 HydrophobicContact CD2-CG 3.87Å; L147-L168 WeakPolarHBondContact CD1-O 3.44Å; L147-L168 HydrophobicContact CD2-CB 3.9Å; L147-L168 HydrophobicContact CD2-CD1 4.4Å; L147-M169 HydrophobicContact CB-SD 4.21Å; L147-M169 HydrophobicContact CD2-CE 4.03Å; L147-M169 HydrophobicContact CD2-SD 4.22Å; L147-L179 PolarHBondContact N-O 3.42Å; L147-E180 HydrophobicContact CB-CB 4.22Å
148	G	92.5	Very high	97.2	Very high	30 Å²	30	43.8 Å²	43.8	31%	0.309	22%	0.217	S	C	.	.	S	Bend	trans	-78.2	-28.1	-175.3	0	0	0	0	0	114.4	R132 A146	R132-G148 VanDerWaalsContact CZ-O 3.3Å; R132-G148 PolarHBondContact NH1-O 2.93Å; R132-G148 PolarHBondContact NH2-O 3.45Å; A146-G148 PolarHBondContact O-N 3.3Å
149	T	96.3	Very high	97.2	Very high	90 Å²	90	50.8 Å²	50.8	55%	0.552	26%	0.255	S	S	*	.	S	Bend	trans	-86	175.1	176.3	45.6	0	0	0	0	111.5	L147 P151	L147-T149 WeakPolarHBondContact CD1-OG1 3.34Å; T149-P151 WeakPolarHBondContact O-CD 3.04Å
150	E	98.5	Very high	97.4	Very high	68 Å²	68	52.7 Å²	52.7	32%	0.318	26%	0.262	S	S	.	.			trans	-105.6	99	175.6	-34.3	-156.5	165.5	0	0	104.9	R132 H152 K181 P183	R132-E150 IonicContact NH2-OE1 3.64Å; R132-E150 PolarHBondContact NH2-OE1 3.07Å; E150-H152 PolarHBondContact O-CD2 3.15Å; E150-H152 VanDerWaalsContact O-CD2 3.28Å; E150-H152 PolarHBondContact O-N 2.83Å; E150-K181 VanDerWaalsContact CG-NZ 3.32Å; E150-K181 IonicContact OE1-NZ 2.84Å; E150-K181 PolarHBondContact OE1-NZ 3.24Å; E150-K181 IonicContact OE2-NZ 2.86Å; E150-K181 PolarHBondContact OE2-NZ 2.97Å; E150-K181 VanDerWaalsContact OE2-NZ 3.09Å; E150-P183 WeakPolarHBondContact OE2-CD 3.46Å
151	P	98.1	Very high	97.6	Very high	10 Å²	10	51.3 Å²	51.3	7%	0.065	26%	0.262	C	S	.	.			trans	-65.8	-22.6	-166.7	24.5	-37.1	0	0	0	114.3	L147 T149 F153 Y165 L168 E180 T182	L147-P151 HydrophobicContact CD2-CB 3.84Å; L147-P151 HydrophobicContact CD2-CG 3.87Å; T149-P151 WeakPolarHBondContact O-CD 3.04Å; P151-F153 PolarHBondContact O-N 3.32Å; P151-Y165 HydrophobicContact CB-CD2 4.44Å; P151-Y165 HydrophobicContact CB-CE2 4.15Å; P151-Y165 HydrophobicContact CG-CE2 3.97Å; P151-L168 HydrophobicContact CB-CD1 3.63Å; P151-E180 WeakPolarHBondContact CD-OE2 3.48Å; P151-E180 HydrophobicContact CG-CB 4.22Å; P151-E180 HydrophobicContact CG-CG 4.18Å; P151-E180 WeakPolarHBondContact CG-OE1 3.22Å; P151-E180 VanDerWaalsContact CG-OE2 3.31Å; P151-E180 WeakPolarHBondContact CG-OE2 3.26Å; P151-T182 VanDerWaalsContact CD-OG1 3.27Å; P151-T182 WeakPolarHBondContact CD-OG1 3.44Å
152	H	98.7	Very high	97.6	Very high	32 Å²	32	53.9 Å²	53.9	15%	0.148	28%	0.276	C	S	.	.			trans	51.8	42.7	-179.1	-73.5	-68	0	0	0	113.4	E150 D155 R156 N157 T182 S184	E150-H152 PolarHBondContact O-CD2 3.15Å; E150-H152 VanDerWaalsContact O-CD2 3.28Å; E150-H152 PolarHBondContact O-N 2.83Å; H152-D155 WeakPolarHBondContact CA-OD1 3.44Å; H152-D155 VanDerWaalsContact CB-OD1 3.24Å; H152-D155 WeakPolarHBondContact CB-OD1 3.44Å; H152-D155 IonicContact CE1-OD2 3.72Å; H152-D155 IonicContact CG-OD1 3.21Å; H152-D155 IonicContact CG-OD2 3.09Å; H152-D155 IonicContact ND1-OD1 3.65Å; H152-D155 PolarHBondContact ND1-OD1 2.9Å; H152-D155 VanDerWaalsContact ND1-OD1 3.13Å; H152-D155 IonicContact ND1-OD2 2.77Å; H152-D155 PolarHBondContact ND1-OD2 3.43Å; H152-R156 HydrophobicContact CB-CB 4.21Å; H152-R156 HydrophobicContact CB-CG 4.3Å; H152-R156 PolarHBondContact CD2-NH1 3.1Å; H152-R156 PolarHBondContact CE1-NH1 3.27Å; H152-R156 PolarHBondContact CE1-NH2 3Å; H152-R156 PolarHBondContact ND1-NH1 3.16Å; H152-R156 PolarHBondContact ND1-NH2 3.14Å; H152-R156 PolarHBondContact NE2-NH1 2.97Å; H152-R156 VanDerWaalsContact NE2-NH1 3.11Å; H152-R156 CarbonylContact O-C 3.48Å; H152-R156 PolarHBondContact O-N 3.17Å; H152-N157 WeakPolarHBondContact O-CB 3.27Å; H152-N157 PolarHBondContact O-N 2.95Å; H152-N157 PolarHBondContact O-ND2 3.31Å; H152-T182 VanDerWaalsContact ND1-CG2 3.32Å; H152-T182 WeakPolarHBondContact ND1-CG2 3.39Å; H152-S184 PolarHBondContact CE1-OG 3.05Å; H152-S184 PolarHBondContact ND1-OG 3.39Å
153	F	98.8	Very high	97.8	Very high	1 Å²	1	55.7 Å²	55.7	0%	0.004	28%	0.281	C	S	.	.	I	π-helix	trans	-76.5	-63.5	-178.5	179	-117.4	0	0	0	110.6	P151 D155 R156 N157 Y158 G161 L162 W164 Y165 Y185	P151-F153 PolarHBondContact O-N 3.32Å; F153-D155 PolarHBondContact O-N 3.36Å; F153-D155 VanDerWaalsContact O-N 3.09Å; F153-R156 PolarHBondContact O-N 3.22Å; F153-N157 WeakPolarHBondContact CD2-O 3.39Å; F153-N157 WeakPolarHBondContact CE2-O 3.42Å; F153-N157 CarbonylContact O-C 3.57Å; F153-N157 PolarHBondContact O-N 3.35Å; F153-N157 VanDerWaalsContact O-N 3.16Å; F153-Y158 HydrophobicContact CD1-CD2 4.29Å; F153-Y158 AromaticContact CE1-CD2 3.72Å; F153-Y158 HydrophobicContact CE1-CD2 3.72Å; F153-Y158 AromaticContact CE1-CE2 3.93Å; F153-Y158 HydrophobicContact CE1-CE2 3.93Å; F153-Y158 HydrophobicContact CE2-CD2 4.26Å; F153-Y158 WeakPolarHBondContact CE2-O 3.35Å; F153-Y158 AromaticContact CZ-CD2 3.7Å; F153-Y158 HydrophobicContact CZ-CD2 3.7Å; F153-Y158 HydrophobicContact CZ-CE2 4.05Å; F153-Y158 WeakPolarHBondContact O-CA 3.38Å; F153-Y158 PolarHBondContact O-N 3.45Å; F153-G161 WeakPolarHBondContact CE2-O 3.45Å; F153-L162 HydrophobicContact CE1-CD2 3.71Å; F153-L162 HydrophobicContact CZ-CD2 3.99Å; F153-L162 HydrophobicContact CZ-CG 4.5Å; F153-W164 HydrophobicContact CB-CZ3 4.35Å; F153-W164 AromaticContact CD2-CE3 3.88Å; F153-W164 HydrophobicContact CD2-CE3 3.88Å; F153-W164 AromaticContact CD2-CZ3 3.84Å; F153-W164 HydrophobicContact CD2-CZ3 3.84Å; F153-W164 HydrophobicContact CE2-CE3 4.38Å; F153-Y165 HydrophobicContact CB-CD2 3.37Å; F153-Y165 HydrophobicContact CB-CE2 3.5Å; F153-Y165 VanDerWaalsContact CB-CE2 3.5Å; F153-Y165 HydrophobicContact CB-CG 4.02Å; F153-Y165 AromaticContact CD1-CD1 3.58Å; F153-Y165 HydrophobicContact CD1-CD1 3.58Å; F153-Y165 AromaticContact CD1-CD2 3.76Å; F153-Y165 HydrophobicContact CD1-CD2 3.76Å; F153-Y165 AromaticContact CD1-CE1 3.88Å; F153-Y165 HydrophobicContact CD1-CE1 3.88Å; F153-Y165 HydrophobicContact CD1-CE2 4.03Å; F153-Y165 AromaticContact CD1-CG 3.5Å; F153-Y165 HydrophobicContact CD1-CG 3.5Å; F153-Y165 HydrophobicContact CD2-CD2 4.22Å; F153-Y165 HydrophobicContact CD2-CG 4.13Å; F153-Y165 AromaticContact CE1-CD1 3.85Å; F153-Y165 HydrophobicContact CE1-CD1 3.85Å; F153-Y165 HydrophobicContact CE1-CE1 4.42Å; F153-Y165 AromaticContact CE1-CG 3.97Å; F153-Y165 HydrophobicContact CE1-CG 3.97Å; F153-Y165 HydrophobicContact CG-CD1 4.17Å; F153-Y165 AromaticContact CG-CD2 3.52Å; F153-Y165 HydrophobicContact CG-CD2 3.52Å; F153-Y165 AromaticContact CG-CE2 3.98Å; F153-Y165 HydrophobicContact CG-CE2 3.98Å; F153-Y165 AromaticContact CG-CG 3.6Å; F153-Y165 HydrophobicContact CG-CG 3.6Å; F153-Y165 HydrophobicContact CZ-CG 4.45Å; F153-Y185 PolarHBondContact N-OH 2.72Å
154	F	98.8	Very high	97.8	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.283	C	S	.	.	I	π-helix	trans	-68.6	-10.5	-174.6	-60.7	-67.6	0	0	0	115	L122 Y158 Y165 Y185 A191 R194 I195 M198	L122-F154 HydrophobicContact CD1-CE2 4.09Å; F154-Y158 AromaticContact CD1-CD2 3.88Å; F154-Y158 HydrophobicContact CD1-CD2 3.88Å; F154-Y158 AromaticContact CD1-CE2 3.85Å; F154-Y158 HydrophobicContact CD1-CE2 3.85Å; F154-Y158 HydrophobicContact CE1-CD2 4.4Å; F154-Y158 HydrophobicContact CE1-CE2 4.03Å; F154-Y165 AromaticContact CE2-CE1 3.75Å; F154-Y165 HydrophobicContact CE2-CE1 3.75Å; F154-Y165 AromaticContact CE2-CZ 3.71Å; F154-Y165 WeakPolarHBondContact CE2-OH 3.47Å; F154-Y165 AromaticContact CZ-CE1 3.87Å; F154-Y165 HydrophobicContact CZ-CE1 3.87Å; F154-Y185 HydrophobicContact CB-CD1 4Å; F154-Y185 HydrophobicContact CB-CE1 3.73Å; F154-Y185 HydrophobicContact CB-CE2 4.4Å; F154-Y185 HydrophobicContact CB-CG 4.45Å; F154-Y185 HydrophobicContact CD2-CD2 4.28Å; F154-Y185 HydrophobicContact CD2-CE1 4.35Å; F154-Y185 AromaticContact CD2-CE2 3.64Å; F154-Y185 HydrophobicContact CD2-CE2 3.64Å; F154-Y185 AromaticContact CD2-CZ 3.68Å; F154-Y185 HydrophobicContact CG-CE2 4.5Å; F154-A191 HydrophobicContact CB-CB 4.21Å; F154-R194 HydrophobicContact CD1-CB 3.66Å; F154-R194 HydrophobicContact CE1-CB 4.25Å; F154-R194 WeakPolarHBondContact CE1-O 3.26Å; F154-R194 PolarHBondContact O-NH1 2.91Å; F154-I195 HydrophobicContact CB-CG1 4.29Å; F154-I195 HydrophobicContact CD1-CG1 3.84Å; F154-I195 HydrophobicContact CD2-CD1 3.95Å; F154-I195 HydrophobicContact CD2-CG1 3.44Å; F154-I195 VanDerWaalsContact CD2-CG1 3.44Å; F154-I195 HydrophobicContact CE1-CG1 3.9Å; F154-I195 HydrophobicContact CE2-CD1 4.38Å; F154-I195 HydrophobicContact CE2-CG1 3.54Å; F154-I195 HydrophobicContact CG-CD1 4.21Å; F154-I195 HydrophobicContact CG-CG1 3.58Å; F154-I195 HydrophobicContact CZ-CB 4.44Å; F154-I195 HydrophobicContact CZ-CG1 3.76Å; F154-M198 HydrophobicContact CE1-CB 4.49Å; F154-M198 HydrophobicContact CZ-CB 4.29Å; F154-M198 HydrophobicContact CZ-CE 4.26Å; F154-M198 HydrophobicContact CZ-SD 3.78Å
155	D	98.4	Very high	97.9	Very high	30 Å²	30	57 Å²	57	16%	0.16	28%	0.282	C	S	.	.	I	π-helix	trans	-112	-26.8	176.1	69.3	-24.4	0	0	0	116	H152 F153 S184 Y185 T188	H152-D155 WeakPolarHBondContact CA-OD1 3.44Å; H152-D155 VanDerWaalsContact CB-OD1 3.24Å; H152-D155 WeakPolarHBondContact CB-OD1 3.44Å; H152-D155 IonicContact CE1-OD2 3.72Å; H152-D155 IonicContact CG-OD1 3.21Å; H152-D155 IonicContact CG-OD2 3.09Å; H152-D155 IonicContact ND1-OD1 3.65Å; H152-D155 PolarHBondContact ND1-OD1 2.9Å; H152-D155 VanDerWaalsContact ND1-OD1 3.13Å; H152-D155 IonicContact ND1-OD2 2.77Å; H152-D155 PolarHBondContact ND1-OD2 3.43Å; F153-D155 PolarHBondContact O-N 3.36Å; F153-D155 VanDerWaalsContact O-N 3.09Å; D155-S184 WeakPolarHBondContact OD2-CB 3.43Å; D155-S184 PolarHBondContact OD2-OG 3.13Å; D155-Y185 HydrophobicContact CB-CD1 4.03Å; D155-Y185 HydrophobicContact CB-CE1 4.3Å; D155-Y185 WeakPolarHBondContact OD1-CE1 3.25Å; D155-T188 HydrophobicContact CB-CG2 3.92Å; D155-T188 VanDerWaalsContact CB-OG1 3.3Å; D155-T188 WeakPolarHBondContact CB-OG1 3.31Å
156	R	98.4	Very high	97.9	Very high	155 Å²	155	57.9 Å²	57.9	59%	0.585	29%	0.285	S	S	*	.	I	π-helix	trans	-138.3	-19	-175.8	-55.4	-175.6	-164.8	134.8	15	117.3	H152 F153	H152-R156 HydrophobicContact CB-CB 4.21Å; H152-R156 HydrophobicContact CB-CG 4.3Å; H152-R156 PolarHBondContact CD2-NH1 3.1Å; H152-R156 PolarHBondContact CE1-NH1 3.27Å; H152-R156 PolarHBondContact CE1-NH2 3Å; H152-R156 PolarHBondContact ND1-NH1 3.16Å; H152-R156 PolarHBondContact ND1-NH2 3.14Å; H152-R156 PolarHBondContact NE2-NH1 2.97Å; H152-R156 VanDerWaalsContact NE2-NH1 3.11Å; H152-R156 CarbonylContact O-C 3.48Å; H152-R156 PolarHBondContact O-N 3.17Å; F153-R156 PolarHBondContact O-N 3.22Å
157	N	98.6	Very high	98	Very high	39 Å²	39	59.3 Å²	59.3	21%	0.209	30%	0.3	C	S	.	.	I	π-helix	trans	-126.1	19.5	-171.9	-67.5	-86.9	0	0	0	112.3	H152 F153 D159 R160 W164	H152-N157 WeakPolarHBondContact O-CB 3.27Å; H152-N157 PolarHBondContact O-N 2.95Å; H152-N157 PolarHBondContact O-ND2 3.31Å; F153-N157 WeakPolarHBondContact CD2-O 3.39Å; F153-N157 WeakPolarHBondContact CE2-O 3.42Å; F153-N157 CarbonylContact O-C 3.57Å; F153-N157 PolarHBondContact O-N 3.35Å; F153-N157 VanDerWaalsContact O-N 3.16Å; N157-D159 PolarHBondContact O-N 3.48Å; N157-R160 HydrophobicContact CB-CG 4.31Å; N157-R160 VanDerWaalsContact O-CB 3.32Å; N157-R160 WeakPolarHBondContact O-CB 3.48Å; N157-R160 WeakPolarHBondContact O-CG 3.41Å; N157-R160 PolarHBondContact O-N 2.73Å; N157-R160 VanDerWaalsContact O-N 3.08Å; N157-R160 PolarHBondContact OD1-NE 2.91Å; N157-W164 HydrophobicContact CB-CE3 4.43Å; N157-W164 HydrophobicContact CB-CH2 3.64Å; N157-W164 HydrophobicContact CB-CZ3 3.57Å
158	Y	98.6	Very high	98.1	Very high	68 Å²	68	61 Å²	61	27%	0.267	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-59.1	-38.2	-171.7	-170.1	-111.6	0	0	0	112.1	F153 F154 R160 G161 R194	F153-Y158 HydrophobicContact CD1-CD2 4.29Å; F153-Y158 AromaticContact CE1-CD2 3.72Å; F153-Y158 HydrophobicContact CE1-CD2 3.72Å; F153-Y158 AromaticContact CE1-CE2 3.93Å; F153-Y158 HydrophobicContact CE1-CE2 3.93Å; F153-Y158 HydrophobicContact CE2-CD2 4.26Å; F153-Y158 WeakPolarHBondContact CE2-O 3.35Å; F153-Y158 AromaticContact CZ-CD2 3.7Å; F153-Y158 HydrophobicContact CZ-CD2 3.7Å; F153-Y158 HydrophobicContact CZ-CE2 4.05Å; F153-Y158 WeakPolarHBondContact O-CA 3.38Å; F153-Y158 PolarHBondContact O-N 3.45Å; F154-Y158 AromaticContact CD1-CD2 3.88Å; F154-Y158 HydrophobicContact CD1-CD2 3.88Å; F154-Y158 AromaticContact CD1-CE2 3.85Å; F154-Y158 HydrophobicContact CD1-CE2 3.85Å; F154-Y158 HydrophobicContact CE1-CD2 4.4Å; F154-Y158 HydrophobicContact CE1-CE2 4.03Å; Y158-R160 PolarHBondContact O-N 2.7Å; Y158-G161 PolarHBondContact O-N 3.06Å; Y158-R194 HydrophobicContact CD1-CG 4.31Å; Y158-R194 HydrophobicContact CD2-CB 4.22Å; Y158-R194 HydrophobicContact CD2-CG 4.16Å; Y158-R194 HydrophobicContact CE1-CG 3.91Å; Y158-R194 HydrophobicContact CE2-CB 3.64Å; Y158-R194 HydrophobicContact CE2-CG 3.77Å; Y158-R194 HydrophobicContact CG-CG 4.41Å
159	D	98.4	Very high	98.3	Very high	148 Å²	148	59.7 Å²	59.7	79%	0.791	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-69	-6.9	-178	-37.7	-58.6	0	0	0	113.2	N157 G161	N157-D159 PolarHBondContact O-N 3.48Å; D159-G161 PolarHBondContact O-N 3.17Å
160	R	98.4	Very high	98.4	Very high	148 Å²	148	56.5 Å²	56.5	56%	0.558	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-76.8	-8.4	168.9	-58.5	-174	179.3	-97.9	-2.5	113.5	N157 Y158 W164	N157-R160 HydrophobicContact CB-CG 4.31Å; N157-R160 VanDerWaalsContact O-CB 3.32Å; N157-R160 WeakPolarHBondContact O-CB 3.48Å; N157-R160 WeakPolarHBondContact O-CG 3.41Å; N157-R160 PolarHBondContact O-N 2.73Å; N157-R160 VanDerWaalsContact O-N 3.08Å; N157-R160 PolarHBondContact OD1-NE 2.91Å; Y158-R160 PolarHBondContact O-N 2.7Å; R160-W164 HydrophobicContact CB-CB 3.84Å; R160-W164 HydrophobicContact CB-CD2 3.7Å; R160-W164 HydrophobicContact CB-CE3 3.81Å; R160-W164 HydrophobicContact CB-CG 3.71Å; R160-W164 VanDerWaalsContact CD-CD2 3.4Å; R160-W164 HydrophobicContact CG-CD2 4.23Å; R160-W164 HydrophobicContact CG-CE3 4.41Å; R160-W164 HydrophobicContact CG-CG 4.47Å; R160-W164 VanDerWaalsContact O-CB 3.24Å; R160-W164 WeakPolarHBondContact O-CB 3.11Å
161	G	98.4	Very high	98.3	Very high	30 Å²	30	57.8 Å²	57.8	31%	0.309	28%	0.278	S	S	.	.	H	α-helix	trans	77	165.1	176.5	0	0	0	0	0	115.3	F153 Y158 D159 D163 W164 Y165	F153-G161 WeakPolarHBondContact CE2-O 3.45Å; Y158-G161 PolarHBondContact O-N 3.06Å; D159-G161 PolarHBondContact O-N 3.17Å; G161-D163 VanDerWaalsContact C-N 3.3Å; G161-D163 PolarHBondContact O-N 3.36Å; G161-W164 PolarHBondContact O-N 2.99Å; G161-Y165 PolarHBondContact O-N 2.81Å
162	L	98.3	Very high	98.2	Very high	57 Å²	57	57.4 Å²	57.4	30%	0.298	28%	0.275	S	S	.	.	H	α-helix	trans	-67.2	-26.6	-175.7	-73.9	173.2	0	0	0	113.6	L118 F153 Y165 R166 M198	L118-L162 HydrophobicContact CD1-CD2 4.49Å; L118-L162 HydrophobicContact CD2-CD2 4.27Å; F153-L162 HydrophobicContact CE1-CD2 3.71Å; F153-L162 HydrophobicContact CZ-CD2 3.99Å; F153-L162 HydrophobicContact CZ-CG 4.5Å; L162-Y165 HydrophobicContact CD2-CD1 4.32Å; L162-Y165 PolarHBondContact O-N 2.73Å; L162-R166 VanDerWaalsContact O-CB 3.29Å; L162-R166 WeakPolarHBondContact O-CB 3.46Å; L162-R166 PolarHBondContact O-N 3.36Å; L162-M198 HydrophobicContact CD1-CG 4.41Å; L162-M198 HydrophobicContact CD2-CB 4.27Å; L162-M198 HydrophobicContact CD2-CG 3.76Å; L162-M198 HydrophobicContact CD2-SD 4.03Å
163	D	98.4	Very high	98	Very high	112 Å²	112	58.5 Å²	58.5	60%	0.599	28%	0.282	S	S	*	.	H	α-helix	trans	-72.1	-35.7	178.1	-63	-56	0	0	0	112.5	G161 R166 G167	G161-D163 VanDerWaalsContact C-N 3.3Å; G161-D163 PolarHBondContact O-N 3.36Å; D163-R166 IonicContact OD1-CZ 3.69Å; D163-R166 IonicContact OD1-NH1 2.67Å; D163-R166 PolarHBondContact OD1-NH1 2.89Å; D163-R166 IonicContact OD1-NH2 2.71Å; D163-R166 PolarHBondContact OD1-NH2 2.63Å; D163-G167 PolarHBondContact O-N 3.13Å
164	W	98.5	Very high	97.6	Very high	79 Å²	79	65.3 Å²	65.3	30%	0.299	32%	0.319	S	S	.	.	H	α-helix	trans	-61.9	-46.5	169.1	175.9	83.2	0	0	0	110.9	F153 N157 R160 G161 G167 L168	F153-W164 HydrophobicContact CB-CZ3 4.35Å; F153-W164 AromaticContact CD2-CE3 3.88Å; F153-W164 HydrophobicContact CD2-CE3 3.88Å; F153-W164 AromaticContact CD2-CZ3 3.84Å; F153-W164 HydrophobicContact CD2-CZ3 3.84Å; F153-W164 HydrophobicContact CE2-CE3 4.38Å; N157-W164 HydrophobicContact CB-CE3 4.43Å; N157-W164 HydrophobicContact CB-CH2 3.64Å; N157-W164 HydrophobicContact CB-CZ3 3.57Å; R160-W164 HydrophobicContact CB-CB 3.84Å; R160-W164 HydrophobicContact CB-CD2 3.7Å; R160-W164 HydrophobicContact CB-CE3 3.81Å; R160-W164 HydrophobicContact CB-CG 3.71Å; R160-W164 VanDerWaalsContact CD-CD2 3.4Å; R160-W164 HydrophobicContact CG-CD2 4.23Å; R160-W164 HydrophobicContact CG-CE3 4.41Å; R160-W164 HydrophobicContact CG-CG 4.47Å; R160-W164 VanDerWaalsContact O-CB 3.24Å; R160-W164 WeakPolarHBondContact O-CB 3.11Å; G161-W164 PolarHBondContact O-N 2.99Å; W164-G167 CarbonylContact O-C 3.22Å; W164-G167 WeakPolarHBondContact O-CA 3.24Å; W164-G167 PolarHBondContact O-N 3.29Å; W164-G167 VanDerWaalsContact O-N 3.09Å; W164-L168 HydrophobicContact CE3-CD1 4.34Å; W164-L168 HydrophobicContact CH2-CD1 3.68Å; W164-L168 HydrophobicContact CZ2-CD1 3.98Å; W164-L168 HydrophobicContact CZ2-CD2 4.24Å; W164-L168 HydrophobicContact CZ2-CG 4.46Å; W164-L168 HydrophobicContact CZ3-CD1 3.86Å; W164-L168 PolarHBondContact O-N 2.63Å; W164-L168 VanDerWaalsContact O-N 3.17Å
165	Y	98.6	Very high	97.3	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-63.5	-46.1	179.9	-177.6	-128.3	0	0	0	112.3	L118 P119 P151 F153 F154 G161 L162 G167 L168 M169 E180 M198	L118-Y165 HydrophobicContact CD2-CD1 3.72Å; L118-Y165 HydrophobicContact CD2-CE1 4.33Å; P119-Y165 HydrophobicContact CG-CE1 3.8Å; P119-Y165 WeakPolarHBondContact CG-OH 3.5Å; P151-Y165 HydrophobicContact CB-CD2 4.44Å; P151-Y165 HydrophobicContact CB-CE2 4.15Å; P151-Y165 HydrophobicContact CG-CE2 3.97Å; F153-Y165 HydrophobicContact CB-CD2 3.37Å; F153-Y165 HydrophobicContact CB-CE2 3.5Å; F153-Y165 VanDerWaalsContact CB-CE2 3.5Å; F153-Y165 HydrophobicContact CB-CG 4.02Å; F153-Y165 AromaticContact CD1-CD1 3.58Å; F153-Y165 HydrophobicContact CD1-CD1 3.58Å; F153-Y165 AromaticContact CD1-CD2 3.76Å; F153-Y165 HydrophobicContact CD1-CD2 3.76Å; F153-Y165 AromaticContact CD1-CE1 3.88Å; F153-Y165 HydrophobicContact CD1-CE1 3.88Å; F153-Y165 HydrophobicContact CD1-CE2 4.03Å; F153-Y165 AromaticContact CD1-CG 3.5Å; F153-Y165 HydrophobicContact CD1-CG 3.5Å; F153-Y165 HydrophobicContact CD2-CD2 4.22Å; F153-Y165 HydrophobicContact CD2-CG 4.13Å; F153-Y165 AromaticContact CE1-CD1 3.85Å; F153-Y165 HydrophobicContact CE1-CD1 3.85Å; F153-Y165 HydrophobicContact CE1-CE1 4.42Å; F153-Y165 AromaticContact CE1-CG 3.97Å; F153-Y165 HydrophobicContact CE1-CG 3.97Å; F153-Y165 HydrophobicContact CG-CD1 4.17Å; F153-Y165 AromaticContact CG-CD2 3.52Å; F153-Y165 HydrophobicContact CG-CD2 3.52Å; F153-Y165 AromaticContact CG-CE2 3.98Å; F153-Y165 HydrophobicContact CG-CE2 3.98Å; F153-Y165 AromaticContact CG-CG 3.6Å; F153-Y165 HydrophobicContact CG-CG 3.6Å; F153-Y165 HydrophobicContact CZ-CG 4.45Å; F154-Y165 AromaticContact CE2-CE1 3.75Å; F154-Y165 HydrophobicContact CE2-CE1 3.75Å; F154-Y165 AromaticContact CE2-CZ 3.71Å; F154-Y165 WeakPolarHBondContact CE2-OH 3.47Å; F154-Y165 AromaticContact CZ-CE1 3.87Å; F154-Y165 HydrophobicContact CZ-CE1 3.87Å; G161-Y165 PolarHBondContact O-N 2.81Å; L162-Y165 HydrophobicContact CD2-CD1 4.32Å; L162-Y165 PolarHBondContact O-N 2.73Å; Y165-G167 PolarHBondContact O-N 3.15Å; Y165-L168 WeakPolarHBondContact O-CB 3.45Å; Y165-L168 PolarHBondContact O-N 2.81Å; Y165-L168 VanDerWaalsContact O-N 3.09Å; Y165-M169 HydrophobicContact CD1-CE 4.46Å; Y165-M169 HydrophobicContact CD2-CE 3.7Å; Y165-M169 HydrophobicContact CE1-CE 4.13Å; Y165-M169 HydrophobicContact CE2-CE 3.34Å; Y165-M169 HydrophobicContact CG-CE 4.27Å; Y165-E180 WeakPolarHBondContact CE2-OE1 3.16Å; Y165-E180 WeakPolarHBondContact OH-CG 3.48Å; Y165-E180 PolarHBondContact OH-OE1 2.96Å; Y165-M198 HydrophobicContact CD1-SD 4.24Å; Y165-M198 HydrophobicContact CE1-SD 3.82Å
166	R	98.4	Very high	97.2	Very high	90 Å²	90	68.8 Å²	68.8	34%	0.34	34%	0.342	S	S	.	.	H	α-helix	trans	-58.9	-37.6	170.6	-161.7	-172.1	-52.7	127.5	12.9	111	K116 L118 L162 D163 L168 M169	K116-R166 WeakPolarHBondContact O-CD 3.22Å; K116-R166 WeakPolarHBondContact O-CG 3.36Å; L118-R166 HydrophobicContact CD2-CB 3.83Å; L118-R166 HydrophobicContact CD2-CG 4.27Å; L118-R166 HydrophobicContact CG-CB 4.35Å; L118-R166 HydrophobicContact CG-CG 4.27Å; L162-R166 VanDerWaalsContact O-CB 3.29Å; L162-R166 WeakPolarHBondContact O-CB 3.46Å; L162-R166 PolarHBondContact O-N 3.36Å; D163-R166 IonicContact OD1-CZ 3.69Å; D163-R166 IonicContact OD1-NH1 2.67Å; D163-R166 PolarHBondContact OD1-NH1 2.89Å; D163-R166 IonicContact OD1-NH2 2.71Å; D163-R166 PolarHBondContact OD1-NH2 2.63Å; R166-L168 PolarHBondContact O-N 3.22Å; R166-M169 WeakPolarHBondContact O-CB 3.18Å; R166-M169 PolarHBondContact O-N 3.28Å; R166-M169 VanDerWaalsContact O-N 3.09Å
167	G	98.1	Very high	97.1	Very high	38 Å²	38	62.6 Å²	62.6	39%	0.392	32%	0.321	S	S	.	.	H	α-helix	trans	-58.9	-27	174.1	0	0	0	0	0	114.5	K116 D163 W164 Y165	K116-G167 PolarHBondContact NZ-O 3.24Å; D163-G167 PolarHBondContact O-N 3.13Å; W164-G167 CarbonylContact O-C 3.22Å; W164-G167 WeakPolarHBondContact O-CA 3.24Å; W164-G167 PolarHBondContact O-N 3.29Å; W164-G167 VanDerWaalsContact O-N 3.09Å; Y165-G167 PolarHBondContact O-N 3.15Å
168	L	98.1	Very high	97.1	Very high	56 Å²	56	60.8 Å²	60.8	29%	0.293	31%	0.311	S	S	.	.	H	α-helix	trans	-76.6	-26.8	174.2	-57.6	-177.4	0	0	0	113.4	L147 P151 W164 Y165 R166	L147-L168 WeakPolarHBondContact CD1-O 3.44Å; L147-L168 HydrophobicContact CD2-CB 3.9Å; L147-L168 HydrophobicContact CD2-CD1 4.4Å; P151-L168 HydrophobicContact CB-CD1 3.63Å; W164-L168 HydrophobicContact CE3-CD1 4.34Å; W164-L168 HydrophobicContact CH2-CD1 3.68Å; W164-L168 HydrophobicContact CZ2-CD1 3.98Å; W164-L168 HydrophobicContact CZ2-CD2 4.24Å; W164-L168 HydrophobicContact CZ2-CG 4.46Å; W164-L168 HydrophobicContact CZ3-CD1 3.86Å; W164-L168 PolarHBondContact O-N 2.63Å; W164-L168 VanDerWaalsContact O-N 3.17Å; Y165-L168 WeakPolarHBondContact O-CB 3.45Å; Y165-L168 PolarHBondContact O-N 2.81Å; Y165-L168 VanDerWaalsContact O-N 3.09Å; R166-L168 PolarHBondContact O-N 3.22Å
169	M	98.3	Very high	97.1	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.01	30%	0.299	C	S	.	.	S	Bend	trans	-69	150.1	-167	-63.7	-58.6	154.1	0	0	112.9	K116 K117 P119 L147 Y165 R166 T178 E180	K116-M169 WeakPolarHBondContact CD-O 3.4Å; K116-M169 WeakPolarHBondContact CE-O 3.31Å; K116-M169 WeakPolarHBondContact CG-O 3.36Å; K117-M169 VanDerWaalsContact O-CB 3.31Å; K117-M169 WeakPolarHBondContact O-CB 3.31Å; K117-M169 VanDerWaalsContact O-CG 3.31Å; K117-M169 WeakPolarHBondContact O-CG 3.39Å; P119-M169 HydrophobicContact CG-CE 4.09Å; P119-M169 HydrophobicContact CG-SD 4.49Å; L147-M169 HydrophobicContact CB-SD 4.21Å; L147-M169 HydrophobicContact CD2-CE 4.03Å; L147-M169 HydrophobicContact CD2-SD 4.22Å; Y165-M169 HydrophobicContact CD1-CE 4.46Å; Y165-M169 HydrophobicContact CD2-CE 3.7Å; Y165-M169 HydrophobicContact CE1-CE 4.13Å; Y165-M169 HydrophobicContact CE2-CE 3.34Å; Y165-M169 HydrophobicContact CG-CE 4.27Å; R166-M169 WeakPolarHBondContact O-CB 3.18Å; R166-M169 PolarHBondContact O-N 3.28Å; R166-M169 VanDerWaalsContact O-N 3.09Å; M169-T178 HydrophobicContact CB-CG2 4.07Å; M169-T178 HydrophobicContact CG-CG2 4.14Å; M169-T178 HydrophobicContact SD-CG2 4.07Å; M169-E180 HydrophobicContact CE-CB 4.3Å; M169-E180 HydrophobicContact CE-CG 4.46Å
170	P	96.7	Very high	97.1	Very high	23 Å²	23	50.6 Å²	50.6	15%	0.149	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-62.8	153.7	171.6	28.4	-35.3	0	0	0	110.8	R145	R145-P170 HydrophobicContact CB-CB 4.39Å; R145-P170 HydrophobicContact CB-CG 3.94Å
171	R	96.5	Very high	97.1	Very high	96 Å²	96	43.5 Å²	43.5	36%	0.362	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	140.6	166.3	-73.1	-179.2	171.8	-83.7	3.6	110.1	A110 Q111 G114 N115 K116 R145	A110-R171 WeakPolarHBondContact O-CB 3.39Å; Q111-R171 WeakPolarHBondContact O-CD 3.37Å; G114-R171 WeakPolarHBondContact O-CB 3.37Å; G114-R171 WeakPolarHBondContact O-CD 3.41Å; G114-R171 WeakPolarHBondContact O-CG 3.34Å; G114-R171 PolarHBondContact O-NH1 3.41Å; N115-R171 WeakPolarHBondContact O-CA 3.47Å; N115-R171 PolarHBondContact OD1-NH1 3.2Å; K116-R171 HydrophobicContact CG-CG 3.96Å; R145-R171 PolarHBondContact NE-O 3.39Å
172	T	96.4	Very high	97.1	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	145.1	-170.8	58.8	0	0	0	0	111.4	G114 N115 R145 T178	G114-T172 CarbonylContact C-O 3.58Å; G114-T172 WeakPolarHBondContact CA-O 3.42Å; N115-T172 PolarHBondContact N-O 2.88Å; N115-T172 PolarHBondContact O-N 3.14Å; N115-T172 PolarHBondContact O-OG1 3.15Å; R145-T172 HydrophobicContact CB-CG2 3.51Å; R145-T172 HydrophobicContact CG-CG2 3.82Å; T172-T178 WeakPolarHBondContact CG2-OG1 3.48Å
173	L	95.4	Very high	97.2	Very high	55 Å²	55	39.9 Å²	39.9	29%	0.288	21%	0.209	S	C	.	.			trans	-81.5	174.4	167.2	-53.8	175.5	0	0	0	110.3	V109 A110 K117 S175 Q176	V109-L173 HydrophobicContact CG1-CD1 4.22Å; A110-L173 HydrophobicContact CB-CD2 4.5Å; A110-L173 HydrophobicContact CB-CG 4.08Å; K117-L173 PolarHBondContact NZ-O 2.92Å; L173-S175 PolarHBondContact O-N 3.18Å; L173-Q176 HydrophobicContact CB-CG 4.08Å; L173-Q176 PolarHBondContact O-N 2.99Å
174	D	90.9	Very high	97.2	Very high	145 Å²	145	35.9 Å²	35.9	78%	0.775	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-24.8	-176	-61.3	-50.1	0	0	0	114.8	K117 Q176	K117-D174 IonicContact NZ-OD1 2.67Å; K117-D174 PolarHBondContact NZ-OD1 2.91Å; D174-Q176 VanDerWaalsContact C-N 3.28Å; D174-Q176 PolarHBondContact O-N 2.91Å
175	S	92.1	Very high	97.2	Very high	79 Å²	79	32.1 Å²	32.1	55%	0.552	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-12.9	170.6	70.6	0	0	0	0	114.4	D143 L173	D143-S175 PolarHBondContact OD1-OG 2.96Å; L173-S175 PolarHBondContact O-N 3.18Å
176	Q	96.1	Very high	97.2	Very high	23 Å²	23	32.3 Å²	32.3	11%	0.107	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-99.2	129.5	-163.7	-57.3	-169.8	-60	0	0	113.4	P142 D143 R145 L173 D174	P142-Q176 PolarHBondContact O-NE2 3.18Å; D143-Q176 CarbonylContact O-C 3.46Å; D143-Q176 VanDerWaalsContact O-CA 3.31Å; D143-Q176 WeakPolarHBondContact O-CA 3.46Å; R145-Q176 HydrophobicContact CG-CB 4.13Å; R145-Q176 HydrophobicContact CG-CG 4.5Å; L173-Q176 HydrophobicContact CB-CG 4.08Å; L173-Q176 PolarHBondContact O-N 2.99Å; D174-Q176 VanDerWaalsContact C-N 3.28Å; D174-Q176 PolarHBondContact O-N 2.91Å
177	I	96.9	Very high	97.2	Very high	26 Å²	26	30.4 Å²	30.4	13%	0.133	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	128	173.3	-60.8	-175	0	0	0	109.8	N120 D143 R145 L179 L296 L298	N120-I177 HydrophobicContact CB-CG2 4.35Å; D143-I177 PolarHBondContact O-N 3.12Å; R145-I177 PolarHBondContact N-O 3.24Å; I177-L179 HydrophobicContact CG2-CD2 3.73Å; I177-L179 HydrophobicContact CG2-CG 4.1Å; I177-L296 HydrophobicContact CD1-CB 3.87Å; I177-L298 HydrophobicContact CD1-CD1 4.23Å; I177-L298 HydrophobicContact CD1-CD2 3.64Å; I177-L298 HydrophobicContact CD1-CG 3.84Å; I177-L298 HydrophobicContact CG1-CD2 4.16Å
178	T	98.2	Very high	97.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	127.4	170.5	-57.5	0	0	0	0	110	P119 N120 R145 M169 T172	P119-T178 CarbonylContact C-O 3.36Å; P119-T178 VanDerWaalsContact CA-O 3.26Å; P119-T178 WeakPolarHBondContact CA-O 2.8Å; P119-T178 HydrophobicContact CB-CG2 4.23Å; P119-T178 WeakPolarHBondContact CB-O 3.49Å; N120-T178 PolarHBondContact N-O 3.44Å; N120-T178 PolarHBondContact OD1-N 2.87Å; N120-T178 VanDerWaalsContact OD1-N 3.1Å; R145-T178 WeakPolarHBondContact O-CA 3.47Å; M169-T178 HydrophobicContact CB-CG2 4.07Å; M169-T178 HydrophobicContact CG-CG2 4.14Å; M169-T178 HydrophobicContact SD-CG2 4.07Å; T172-T178 WeakPolarHBondContact CG2-OG1 3.48Å
179	L	97.8	Very high	97.3	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	151.3	-179.4	-63.8	-177.2	0	0	0	113.5	A121 I138 V144 R145 A146 L147 I177	A121-L179 HydrophobicContact CB-CD2 3.59Å; A121-L179 WeakPolarHBondContact O-CD2 3.46Å; I138-L179 HydrophobicContact CG1-CD1 4.27Å; I138-L179 HydrophobicContact CG2-CD1 3.62Å; V144-L179 HydrophobicContact CG1-CD1 3.53Å; V144-L179 HydrophobicContact CG1-CG 4.16Å; R145-L179 PolarHBondContact O-N 2.87Å; A146-L179 CarbonylContact C-O 3.54Å; A146-L179 VanDerWaalsContact CA-O 3.27Å; A146-L179 WeakPolarHBondContact CA-O 3.49Å; A146-L179 HydrophobicContact CB-CB 3.82Å; L147-L179 PolarHBondContact N-O 3.42Å; I177-L179 HydrophobicContact CG2-CD2 3.73Å; I177-L179 HydrophobicContact CG2-CG 4.1Å
180	E	98.4	Very high	97.3	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	-179.5	156.8	73.9	118.9	128.1	0	0	111.5	P119 L122 I123 L147 P151 Y165 M169 T182 Y185	P119-E180 HydrophobicContact CG-CG 4.43Å; L122-E180 HydrophobicContact CD2-CG 3.39Å; I123-E180 PolarHBondContact N-O 3.11Å; L147-E180 HydrophobicContact CB-CB 4.22Å; P151-E180 WeakPolarHBondContact CD-OE2 3.48Å; P151-E180 HydrophobicContact CG-CB 4.22Å; P151-E180 HydrophobicContact CG-CG 4.18Å; P151-E180 WeakPolarHBondContact CG-OE1 3.22Å; P151-E180 VanDerWaalsContact CG-OE2 3.31Å; P151-E180 WeakPolarHBondContact CG-OE2 3.26Å; Y165-E180 WeakPolarHBondContact CE2-OE1 3.16Å; Y165-E180 WeakPolarHBondContact OH-CG 3.48Å; Y165-E180 PolarHBondContact OH-OE1 2.96Å; M169-E180 HydrophobicContact CE-CB 4.3Å; M169-E180 HydrophobicContact CE-CG 4.46Å; E180-T182 WeakPolarHBondContact OE2-CB 3.42Å; E180-T182 PolarHBondContact OE2-N 3.03Å; E180-T182 VanDerWaalsContact OE2-N 3.13Å; E180-T182 PolarHBondContact OE2-OG1 3.46Å; E180-Y185 VanDerWaalsContact OE1-CE2 3.23Å; E180-Y185 WeakPolarHBondContact OE1-CE2 3.15Å; E180-Y185 PolarHBondContact OE1-OH 3.37Å
181	K	98.8	Very high	97.4	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	112.4	-178.3	176	-148.7	57.4	49	0	109.2	I123 T131 L135 E150 P183	I123-K181 HydrophobicContact CB-CB 3.87Å; I123-K181 HydrophobicContact CB-CG 3.79Å; I123-K181 HydrophobicContact CD1-CB 4.4Å; I123-K181 HydrophobicContact CD1-CG 4.48Å; I123-K181 HydrophobicContact CG1-CB 4.49Å; I123-K181 HydrophobicContact CG2-CG 3.92Å; I123-K181 WeakPolarHBondContact O-CA 3.36Å; T131-K181 VanDerWaalsContact C-CD 3.47Å; T131-K181 WeakPolarHBondContact O-CD 3.28Å; L135-K181 HydrophobicContact CB-CD 4.07Å; L135-K181 HydrophobicContact CD1-CB 4.09Å; L135-K181 HydrophobicContact CD2-CB 3.95Å; L135-K181 HydrophobicContact CD2-CD 4.02Å; L135-K181 HydrophobicContact CG-CB 4.43Å; E150-K181 VanDerWaalsContact CG-NZ 3.32Å; E150-K181 IonicContact OE1-NZ 2.84Å; E150-K181 PolarHBondContact OE1-NZ 3.24Å; E150-K181 IonicContact OE2-NZ 2.86Å; E150-K181 PolarHBondContact OE2-NZ 2.97Å; E150-K181 VanDerWaalsContact OE2-NZ 3.09Å; K181-P183 HydrophobicContact CG-CG 4.31Å
182	T	98.9	Very high	97.5	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.178	C	C	.	.			trans	-133.5	96.4	173	-62	0	0	0	0	109.2	I123 P151 H152 E180 S184 Y185	I123-T182 PolarHBondContact O-N 2.94Å; I123-T182 VanDerWaalsContact O-N 3.17Å; P151-T182 VanDerWaalsContact CD-OG1 3.27Å; P151-T182 WeakPolarHBondContact CD-OG1 3.44Å; H152-T182 VanDerWaalsContact ND1-CG2 3.32Å; H152-T182 WeakPolarHBondContact ND1-CG2 3.39Å; E180-T182 WeakPolarHBondContact OE2-CB 3.42Å; E180-T182 PolarHBondContact OE2-N 3.03Å; E180-T182 VanDerWaalsContact OE2-N 3.13Å; E180-T182 PolarHBondContact OE2-OG1 3.46Å; T182-S184 WeakPolarHBondContact CG2-OG 3.48Å; T182-S184 PolarHBondContact O-N 3.34Å; T182-Y185 HydrophobicContact CG2-CD1 3.62Å; T182-Y185 HydrophobicContact CG2-CD2 4.48Å; T182-Y185 HydrophobicContact CG2-CE1 3.38Å; T182-Y185 HydrophobicContact CG2-CE2 4.29Å; T182-Y185 HydrophobicContact CG2-CG 4.17Å; T182-Y185 PolarHBondContact O-N 2.8Å; T182-Y185 VanDerWaalsContact O-N 3.14Å; T182-Y185 PolarHBondContact OG1-OH 3.39Å
183	P	98.8	Very high	97.6	Very high	11 Å²	11	39 Å²	39	7%	0.071	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	1	-167.3	-20.2	34.3	0	0	0	116.1	V124 K127 T131 E150 K181	V124-P183 CarbonylContact O-C 3.59Å; V124-P183 WeakPolarHBondContact O-CA 3.33Å; K127-P183 HydrophobicContact CB-CB 4.49Å; K127-P183 PolarHBondContact N-O 2.81Å; T131-P183 HydrophobicContact CG2-CB 4.2Å; T131-P183 HydrophobicContact CG2-CG 4.1Å; T131-P183 WeakPolarHBondContact OG1-CG 3.22Å; E150-P183 WeakPolarHBondContact OE2-CD 3.46Å; K181-P183 HydrophobicContact CG-CG 4.31Å
184	S	98.8	Very high	97.8	Very high	27 Å²	27	38.9 Å²	38.9	19%	0.189	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-25.8	171.8	37.4	0	0	0	0	112.6	H152 D155 T182 F186 V187 T188	H152-S184 PolarHBondContact CE1-OG 3.05Å; H152-S184 PolarHBondContact ND1-OG 3.39Å; D155-S184 WeakPolarHBondContact OD2-CB 3.43Å; D155-S184 PolarHBondContact OD2-OG 3.13Å; T182-S184 WeakPolarHBondContact CG2-OG 3.48Å; T182-S184 PolarHBondContact O-N 3.34Å; S184-F186 PolarHBondContact O-N 3.47Å; S184-F186 VanDerWaalsContact O-N 3.12Å; S184-V187 WeakPolarHBondContact O-CG2 3.35Å; S184-V187 PolarHBondContact O-N 3.47Å; S184-T188 PolarHBondContact O-N 2.88Å; S184-T188 PolarHBondContact O-OG1 2.81Å
185	Y	98.9	Very high	98.1	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-52.2	-40.8	-178.3	-66.7	-15.6	0	0	0	111.6	V124 F153 F154 D155 E180 T182 V187 T188 I195 W264	V124-Y185 HydrophobicContact CG1-CD2 4.24Å; F153-Y185 PolarHBondContact N-OH 2.72Å; F154-Y185 HydrophobicContact CB-CD1 4Å; F154-Y185 HydrophobicContact CB-CE1 3.73Å; F154-Y185 HydrophobicContact CB-CE2 4.4Å; F154-Y185 HydrophobicContact CB-CG 4.45Å; F154-Y185 HydrophobicContact CD2-CD2 4.28Å; F154-Y185 HydrophobicContact CD2-CE1 4.35Å; F154-Y185 AromaticContact CD2-CE2 3.64Å; F154-Y185 HydrophobicContact CD2-CE2 3.64Å; F154-Y185 AromaticContact CD2-CZ 3.68Å; F154-Y185 HydrophobicContact CG-CE2 4.5Å; D155-Y185 HydrophobicContact CB-CD1 4.03Å; D155-Y185 HydrophobicContact CB-CE1 4.3Å; D155-Y185 WeakPolarHBondContact OD1-CE1 3.25Å; E180-Y185 VanDerWaalsContact OE1-CE2 3.23Å; E180-Y185 WeakPolarHBondContact OE1-CE2 3.15Å; E180-Y185 PolarHBondContact OE1-OH 3.37Å; T182-Y185 HydrophobicContact CG2-CD1 3.62Å; T182-Y185 HydrophobicContact CG2-CD2 4.48Å; T182-Y185 HydrophobicContact CG2-CE1 3.38Å; T182-Y185 HydrophobicContact CG2-CE2 4.29Å; T182-Y185 HydrophobicContact CG2-CG 4.17Å; T182-Y185 PolarHBondContact O-N 2.8Å; T182-Y185 VanDerWaalsContact O-N 3.14Å; T182-Y185 PolarHBondContact OG1-OH 3.39Å; Y185-V187 PolarHBondContact O-N 2.91Å; Y185-T188 PolarHBondContact O-N 2.91Å; Y185-I195 HydrophobicContact CD2-CD1 4.36Å; Y185-W264 WeakPolarHBondContact O-CZ2 3.39Å
186	F	98.9	Very high	98.4	Very high	4 Å²	4	28.7 Å²	28.7	2%	0.018	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-52.5	-29.9	-179.7	-172	-106.7	0	0	0	114.3	V124 V126 S184 V206 Y257 H260 W264	V124-F186 HydrophobicContact CG2-CD2 4.33Å; V124-F186 WeakPolarHBondContact O-CB 3.31Å; V124-F186 PolarHBondContact O-N 2.85Å; V126-F186 HydrophobicContact CG1-CD1 3.66Å; V126-F186 HydrophobicContact CG1-CE1 3.83Å; V126-F186 HydrophobicContact CG1-CG 4.23Å; S184-F186 PolarHBondContact O-N 3.47Å; S184-F186 VanDerWaalsContact O-N 3.12Å; F186-V206 HydrophobicContact CD2-CG1 3.92Å; F186-V206 HydrophobicContact CD2-CG2 4.07Å; F186-V206 HydrophobicContact CE2-CG1 3.79Å; F186-V206 HydrophobicContact CE2-CG2 4.04Å; F186-V206 HydrophobicContact CG-CG1 4.44Å; F186-V206 HydrophobicContact CZ-CG1 4.19Å; F186-Y257 HydrophobicContact CE1-CD1 4.18Å; F186-H260 HydrophobicContact CD1-CB 3.94Å; F186-H260 HydrophobicContact CE1-CB 3.51Å; F186-H260 HydrophobicContact CZ-CB 3.84Å; F186-W264 AromaticContact CD2-CD1 3.85Å; F186-W264 AromaticContact CD2-NE1 3.44Å; F186-W264 AromaticContact CE2-CD1 3.88Å; F186-W264 AromaticContact CE2-NE1 3.96Å; F186-W264 PolarHBondContact O-NE1 3.11Å
187	V	98.7	Very high	98.5	Very high	51 Å²	51	31 Å²	31	31%	0.309	15%	0.152	S	C	.	.	G	3₁₀ helix	trans	-112.3	10.7	-179.8	-51.6	0	0	0	0	113.4	S184 Y185 I254	S184-V187 WeakPolarHBondContact O-CG2 3.35Å; S184-V187 PolarHBondContact O-N 3.47Å; Y185-V187 PolarHBondContact O-N 2.91Å; V187-I254 HydrophobicContact CG1-CG1 4.15Å; V187-I254 HydrophobicContact CG1-CG2 4.34Å; V187-I254 HydrophobicContact CG2-CG1 4.37Å
188	T	98.8	Very high	98.6	Very high	22 Å²	22	31 Å²	31	14%	0.135	15%	0.152	C	C	.	.			trans	-91.5	117.3	171.9	-65.8	0	0	0	0	108.5	D155 S184 Y185 E190 A191	D155-T188 HydrophobicContact CB-CG2 3.92Å; D155-T188 VanDerWaalsContact CB-OG1 3.3Å; D155-T188 WeakPolarHBondContact CB-OG1 3.31Å; S184-T188 PolarHBondContact O-N 2.88Å; S184-T188 PolarHBondContact O-OG1 2.81Å; Y185-T188 PolarHBondContact O-N 2.91Å; T188-E190 VanDerWaalsContact C-N 3.26Å; T188-E190 WeakPolarHBondContact CG2-OE2 3.46Å; T188-E190 PolarHBondContact O-N 3.23Å; T188-A191 HydrophobicContact CG2-CB 3.91Å; T188-A191 PolarHBondContact O-N 3.17Å
189	R	98.4	Very high	98.5	Very high	193 Å²	193	33.3 Å²	33.3	73%	0.728	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-38	-173.7	179.6	-173.6	-174.6	-169	1.9	112.7	P192 N263	R189-P192 WeakPolarHBondContact O-CD 3.47Å; R189-N263 PolarHBondContact O-ND2 3.35Å
190	E	98.7	Very high	98.3	Very high	87 Å²	87	39.5 Å²	39.5	41%	0.407	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-17.3	-174.9	-55.3	67.8	-146.2	0	0	112.8	T188 H193 R194	T188-E190 VanDerWaalsContact C-N 3.26Å; T188-E190 WeakPolarHBondContact CG2-OE2 3.46Å; T188-E190 PolarHBondContact O-N 3.23Å; E190-H193 PolarHBondContact O-N 3.03Å; E190-R194 HydrophobicContact CB-CG 4.46Å; E190-R194 WeakPolarHBondContact O-CB 3.18Å; E190-R194 VanDerWaalsContact O-CG 3.23Å; E190-R194 WeakPolarHBondContact O-CG 3.4Å; E190-R194 PolarHBondContact O-N 2.64Å
191	A	98.8	Very high	98.2	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-63.3	-42.1	-171.2	0	0	0	0	0	114	F154 T188 H193 R194 I195 W264	F154-A191 HydrophobicContact CB-CB 4.21Å; T188-A191 HydrophobicContact CG2-CB 3.91Å; T188-A191 PolarHBondContact O-N 3.17Å; A191-H193 PolarHBondContact O-N 3.29Å; A191-R194 PolarHBondContact O-N 2.79Å; A191-I195 HydrophobicContact CB-CD1 4.32Å; A191-I195 WeakPolarHBondContact O-CB 3.32Å; A191-I195 WeakPolarHBondContact O-CD1 3.31Å; A191-I195 WeakPolarHBondContact O-CG1 3.37Å; A191-I195 PolarHBondContact O-N 2.85Å; A191-W264 HydrophobicContact CB-CH2 4.42Å; A191-W264 HydrophobicContact CB-CZ2 4.47Å
192	P	98.8	Very high	98.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.3	-47.1	179	-24.6	35.6	0	0	0	112.6	R189 I195 S196 W264 Y267 F268	R189-P192 WeakPolarHBondContact O-CD 3.47Å; P192-I195 PolarHBondContact O-N 2.99Å; P192-S196 WeakPolarHBondContact O-CB 3.04Å; P192-S196 PolarHBondContact O-N 3.32Å; P192-W264 HydrophobicContact CB-CD2 4.11Å; P192-W264 HydrophobicContact CB-CE3 3.85Å; P192-W264 HydrophobicContact CB-CZ3 4.21Å; P192-W264 HydrophobicContact CG-CD2 3.59Å; P192-W264 HydrophobicContact CG-CE3 3.79Å; P192-W264 HydrophobicContact CG-CG 3.97Å; P192-W264 HydrophobicContact CG-CH2 4.31Å; P192-W264 HydrophobicContact CG-CZ2 4.1Å; P192-W264 HydrophobicContact CG-CZ3 4.16Å; P192-Y267 HydrophobicContact CB-CD2 3.59Å; P192-Y267 HydrophobicContact CB-CE2 4.34Å; P192-Y267 HydrophobicContact CB-CG 4.1Å; P192-F268 HydrophobicContact CB-CE2 4.35Å; P192-F268 WeakPolarHBondContact O-CE2 3.38Å
193	H	98.6	Very high	98.2	Very high	94 Å²	94	48.6 Å²	48.6	44%	0.435	24%	0.242	S	C	.	.	H	α-helix	trans	-57.7	-54.4	174.8	175	58.9	0	0	0	111.1	E190 A191 I195 S196 S197 Y267	E190-H193 PolarHBondContact O-N 3.03Å; A191-H193 PolarHBondContact O-N 3.29Å; H193-I195 VanDerWaalsContact C-N 3.28Å; H193-I195 PolarHBondContact O-N 3.14Å; H193-S196 PolarHBondContact O-N 2.94Å; H193-S196 VanDerWaalsContact O-N 3.17Å; H193-S197 PolarHBondContact CE1-OG 3.28Å; H193-S197 PolarHBondContact O-N 2.78Å; H193-S197 PolarHBondContact O-OG 3.24Å; H193-Y267 HydrophobicContact CB-CD1 4.1Å; H193-Y267 HydrophobicContact CB-CE1 3.64Å; H193-Y267 HydrophobicContact CB-CE2 4.36Å; H193-Y267 AromaticContact ND1-CE1 3.66Å
194	R	98.7	Very high	98.2	Very high	53 Å²	53	48.1 Å²	48.1	20%	0.2	24%	0.239	C	C	.	.	H	α-helix	trans	-60.1	-33.8	-177.2	-69.2	171.6	166.5	165.4	-1.9	113.7	F154 Y158 E190 A191 M198	F154-R194 HydrophobicContact CD1-CB 3.66Å; F154-R194 HydrophobicContact CE1-CB 4.25Å; F154-R194 WeakPolarHBondContact CE1-O 3.26Å; F154-R194 PolarHBondContact O-NH1 2.91Å; Y158-R194 HydrophobicContact CD1-CG 4.31Å; Y158-R194 HydrophobicContact CD2-CB 4.22Å; Y158-R194 HydrophobicContact CD2-CG 4.16Å; Y158-R194 HydrophobicContact CE1-CG 3.91Å; Y158-R194 HydrophobicContact CE2-CB 3.64Å; Y158-R194 HydrophobicContact CE2-CG 3.77Å; Y158-R194 HydrophobicContact CG-CG 4.41Å; E190-R194 HydrophobicContact CB-CG 4.46Å; E190-R194 WeakPolarHBondContact O-CB 3.18Å; E190-R194 VanDerWaalsContact O-CG 3.23Å; E190-R194 WeakPolarHBondContact O-CG 3.4Å; E190-R194 PolarHBondContact O-N 2.64Å; A191-R194 PolarHBondContact O-N 2.79Å; R194-M198 PolarHBondContact O-N 3.16Å
195	I	98.8	Very high	98.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-76.5	-43.1	176.8	-65	160.6	0	0	0	110.6	L122 V124 F154 Y185 A191 P192 H193 S197 M198 S199 T202 L204 W264 F268	L122-I195 HydrophobicContact CD1-CB 4.38Å; L122-I195 HydrophobicContact CD1-CD1 3.73Å; L122-I195 HydrophobicContact CD1-CG1 3.86Å; L122-I195 HydrophobicContact CD1-CG2 3.51Å; V124-I195 HydrophobicContact CG1-CD1 4.43Å; F154-I195 HydrophobicContact CB-CG1 4.29Å; F154-I195 HydrophobicContact CD1-CG1 3.84Å; F154-I195 HydrophobicContact CD2-CD1 3.95Å; F154-I195 HydrophobicContact CD2-CG1 3.44Å; F154-I195 VanDerWaalsContact CD2-CG1 3.44Å; F154-I195 HydrophobicContact CE1-CG1 3.9Å; F154-I195 HydrophobicContact CE2-CD1 4.38Å; F154-I195 HydrophobicContact CE2-CG1 3.54Å; F154-I195 HydrophobicContact CG-CD1 4.21Å; F154-I195 HydrophobicContact CG-CG1 3.58Å; F154-I195 HydrophobicContact CZ-CB 4.44Å; F154-I195 HydrophobicContact CZ-CG1 3.76Å; Y185-I195 HydrophobicContact CD2-CD1 4.36Å; A191-I195 HydrophobicContact CB-CD1 4.32Å; A191-I195 WeakPolarHBondContact O-CB 3.32Å; A191-I195 WeakPolarHBondContact O-CD1 3.31Å; A191-I195 WeakPolarHBondContact O-CG1 3.37Å; A191-I195 PolarHBondContact O-N 2.85Å; P192-I195 PolarHBondContact O-N 2.99Å; H193-I195 VanDerWaalsContact C-N 3.28Å; H193-I195 PolarHBondContact O-N 3.14Å; I195-S197 VanDerWaalsContact C-N 3.28Å; I195-S197 PolarHBondContact O-N 2.88Å; I195-M198 WeakPolarHBondContact O-CA 3.28Å; I195-M198 WeakPolarHBondContact O-CB 3.28Å; I195-M198 PolarHBondContact O-N 3.24Å; I195-S199 PolarHBondContact O-N 3.18Å; I195-S199 VanDerWaalsContact O-N 3.11Å; I195-T202 HydrophobicContact CG2-CG2 3.84Å; I195-L204 HydrophobicContact CG2-CD2 4.34Å; I195-W264 HydrophobicContact CD1-CH2 3.53Å; I195-W264 HydrophobicContact CD1-CZ3 3.81Å; I195-F268 HydrophobicContact CB-CE2 4.44Å; I195-F268 HydrophobicContact CB-CZ 4.03Å; I195-F268 HydrophobicContact CG2-CE1 4.45Å; I195-F268 HydrophobicContact CG2-CE2 4.47Å; I195-F268 HydrophobicContact CG2-CZ 3.68Å
196	S	98.4	Very high	98.2	Very high	9 Å²	9	46.9 Å²	46.9	6%	0.063	23%	0.23	C	C	.	.	H	α-helix	trans	-62.3	-39.2	177.9	-162	0	0	0	0	110.7	P192 H193 M198 S199 H200 Y267	P192-S196 WeakPolarHBondContact O-CB 3.04Å; P192-S196 PolarHBondContact O-N 3.32Å; H193-S196 PolarHBondContact O-N 2.94Å; H193-S196 VanDerWaalsContact O-N 3.17Å; S196-M198 VanDerWaalsContact C-N 3.25Å; S196-M198 PolarHBondContact O-N 2.61Å; S196-S199 CarbonylContact O-C 3.55Å; S196-S199 VanDerWaalsContact O-C 3.22Å; S196-S199 PolarHBondContact O-N 2.86Å; S196-H200 PolarHBondContact O-N 2.73Å; S196-H200 PolarHBondContact O-ND1 2.8Å; S196-H200 PolarHBondContact OG-ND1 3.06Å; S196-Y267 PolarHBondContact OG-O 3.26Å
197	S	98	Very high	98.2	Very high	71 Å²	71	46.7 Å²	46.7	50%	0.497	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-14.3	171.3	-61	0	0	0	0	115.1	H193 I195	H193-S197 PolarHBondContact CE1-OG 3.28Å; H193-S197 PolarHBondContact O-N 2.78Å; H193-S197 PolarHBondContact O-OG 3.24Å; I195-S197 VanDerWaalsContact C-N 3.28Å; I195-S197 PolarHBondContact O-N 2.88Å
198	M	98	Very high	98.2	Very high	27 Å²	27	44.2 Å²	44.2	13%	0.133	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-45.4	168.4	-179.3	-169.5	70.7	0	0	110.9	L118 P119 F154 L162 Y165 R194 I195 S196	L118-M198 HydrophobicContact CB-SD 4.09Å; L118-M198 HydrophobicContact CD1-CG 3.93Å; L118-M198 HydrophobicContact CD1-SD 4.12Å; L118-M198 HydrophobicContact CD2-SD 4Å; L118-M198 HydrophobicContact CG-SD 4.29Å; P119-M198 HydrophobicContact CG-CE 4.39Å; F154-M198 HydrophobicContact CE1-CB 4.49Å; F154-M198 HydrophobicContact CZ-CB 4.29Å; F154-M198 HydrophobicContact CZ-CE 4.26Å; F154-M198 HydrophobicContact CZ-SD 3.78Å; L162-M198 HydrophobicContact CD1-CG 4.41Å; L162-M198 HydrophobicContact CD2-CB 4.27Å; L162-M198 HydrophobicContact CD2-CG 3.76Å; L162-M198 HydrophobicContact CD2-SD 4.03Å; Y165-M198 HydrophobicContact CD1-SD 4.24Å; Y165-M198 HydrophobicContact CE1-SD 3.82Å; R194-M198 PolarHBondContact O-N 3.16Å; I195-M198 WeakPolarHBondContact O-CA 3.28Å; I195-M198 WeakPolarHBondContact O-CB 3.28Å; I195-M198 PolarHBondContact O-N 3.24Å; S196-M198 VanDerWaalsContact C-N 3.25Å; S196-M198 PolarHBondContact O-N 2.61Å
199	S	96.1	Very high	98.2	Very high	48 Å²	48	45.3 Å²	45.3	34%	0.336	22%	0.216	S	C	.	.			trans	-165.7	124.7	171.4	174	0	0	0	0	110.4	I195 S196 D201 T202	I195-S199 PolarHBondContact O-N 3.18Å; I195-S199 VanDerWaalsContact O-N 3.11Å; S196-S199 CarbonylContact O-C 3.55Å; S196-S199 VanDerWaalsContact O-C 3.22Å; S196-S199 PolarHBondContact O-N 2.86Å; S199-D201 PolarHBondContact O-N 3.25Å; S199-D201 PolarHBondContact OG-N 3.07Å; S199-T202 WeakPolarHBondContact O-CB 3.47Å; S199-T202 PolarHBondContact O-N 2.95Å; S199-T202 PolarHBondContact O-OG1 3.22Å
200	H	94.6	Very high	98.2	Very high	131 Å²	131	37.2 Å²	37.2	61%	0.606	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-16.3	175.8	-62.7	-53.3	0	0	0	113.8	S196 Q272	S196-H200 PolarHBondContact O-N 2.73Å; S196-H200 PolarHBondContact O-ND1 2.8Å; S196-H200 PolarHBondContact OG-ND1 3.06Å; H200-Q272 PolarHBondContact O-NE2 3.41Å
201	D	96.1	Very high	98.2	Very high	122 Å²	122	33 Å²	33	65%	0.652	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.4	0.2	178.6	-64	-56.8	0	0	0	113.7	S199 K203	S199-D201 PolarHBondContact O-N 3.25Å; S199-D201 PolarHBondContact OG-N 3.07Å; D201-K203 PolarHBondContact O-N 3.28Å
202	T	98.4	Very high	98.2	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.012	17%	0.169	C	C	.	.			trans	-55.8	125.6	-179.8	-52.8	0	0	0	0	110.8	L122 I195 S199 L204 Q272	L122-T202 HydrophobicContact CD1-CG2 3.9Å; L122-T202 HydrophobicContact CG-CG2 3.9Å; I195-T202 HydrophobicContact CG2-CG2 3.84Å; S199-T202 WeakPolarHBondContact O-CB 3.47Å; S199-T202 PolarHBondContact O-N 2.95Å; S199-T202 PolarHBondContact O-OG1 3.22Å; T202-L204 HydrophobicContact CG2-CD2 4.06Å; T202-Q272 PolarHBondContact O-NE2 3.2Å
203	K	98.8	Very high	98.1	Very high	69 Å²	69	35.4 Å²	35.4	30%	0.3	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	137.7	174.5	-67.8	-177.3	-178	-177.8	0	111	N120 A121 L122 D201 F295 L296	N120-K203 PolarHBondContact O-N 2.96Å; A121-K203 CarbonylContact C-O 3.53Å; A121-K203 WeakPolarHBondContact CA-O 3.38Å; A121-K203 HydrophobicContact CB-CB 3.81Å; A121-K203 VanDerWaalsContact CB-O 3.31Å; A121-K203 WeakPolarHBondContact CB-O 3.29Å; L122-K203 PolarHBondContact N-O 2.97Å; D201-K203 PolarHBondContact O-N 3.28Å; K203-F295 HydrophobicContact CB-CE1 3.86Å; K203-F295 HydrophobicContact CB-CZ 3.76Å; K203-F295 HydrophobicContact CD-CE1 4.4Å; K203-F295 HydrophobicContact CD-CZ 4.33Å; K203-F295 WeakPolarHBondContact CD-O 3.45Å; K203-F295 WeakPolarHBondContact CE-O 3.38Å; K203-F295 HydrophobicContact CG-CZ 4.2Å; K203-F295 PolarHBondContact NZ-O 3.26Å; K203-L296 VanDerWaalsContact NZ-C 3.33Å; K203-L296 PolarHBondContact NZ-O 3.28Å
204	L	98.9	Very high	98.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	135.1	-174.2	-52.3	179.6	0	0	0	110.9	L122 V124 I195 T202 W264 F268 Q272 M273 H274 F295	L122-L204 HydrophobicContact CB-CD2 4.23Å; L122-L204 HydrophobicContact CD1-CD2 4.31Å; V124-L204 HydrophobicContact CG1-CD2 3.95Å; I195-L204 HydrophobicContact CG2-CD2 4.34Å; T202-L204 HydrophobicContact CG2-CD2 4.06Å; L204-W264 HydrophobicContact CD1-CD2 4.43Å; L204-W264 HydrophobicContact CD1-CE3 3.36Å; L204-W264 HydrophobicContact CD1-CZ3 3.47Å; L204-W264 VanDerWaalsContact CD1-CZ3 3.47Å; L204-W264 HydrophobicContact CD2-CZ3 4.19Å; L204-W264 HydrophobicContact CG-CZ3 4.47Å; L204-F268 HydrophobicContact CD1-CB 4.18Å; L204-F268 HydrophobicContact CD1-CD1 3.76Å; L204-F268 HydrophobicContact CD1-CD2 3.67Å; L204-F268 HydrophobicContact CD1-CE1 4.06Å; L204-F268 HydrophobicContact CD1-CE2 3.96Å; L204-F268 HydrophobicContact CD1-CG 3.56Å; L204-F268 HydrophobicContact CD1-CZ 4.16Å; L204-F268 HydrophobicContact CD2-CE1 4.44Å; L204-F268 HydrophobicContact CG-CD1 4.24Å; L204-F268 HydrophobicContact CG-CE1 4.34Å; L204-Q272 PolarHBondContact N-O 2.77Å; L204-M273 HydrophobicContact CB-CG 4.27Å; L204-M273 HydrophobicContact CD1-CE 4.14Å; L204-M273 HydrophobicContact CD1-CG 4.16Å; L204-M273 HydrophobicContact CD1-SD 4.5Å; L204-M273 CarbonylContact O-C 3.57Å; L204-M273 WeakPolarHBondContact O-CA 3.42Å; L204-H274 PolarHBondContact O-N 3.41Å; L204-F295 WeakPolarHBondContact O-CE1 3.29Å; L204-F295 WeakPolarHBondContact O-CZ 3.37Å
205	I	98.9	Very high	98.1	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	125	175	-62.4	171.5	0	0	0	108.8	L122 I123 V124 V207 H274 V276 V292 F295 L296	L122-I205 PolarHBondContact O-N 3.12Å; I123-I205 CarbonylContact C-O 3.59Å; I123-I205 WeakPolarHBondContact CA-O 3.34Å; I123-I205 HydrophobicContact CB-CB 4.48Å; I123-I205 HydrophobicContact CG1-CB 4.1Å; I123-I205 HydrophobicContact CG1-CD1 4.3Å; I123-I205 HydrophobicContact CG1-CG2 4.32Å; I123-I205 HydrophobicContact CG2-CG2 4.3Å; V124-I205 PolarHBondContact N-O 2.81Å; I205-V207 HydrophobicContact CG2-CG2 4.21Å; I205-H274 WeakPolarHBondContact CA-O 3.44Å; I205-V276 HydrophobicContact CG2-CG2 3.89Å; I205-V292 HydrophobicContact CD1-CG1 3.95Å; I205-F295 HydrophobicContact CG1-CD1 4.16Å; I205-F295 HydrophobicContact CG1-CE1 3.83Å; I205-L296 HydrophobicContact CD1-CD1 4.41Å; I205-L296 HydrophobicContact CD1-CD2 4.26Å; I205-L296 HydrophobicContact CD1-CG 4.44Å
206	V	98.9	Very high	98.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	105.6	177.1	-168.6	0	0	0	0	108.5	V124 G125 V126 F186 V208 M273 H274 F275 V276	V124-V206 HydrophobicContact CG2-CG2 3.88Å; G125-V206 CarbonylContact O-C 3.05Å; G125-V206 WeakPolarHBondContact O-CA 3.44Å; V126-V206 HydrophobicContact CG1-CG1 3.79Å; F186-V206 HydrophobicContact CD2-CG1 3.92Å; F186-V206 HydrophobicContact CD2-CG2 4.07Å; F186-V206 HydrophobicContact CE2-CG1 3.79Å; F186-V206 HydrophobicContact CE2-CG2 4.04Å; F186-V206 HydrophobicContact CG-CG1 4.44Å; F186-V206 HydrophobicContact CZ-CG1 4.19Å; V206-V208 HydrophobicContact CG1-CG1 3.87Å; V206-V208 PolarHBondContact O-N 2.86Å; V206-M273 HydrophobicContact CG2-CE 4.03Å; V206-H274 PolarHBondContact N-O 2.8Å; V206-F275 HydrophobicContact CB-CD1 3.74Å; V206-F275 HydrophobicContact CB-CE1 3.91Å; V206-F275 HydrophobicContact CG1-CD1 4.25Å; V206-F275 HydrophobicContact CG1-CE1 4.37Å; V206-F275 HydrophobicContact CG2-CD1 4.22Å; V206-F275 HydrophobicContact CG2-CE1 3.89Å; V206-F275 CarbonylContact O-C 3.56Å; V206-F275 VanDerWaalsContact O-CA 3.31Å; V206-F275 WeakPolarHBondContact O-CA 3.36Å; V206-V276 PolarHBondContact O-N 3.36Å
207	V	98.8	Very high	98.1	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	100.3	174.1	-165.9	0	0	0	0	108.3	I123 G125 V126 G129 T131 V134 I205 V276 L281	I123-V207 HydrophobicContact CG2-CG2 4.08Å; G125-V207 PolarHBondContact O-N 3.13Å; V126-V207 WeakPolarHBondContact CG2-O 3.34Å; V126-V207 PolarHBondContact N-O 3.3Å; G129-V207 WeakPolarHBondContact CA-O 3.4Å; T131-V207 HydrophobicContact CG2-CB 3.99Å; T131-V207 HydrophobicContact CG2-CG2 4Å; V134-V207 HydrophobicContact CB-CG2 4.19Å; V134-V207 HydrophobicContact CG2-CG1 4.18Å; V134-V207 HydrophobicContact CG2-CG2 3.53Å; I205-V207 HydrophobicContact CG2-CG2 4.21Å; V207-V276 WeakPolarHBondContact CA-O 3.41Å; V207-V276 HydrophobicContact CB-CB 4.36Å; V207-V276 HydrophobicContact CG1-CB 4.17Å; V207-V276 HydrophobicContact CG1-CG1 4.01Å; V207-V276 HydrophobicContact CG2-CB 4.14Å; V207-V276 HydrophobicContact CG2-CG1 4.45Å; V207-L281 HydrophobicContact CG1-CD2 4.21Å
208	V	98.8	Very high	98.1	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	173.3	179.3	-68.9	0	0	0	0	111.3	V126 V206 Y257 V276 G278 F360 F368 W370	V126-V208 HydrophobicContact CG1-CG1 4.29Å; V206-V208 HydrophobicContact CG1-CG1 3.87Å; V206-V208 PolarHBondContact O-N 2.86Å; V208-Y257 HydrophobicContact CB-CD2 4.47Å; V208-Y257 HydrophobicContact CB-CE2 4.13Å; V208-Y257 HydrophobicContact CG1-CD2 4.19Å; V208-Y257 HydrophobicContact CG1-CE2 4.26Å; V208-Y257 HydrophobicContact CG1-CG 4.47Å; V208-V276 WeakPolarHBondContact CG2-O 3.34Å; V208-V276 PolarHBondContact N-O 2.84Å; V208-G278 VanDerWaalsContact O-CA 3.23Å; V208-G278 WeakPolarHBondContact O-CA 3.32Å; V208-G278 PolarHBondContact O-N 3.45Å; V208-F360 HydrophobicContact CG1-CE1 4.32Å; V208-F360 HydrophobicContact CG1-CZ 3.84Å; V208-F360 HydrophobicContact CG2-CE1 4.48Å; V208-F368 HydrophobicContact CG2-CD1 3.64Å; V208-F368 HydrophobicContact CG2-CE1 3.31Å; V208-F368 HydrophobicContact CG2-CE2 4.41Å; V208-F368 HydrophobicContact CG2-CG 4.34Å; V208-F368 HydrophobicContact CG2-CZ 3.76Å; V208-W370 HydrophobicContact CB-CH2 3.76Å; V208-W370 HydrophobicContact CB-CZ2 3.84Å; V208-W370 HydrophobicContact CG2-CH2 3.83Å; V208-W370 HydrophobicContact CG2-CZ2 3.7Å
209	R	98.6	Very high	98.1	Very high	45 Å²	45	25.4 Å²	25.4	17%	0.17	13%	0.13	C	C	.	.			trans	-166	153.6	-175.7	-176.6	-171	167.5	139.4	12.7	108.6	P211 T213 R214 Y257 E279 W370	R209-P211 WeakPolarHBondContact O-CD 3.18Å; R209-P211 VanDerWaalsContact O-N 3.11Å; R209-T213 PolarHBondContact NE-OG1 2.92Å; R209-T213 PolarHBondContact NH2-OG1 3.4Å; R209-R214 HydrophobicContact CB-CB 4.36Å; R209-R214 HydrophobicContact CG-CB 4.43Å; R209-Y257 VanDerWaalsContact O-CE2 3.26Å; R209-Y257 WeakPolarHBondContact O-CE2 3.28Å; R209-Y257 PolarHBondContact O-OH 3.1Å; R209-E279 WeakPolarHBondContact CA-OE1 3.37Å; R209-E279 WeakPolarHBondContact CG-OE1 3.28Å; R209-W370 VanDerWaalsContact C-CE2 3.43Å
210	N	98.6	Very high	98.1	Very high	22 Å²	22	23.5 Å²	23.5	12%	0.118	12%	0.117	C	C	.	.			trans	-44.1	118.9	171	166.2	-71	0	0	0	110.2	V212 T213 R214 E279 W370	N210-V212 VanDerWaalsContact C-N 3.31Å; N210-V212 PolarHBondContact O-N 3.49Å; N210-V212 WeakPolarHBondContact OD1-CB 3.4Å; N210-V212 PolarHBondContact OD1-N 3.37Å; N210-V212 VanDerWaalsContact OD1-N 3.15Å; N210-T213 PolarHBondContact O-N 2.94Å; N210-T213 PolarHBondContact O-OG1 3.31Å; N210-T213 WeakPolarHBondContact OD1-CG2 3.41Å; N210-T213 PolarHBondContact OD1-N 2.72Å; N210-R214 VanDerWaalsContact O-CB 3.28Å; N210-R214 WeakPolarHBondContact O-CB 3.29Å; N210-R214 PolarHBondContact O-N 2.88Å; N210-E279 PolarHBondContact N-OE1 3.35Å; N210-W370 VanDerWaalsContact CA-CG 3.49Å; N210-W370 HydrophobicContact CB-CB 3.98Å; N210-W370 HydrophobicContact CB-CD2 4.39Å; N210-W370 HydrophobicContact CB-CG 3.71Å; N210-W370 VanDerWaalsContact N-CE2 3.35Å; N210-W370 VanDerWaalsContact N-NE1 3.14Å; N210-W370 PolarHBondContact ND2-O 3.4Å
211	P	98.8	Very high	98.2	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-58.7	-34.4	-170.6	-31.6	37.2	0	0	0	115.3	R209 R214 A215 Y257 Y353 N357 W370	R209-P211 WeakPolarHBondContact O-CD 3.18Å; R209-P211 VanDerWaalsContact O-N 3.11Å; P211-R214 WeakPolarHBondContact O-CB 3.42Å; P211-R214 PolarHBondContact O-N 2.92Å; P211-A215 WeakPolarHBondContact O-CB 3.33Å; P211-A215 PolarHBondContact O-N 3.31Å; P211-Y257 HydrophobicContact CG-CD2 4.4Å; P211-Y257 HydrophobicContact CG-CE2 3.83Å; P211-Y353 HydrophobicContact CB-CD1 3.57Å; P211-Y353 HydrophobicContact CB-CD2 3.6Å; P211-Y353 HydrophobicContact CB-CE1 3.58Å; P211-Y353 HydrophobicContact CB-CE2 3.63Å; P211-Y353 HydrophobicContact CB-CG 3.58Å; P211-Y353 HydrophobicContact CG-CD1 4.13Å; P211-Y353 HydrophobicContact CG-CG 4.15Å; P211-N357 WeakPolarHBondContact CG-OD1 3.37Å; P211-W370 HydrophobicContact CG-CE3 4.28Å; P211-W370 HydrophobicContact CG-CZ3 4.45Å
212	V	98.4	Very high	98.2	Very high	3 Å²	3	17 Å²	17	2%	0.018	9%	0.087	C	C	.	.	H	α-helix	trans	-64.9	-55.4	177.4	-172.2	0	0	0	0	110	N210 R214 A215 I216 I346 L349 Q350 Y353	N210-V212 VanDerWaalsContact C-N 3.31Å; N210-V212 PolarHBondContact O-N 3.49Å; N210-V212 WeakPolarHBondContact OD1-CB 3.4Å; N210-V212 PolarHBondContact OD1-N 3.37Å; N210-V212 VanDerWaalsContact OD1-N 3.15Å; V212-R214 PolarHBondContact O-N 3.17Å; V212-A215 WeakPolarHBondContact O-CB 3.23Å; V212-A215 PolarHBondContact O-N 3.37Å; V212-I216 HydrophobicContact CG1-CD1 3.98Å; V212-I216 WeakPolarHBondContact O-CG1 3.38Å; V212-I216 PolarHBondContact O-N 3.18Å; V212-I346 HydrophobicContact CG1-CG2 4.24Å; V212-L349 HydrophobicContact CG1-CB 4.07Å; V212-L349 HydrophobicContact CG1-CD1 4.24Å; V212-L349 HydrophobicContact CG2-CB 3.81Å; V212-Q350 HydrophobicContact CG2-CG 3.9Å; V212-Y353 HydrophobicContact CG2-CD2 3.69Å; V212-Y353 HydrophobicContact CG2-CE2 4Å
213	T	98	Very high	98.1	Very high	46 Å²	46	19 Å²	19	28%	0.282	10%	0.097	S	C	.	.	H	α-helix	trans	-67.3	-24.7	179	73.6	0	0	0	0	112.6	R209 N210 S217	R209-T213 PolarHBondContact NE-OG1 2.92Å; R209-T213 PolarHBondContact NH2-OG1 3.4Å; N210-T213 PolarHBondContact O-N 2.94Å; N210-T213 PolarHBondContact O-OG1 3.31Å; N210-T213 WeakPolarHBondContact OD1-CG2 3.41Å; N210-T213 PolarHBondContact OD1-N 2.72Å; T213-S217 VanDerWaalsContact O-CB 3.29Å; T213-S217 WeakPolarHBondContact O-CB 3.46Å; T213-S217 PolarHBondContact O-N 3.46Å
214	R	98.6	Very high	97.9	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-66.3	-44.9	169.7	-172.7	-123.1	73.4	78.3	-1.7	111.4	V126 K127 K128 R209 N210 P211 V212 D218 A251 Y257	V126-R214 HydrophobicContact CG2-CG 4.28Å; K127-R214 PolarHBondContact O-NH1 2.97Å; K128-R214 HydrophobicContact CB-CG 4.15Å; R209-R214 HydrophobicContact CB-CB 4.36Å; R209-R214 HydrophobicContact CG-CB 4.43Å; N210-R214 VanDerWaalsContact O-CB 3.28Å; N210-R214 WeakPolarHBondContact O-CB 3.29Å; N210-R214 PolarHBondContact O-N 2.88Å; P211-R214 WeakPolarHBondContact O-CB 3.42Å; P211-R214 PolarHBondContact O-N 2.92Å; V212-R214 PolarHBondContact O-N 3.17Å; R214-D218 IonicContact CZ-OD2 2.85Å; R214-D218 IonicContact NH1-OD2 3.33Å; R214-D218 PolarHBondContact NH1-OD2 3.29Å; R214-D218 IonicContact NH2-OD2 3.96Å; R214-D218 PolarHBondContact NH2-OD2 3.31Å; R214-D218 VanDerWaalsContact NH2-OD2 3.13Å; R214-D218 PolarHBondContact O-N 2.96Å; R214-D218 VanDerWaalsContact O-N 3.1Å; R214-A251 PolarHBondContact NH2-O 3.46Å; R214-Y257 VanDerWaalsContact CD-OH 3.28Å; R214-Y257 WeakPolarHBondContact CD-OH 3.43Å
215	A	98.6	Very high	97.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65	-50.3	176.5	0	0	0	0	0	112.1	P211 V212 S217 D218 Y219 F232 A251	P211-A215 WeakPolarHBondContact O-CB 3.33Å; P211-A215 PolarHBondContact O-N 3.31Å; V212-A215 WeakPolarHBondContact O-CB 3.23Å; V212-A215 PolarHBondContact O-N 3.37Å; A215-S217 VanDerWaalsContact C-N 3.27Å; A215-S217 PolarHBondContact O-N 3.05Å; A215-D218 WeakPolarHBondContact O-CA 3.3Å; A215-D218 VanDerWaalsContact O-CB 3.28Å; A215-D218 WeakPolarHBondContact O-CB 3.35Å; A215-D218 PolarHBondContact O-N 3.25Å; A215-Y219 PolarHBondContact O-N 3Å; A215-F232 HydrophobicContact CB-CE2 4.15Å; A215-F232 HydrophobicContact CB-CZ 4.23Å; A215-A251 VanDerWaalsContact CB-O 3.22Å; A215-A251 WeakPolarHBondContact CB-O 3.23Å
216	I	98.3	Very high	97.5	Very high	10 Å²	10	33.1 Å²	33.1	5%	0.051	17%	0.166	C	C	.	.	H	α-helix	trans	-57.7	-41.6	176.6	-61.4	167.1	0	0	0	110.6	V212 D218 Y219 T220 F232 H338 V339 I341	V212-I216 HydrophobicContact CG1-CD1 3.98Å; V212-I216 WeakPolarHBondContact O-CG1 3.38Å; V212-I216 PolarHBondContact O-N 3.18Å; I216-D218 VanDerWaalsContact C-N 3.27Å; I216-D218 PolarHBondContact O-N 3.44Å; I216-Y219 PolarHBondContact O-N 2.71Å; I216-T220 VanDerWaalsContact O-CB 3.29Å; I216-T220 WeakPolarHBondContact O-CB 3.43Å; I216-T220 PolarHBondContact O-N 2.92Å; I216-T220 PolarHBondContact O-OG1 3.34Å; I216-F232 HydrophobicContact CB-CE2 4.4Å; I216-F232 HydrophobicContact CG1-CD1 4.48Å; I216-F232 HydrophobicContact CG1-CD2 4.36Å; I216-F232 HydrophobicContact CG1-CE1 3.92Å; I216-F232 HydrophobicContact CG1-CE2 3.81Å; I216-F232 HydrophobicContact CG1-CZ 3.56Å; I216-H338 HydrophobicContact CG2-CB 3.96Å; I216-V339 HydrophobicContact CG2-CG2 4.18Å; I216-I341 HydrophobicContact CD1-CB 4.31Å; I216-I341 HydrophobicContact CD1-CG1 3.82Å; I216-I341 HydrophobicContact CG1-CG1 3.99Å; I216-I341 HydrophobicContact CG2-CG1 4.02Å
217	S	97.7	Very high	97.2	Very high	13 Å²	13	37.5 Å²	37.5	9%	0.091	20%	0.195	C	C	.	.	H	α-helix	trans	-66	-30	175.9	-154.7	0	0	0	0	112.7	K128 T213 A215 Q221 H338	K128-S217 WeakPolarHBondContact CE-O 3.34Å; K128-S217 VanDerWaalsContact CE-OG 3.29Å; K128-S217 WeakPolarHBondContact CE-OG 3.39Å; K128-S217 PolarHBondContact NZ-O 3.21Å; K128-S217 PolarHBondContact NZ-OG 2.98Å; T213-S217 VanDerWaalsContact O-CB 3.29Å; T213-S217 WeakPolarHBondContact O-CB 3.46Å; T213-S217 PolarHBondContact O-N 3.46Å; A215-S217 VanDerWaalsContact C-N 3.27Å; A215-S217 PolarHBondContact O-N 3.05Å; S217-Q221 PolarHBondContact O-N 2.67Å; S217-H338 VanDerWaalsContact CB-CE1 3.48Å; S217-H338 WeakPolarHBondContact CB-CE1 3.17Å; S217-H338 VanDerWaalsContact CB-NE2 3.29Å; S217-H338 WeakPolarHBondContact CB-NE2 3.27Å; S217-H338 PolarHBondContact OG-NE2 3.11Å
218	D	98.1	Very high	97	Very high	3 Å²	3	44.9 Å²	44.9	2%	0.016	23%	0.234	C	C	.	.	H	α-helix	trans	-71.6	-50.9	177	-143.2	-13.4	0	0	0	111	K127 K128 R214 A215 I216 T220 Q221 T222 A251	K127-D218 WeakPolarHBondContact CD-OD2 3.41Å; K127-D218 WeakPolarHBondContact CE-OD1 3.35Å; K127-D218 WeakPolarHBondContact CE-OD2 3.25Å; K127-D218 IonicContact NZ-OD1 3.57Å; K127-D218 PolarHBondContact NZ-OD1 3.09Å; K127-D218 IonicContact NZ-OD2 2.65Å; K127-D218 PolarHBondContact NZ-OD2 3.03Å; K128-D218 HydrophobicContact CD-CB 4.34Å; K128-D218 HydrophobicContact CG-CB 3.7Å; R214-D218 IonicContact CZ-OD2 2.85Å; R214-D218 IonicContact NH1-OD2 3.33Å; R214-D218 PolarHBondContact NH1-OD2 3.29Å; R214-D218 IonicContact NH2-OD2 3.96Å; R214-D218 PolarHBondContact NH2-OD2 3.31Å; R214-D218 VanDerWaalsContact NH2-OD2 3.13Å; R214-D218 PolarHBondContact O-N 2.96Å; R214-D218 VanDerWaalsContact O-N 3.1Å; A215-D218 WeakPolarHBondContact O-CA 3.3Å; A215-D218 VanDerWaalsContact O-CB 3.28Å; A215-D218 WeakPolarHBondContact O-CB 3.35Å; A215-D218 PolarHBondContact O-N 3.25Å; I216-D218 VanDerWaalsContact C-N 3.27Å; I216-D218 PolarHBondContact O-N 3.44Å; D218-T220 PolarHBondContact O-N 2.86Å; D218-Q221 WeakPolarHBondContact O-CA 3.49Å; D218-Q221 WeakPolarHBondContact O-CB 3.44Å; D218-Q221 PolarHBondContact O-N 3.05Å; D218-T222 PolarHBondContact O-N 2.81Å; D218-T222 PolarHBondContact O-OG1 3.5Å; D218-A251 HydrophobicContact CB-CB 4.43Å
219	Y	98.1	Very high	96.9	Very high	18 Å²	18	46.7 Å²	46.7	7%	0.071	24%	0.244	C	C	.	.	H	α-helix	trans	-51.6	-52.2	170.8	171.6	-101.2	0	0	0	111.9	A215 I216 Q221 T222 L223 I229 P230 F232 L235 W249 V339	A215-Y219 PolarHBondContact O-N 3Å; I216-Y219 PolarHBondContact O-N 2.71Å; Y219-Q221 PolarHBondContact O-N 2.72Å; Y219-T222 CarbonylContact O-C 3.56Å; Y219-T222 WeakPolarHBondContact O-CA 3.48Å; Y219-T222 WeakPolarHBondContact O-CB 3.49Å; Y219-T222 PolarHBondContact O-N 3.35Å; Y219-L223 HydrophobicContact CE1-CD2 4.08Å; Y219-L223 PolarHBondContact O-N 3.33Å; Y219-I229 HydrophobicContact CD2-CD1 3.94Å; Y219-I229 HydrophobicContact CE2-CD1 3.49Å; Y219-I229 VanDerWaalsContact CE2-CD1 3.49Å; Y219-I229 HydrophobicContact CE2-CG1 4.03Å; Y219-P230 WeakPolarHBondContact CE2-O 3.23Å; Y219-P230 PolarHBondContact OH-O 2.87Å; Y219-F232 HydrophobicContact CD1-CB 3.91Å; Y219-F232 HydrophobicContact CD1-CD2 4.08Å; Y219-F232 HydrophobicContact CD1-CG 4.44Å; Y219-F232 HydrophobicContact CD2-CB 4.39Å; Y219-F232 HydrophobicContact CD2-CD2 4.38Å; Y219-F232 HydrophobicContact CE1-CB 3.93Å; Y219-F232 HydrophobicContact CE2-CB 4.4Å; Y219-F232 HydrophobicContact CG-CB 4.15Å; Y219-F232 AromaticContact CG-CD2 3.79Å; Y219-F232 HydrophobicContact CG-CD2 3.79Å; Y219-F232 HydrophobicContact CG-CG 4.47Å; Y219-L235 HydrophobicContact CD2-CD1 4.13Å; Y219-L235 HydrophobicContact CE2-CD1 4.02Å; Y219-W249 HydrophobicContact CD2-CH2 4.03Å; Y219-W249 HydrophobicContact CD2-CZ2 4.08Å; Y219-W249 HydrophobicContact CG-CH2 4.38Å; Y219-V339 HydrophobicContact CD1-CG2 3.85Å; Y219-V339 HydrophobicContact CE1-CG1 4.17Å; Y219-V339 HydrophobicContact CE1-CG2 3.78Å
220	T	96.9	Very high	96.8	Very high	9 Å²	9	47.8 Å²	47.8	6%	0.055	26%	0.256	C	S	.	.	H	α-helix	trans	-54.6	-30.9	176.8	-58.6	0	0	0	0	112.7	I216 D218 S224 R336 T337	I216-T220 VanDerWaalsContact O-CB 3.29Å; I216-T220 WeakPolarHBondContact O-CB 3.43Å; I216-T220 PolarHBondContact O-N 2.92Å; I216-T220 PolarHBondContact O-OG1 3.34Å; D218-T220 PolarHBondContact O-N 2.86Å; T220-S224 WeakPolarHBondContact O-CB 3.38Å; T220-S224 PolarHBondContact O-N 3Å; T220-S224 PolarHBondContact O-OG 3.49Å; T220-R336 HydrophobicContact CG2-CB 4.09Å; T220-T337 WeakPolarHBondContact CG2-O 3.16Å
221	Q	96.3	Very high	96.7	Very high	53 Å²	53	49.6 Å²	49.6	25%	0.248	27%	0.268	C	S	.	.	H	α-helix	trans	-78.8	-35.2	175.1	169	172.8	-35	0	0	113	K128 S217 D218 Y219 S224	K128-Q221 VanDerWaalsContact NZ-CB 3.34Å; S217-Q221 PolarHBondContact O-N 2.67Å; D218-Q221 WeakPolarHBondContact O-CA 3.49Å; D218-Q221 WeakPolarHBondContact O-CB 3.44Å; D218-Q221 PolarHBondContact O-N 3.05Å; Y219-Q221 PolarHBondContact O-N 2.72Å; Q221-S224 WeakPolarHBondContact CA-OG 3.45Å; Q221-S224 PolarHBondContact O-OG 3.01Å
222	T	96.3	Very high	96.6	Very high	62 Å²	62	49.6 Å²	49.6	38%	0.38	27%	0.268	S	S	.	.	H	α-helix	trans	-66.2	-48	172.7	-53.5	0	0	0	0	110.7	D218 Y219 S224 K225 K226 I229	D218-T222 PolarHBondContact O-N 2.81Å; D218-T222 PolarHBondContact O-OG1 3.5Å; Y219-T222 CarbonylContact O-C 3.56Å; Y219-T222 WeakPolarHBondContact O-CA 3.48Å; Y219-T222 WeakPolarHBondContact O-CB 3.49Å; Y219-T222 PolarHBondContact O-N 3.35Å; T222-S224 VanDerWaalsContact C-N 3.3Å; T222-S224 PolarHBondContact O-N 3.33Å; T222-K225 CarbonylContact O-C 3.54Å; T222-K225 WeakPolarHBondContact O-CA 3.47Å; T222-K225 WeakPolarHBondContact O-CB 3.47Å; T222-K225 PolarHBondContact O-N 3.06Å; T222-K226 PolarHBondContact O-N 3.38Å; T222-I229 HydrophobicContact CG2-CD1 4Å
223	L	95.8	Very high	96.5	Very high	46 Å²	46	50.9 Å²	50.9	24%	0.241	27%	0.274	C	S	.	.	H	α-helix	trans	-54.2	-44.7	174.7	-170.5	66.6	0	0	0	111.4	Y219 K225 K226 P227 I229 V339	Y219-L223 HydrophobicContact CE1-CD2 4.08Å; Y219-L223 PolarHBondContact O-N 3.33Å; L223-K225 PolarHBondContact O-N 3.46Å; L223-K226 WeakPolarHBondContact CA-O 3.44Å; L223-K226 CarbonylContact O-C 3.53Å; L223-K226 VanDerWaalsContact O-C 3.23Å; L223-K226 PolarHBondContact O-N 2.87Å; L223-P227 WeakPolarHBondContact CD1-O 3.38Å; L223-I229 HydrophobicContact CB-CD1 4.02Å; L223-I229 HydrophobicContact CD1-CD1 4.03Å; L223-I229 HydrophobicContact CD1-CG1 3.71Å; L223-V339 HydrophobicContact CD2-CG1 3.74Å
224	S	94.2	Very high	96.4	Very high	61 Å²	61	54.8 Å²	54.8	43%	0.427	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	8.4	174.9	75.7	0	0	0	0	115.9	T220 Q221 T222 R336	T220-S224 WeakPolarHBondContact O-CB 3.38Å; T220-S224 PolarHBondContact O-N 3Å; T220-S224 PolarHBondContact O-OG 3.49Å; Q221-S224 WeakPolarHBondContact CA-OG 3.45Å; Q221-S224 PolarHBondContact O-OG 3.01Å; T222-S224 VanDerWaalsContact C-N 3.3Å; T222-S224 PolarHBondContact O-N 3.33Å; S224-R336 VanDerWaalsContact OG-CZ 3.31Å; S224-R336 PolarHBondContact OG-NE 2.95Å; S224-R336 PolarHBondContact OG-NH2 3.27Å
225	K	95	Very high	96.4	Very high	164 Å²	164	57 Å²	57	71%	0.713	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.2	-24.4	174	-72.4	-173.4	164.9	-154.5	0	113.4	T222 L223	T222-K225 CarbonylContact O-C 3.54Å; T222-K225 WeakPolarHBondContact O-CA 3.47Å; T222-K225 WeakPolarHBondContact O-CB 3.47Å; T222-K225 PolarHBondContact O-N 3.06Å; L223-K225 PolarHBondContact O-N 3.46Å
226	K	94.8	Very high	96.3	Very high	141 Å²	141	57 Å²	57	61%	0.613	30%	0.301	S	S	*	.			trans	-142.2	95.8	178.2	-69.5	-168.6	171.1	-160.9	0	106.3	T222 L223 D228 I229	T222-K226 PolarHBondContact O-N 3.38Å; L223-K226 WeakPolarHBondContact CA-O 3.44Å; L223-K226 CarbonylContact O-C 3.53Å; L223-K226 VanDerWaalsContact O-C 3.23Å; L223-K226 PolarHBondContact O-N 2.87Å; K226-D228 PolarHBondContact O-N 3.36Å; K226-I229 HydrophobicContact CB-CG2 3.9Å
227	P	92	Very high	96.3	Very high	92 Å²	92	57.2 Å²	57.2	60%	0.597	30%	0.301	S	S	*	.	S	Bend	trans	-60.9	-35.8	178.7	-23.3	35.1	0	0	0	111.9	L223 I229	L223-P227 WeakPolarHBondContact CD1-O 3.38Å; P227-I229 PolarHBondContact O-N 2.76Å
228	D	94.9	Very high	96.2	Very high	154 Å²	154	63.8 Å²	63.8	82%	0.824	33%	0.328	S	S	*	.	S	Bend	trans	-87.5	53.9	-169	-30.8	-82.5	0	0	0	111.4	K226	K226-D228 PolarHBondContact O-N 3.36Å
229	I	96.4	Very high	96	Very high	39 Å²	39	66.7 Å²	66.7	20%	0.2	34%	0.344	C	S	.	.	S	Bend	trans	-111.6	152.5	171.5	61.1	177	0	0	0	109.9	Y219 T222 L223 K226 P227	Y219-I229 HydrophobicContact CD2-CD1 3.94Å; Y219-I229 HydrophobicContact CE2-CD1 3.49Å; Y219-I229 VanDerWaalsContact CE2-CD1 3.49Å; Y219-I229 HydrophobicContact CE2-CG1 4.03Å; T222-I229 HydrophobicContact CG2-CD1 4Å; L223-I229 HydrophobicContact CB-CD1 4.02Å; L223-I229 HydrophobicContact CD1-CD1 4.03Å; L223-I229 HydrophobicContact CD1-CG1 3.71Å; K226-I229 HydrophobicContact CB-CG2 3.9Å; P227-I229 PolarHBondContact O-N 2.76Å
230	P	96.9	Very high	95.6	Very high	67 Å²	67	69.4 Å²	69.4	44%	0.435	35%	0.354	S	S	.	.			trans	-57.8	162.4	170.9	-21.4	32.9	0	0	0	111.6	Y219 E234 L235	Y219-P230 WeakPolarHBondContact CE2-O 3.23Å; Y219-P230 PolarHBondContact OH-O 2.87Å; P230-E234 HydrophobicContact CB-CB 3.98Å; P230-L235 HydrophobicContact CB-CD2 4.19Å; P230-L235 HydrophobicContact CB-CG 4.15Å; P230-L235 HydrophobicContact CG-CD2 4.2Å
231	T	96.7	Very high	95.3	Very high	60 Å²	60	74.6 Å²	74.6	37%	0.368	39%	0.391	S	S	.	.			trans	-57.1	165.6	179.3	60.6	0	0	0	0	112.5	E233 E234 L235	T231-E233 WeakPolarHBondContact CB-OE2 3.07Å; T231-E233 PolarHBondContact O-N 2.82Å; T231-E234 VanDerWaalsContact CB-OE2 3.31Å; T231-E234 WeakPolarHBondContact CB-OE2 3.03Å; T231-E234 WeakPolarHBondContact CG2-OE2 3.49Å; T231-E234 PolarHBondContact N-OE2 3.23Å; T231-E234 WeakPolarHBondContact OG1-CB 3.38Å; T231-E234 VanDerWaalsContact OG1-CD 3.24Å; T231-E234 WeakPolarHBondContact OG1-CG 3.45Å; T231-E234 PolarHBondContact OG1-N 3.19Å; T231-E234 VanDerWaalsContact OG1-N 3.14Å; T231-E234 PolarHBondContact OG1-OE2 3.06Å; T231-L235 VanDerWaalsContact O-CG 3.31Å; T231-L235 WeakPolarHBondContact O-CG 3.29Å; T231-L235 PolarHBondContact O-N 3.19Å
232	F	97.6	Very high	95	Very high	0 Å²	0	77.7 Å²	77.7	0%	0	41%	0.408	C	S	.	.	H	α-helix	trans	-63.1	-36.9	176.5	175.3	-98	0	0	0	110.6	A215 I216 Y219 L235 A236 W249 I341 V345 L349	A215-F232 HydrophobicContact CB-CE2 4.15Å; A215-F232 HydrophobicContact CB-CZ 4.23Å; I216-F232 HydrophobicContact CB-CE2 4.4Å; I216-F232 HydrophobicContact CG1-CD1 4.48Å; I216-F232 HydrophobicContact CG1-CD2 4.36Å; I216-F232 HydrophobicContact CG1-CE1 3.92Å; I216-F232 HydrophobicContact CG1-CE2 3.81Å; I216-F232 HydrophobicContact CG1-CZ 3.56Å; Y219-F232 HydrophobicContact CD1-CB 3.91Å; Y219-F232 HydrophobicContact CD1-CD2 4.08Å; Y219-F232 HydrophobicContact CD1-CG 4.44Å; Y219-F232 HydrophobicContact CD2-CB 4.39Å; Y219-F232 HydrophobicContact CD2-CD2 4.38Å; Y219-F232 HydrophobicContact CE1-CB 3.93Å; Y219-F232 HydrophobicContact CE2-CB 4.4Å; Y219-F232 HydrophobicContact CG-CB 4.15Å; Y219-F232 AromaticContact CG-CD2 3.79Å; Y219-F232 HydrophobicContact CG-CD2 3.79Å; Y219-F232 HydrophobicContact CG-CG 4.47Å; F232-L235 PolarHBondContact O-N 3.33Å; F232-A236 HydrophobicContact CD1-CB 4.48Å; F232-A236 HydrophobicContact CE1-CB 4.26Å; F232-A236 WeakPolarHBondContact O-CB 3.48Å; F232-A236 PolarHBondContact O-N 2.92Å; F232-W249 AromaticContact CD2-CH2 3.68Å; F232-W249 HydrophobicContact CD2-CH2 3.68Å; F232-W249 AromaticContact CD2-CZ3 3.96Å; F232-W249 HydrophobicContact CD2-CZ3 3.96Å; F232-W249 AromaticContact CE2-CH2 3.89Å; F232-W249 HydrophobicContact CE2-CH2 3.89Å; F232-W249 AromaticContact CE2-CZ3 3.83Å; F232-W249 HydrophobicContact CE2-CZ3 3.83Å; F232-I341 HydrophobicContact CB-CD1 3.47Å; F232-I341 VanDerWaalsContact CB-CD1 3.47Å; F232-I341 HydrophobicContact CD1-CD1 3.6Å; F232-I341 HydrophobicContact CD1-CG1 4.14Å; F232-I341 HydrophobicContact CD1-CG2 3.95Å; F232-I341 HydrophobicContact CE1-CG2 4.19Å; F232-I341 HydrophobicContact CG-CD1 3.64Å; F232-I341 HydrophobicContact CG-CG1 4.48Å; F232-V345 HydrophobicContact CD1-CG1 4.2Å; F232-V345 HydrophobicContact CE1-CG1 4.08Å; F232-L349 HydrophobicContact CE1-CD1 3.52Å; F232-L349 HydrophobicContact CZ-CD1 3.7Å
233	E	96	Very high	94.8	Very high	31 Å²	31	76.3 Å²	76.3	15%	0.145	41%	0.406	C	S	.	.	H	α-helix	trans	-64	-51.9	179.9	-65.2	72.7	-166.2	0	0	111.7	T231 L235 A236 F237 I341 V345	T231-E233 WeakPolarHBondContact CB-OE2 3.07Å; T231-E233 PolarHBondContact O-N 2.82Å; E233-L235 PolarHBondContact O-N 3.33Å; E233-A236 PolarHBondContact O-N 2.9Å; E233-A236 VanDerWaalsContact O-N 3.15Å; E233-F237 WeakPolarHBondContact O-CD2 3.29Å; E233-F237 PolarHBondContact O-N 2.84Å; E233-I341 WeakPolarHBondContact OE1-CD1 3.31Å; E233-V345 HydrophobicContact CG-CG1 4.28Å; E233-V345 HydrophobicContact CG-CG2 3.96Å
234	E	96.2	Very high	94.8	Very high	128 Å²	128	78.7 Å²	78.7	60%	0.598	42%	0.418	S	S	*	.	H	α-helix	trans	-62.2	-25.6	176.1	-71.5	163.6	127.2	0	0	113.4	P230 T231	P230-E234 HydrophobicContact CB-CB 3.98Å; T231-E234 VanDerWaalsContact CB-OE2 3.31Å; T231-E234 WeakPolarHBondContact CB-OE2 3.03Å; T231-E234 WeakPolarHBondContact CG2-OE2 3.49Å; T231-E234 PolarHBondContact N-OE2 3.23Å; T231-E234 WeakPolarHBondContact OG1-CB 3.38Å; T231-E234 VanDerWaalsContact OG1-CD 3.24Å; T231-E234 WeakPolarHBondContact OG1-CG 3.45Å; T231-E234 PolarHBondContact OG1-N 3.19Å; T231-E234 VanDerWaalsContact OG1-N 3.14Å; T231-E234 PolarHBondContact OG1-OE2 3.06Å
235	L	97.4	Very high	94.9	Very high	46 Å²	46	76.5 Å²	76.5	24%	0.241	40%	0.402	C	S	.	.	H	α-helix	trans	-91.8	-22.2	176.4	-62.8	174.7	0	0	0	113.2	Y219 P230 T231 F232 E233 W249	Y219-L235 HydrophobicContact CD2-CD1 4.13Å; Y219-L235 HydrophobicContact CE2-CD1 4.02Å; P230-L235 HydrophobicContact CB-CD2 4.19Å; P230-L235 HydrophobicContact CB-CG 4.15Å; P230-L235 HydrophobicContact CG-CD2 4.2Å; T231-L235 VanDerWaalsContact O-CG 3.31Å; T231-L235 WeakPolarHBondContact O-CG 3.29Å; T231-L235 PolarHBondContact O-N 3.19Å; F232-L235 PolarHBondContact O-N 3.33Å; E233-L235 PolarHBondContact O-N 3.33Å; L235-W249 VanDerWaalsContact C-CE3 3.44Å; L235-W249 HydrophobicContact CB-CD2 3.85Å; L235-W249 HydrophobicContact CB-CE3 3.85Å; L235-W249 HydrophobicContact CB-CH2 3.64Å; L235-W249 HydrophobicContact CB-CZ2 3.64Å; L235-W249 HydrophobicContact CB-CZ3 3.75Å; L235-W249 HydrophobicContact CD1-CH2 4.2Å; L235-W249 HydrophobicContact CD1-CZ2 3.66Å; L235-W249 HydrophobicContact CG-CZ2 4.29Å
236	A	97.6	Very high	95.1	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-83.4	-25.2	-177.3	0	0	0	0	0	113.5	F232 E233 V245 D246 W249 I252 L349	F232-A236 HydrophobicContact CD1-CB 4.48Å; F232-A236 HydrophobicContact CE1-CB 4.26Å; F232-A236 WeakPolarHBondContact O-CB 3.48Å; F232-A236 PolarHBondContact O-N 2.92Å; E233-A236 PolarHBondContact O-N 2.9Å; E233-A236 VanDerWaalsContact O-N 3.15Å; A236-V245 CarbonylContact O-C 3.23Å; A236-V245 VanDerWaalsContact O-CA 3.31Å; A236-V245 WeakPolarHBondContact O-CA 3.32Å; A236-V245 WeakPolarHBondContact O-CG1 3.44Å; A236-D246 PolarHBondContact O-N 3.07Å; A236-W249 HydrophobicContact CB-CZ3 4.18Å; A236-I252 HydrophobicContact CB-CD1 4.41Å; A236-L349 HydrophobicContact CB-CD1 4.44Å
237	F	97.9	Very high	95.2	Very high	15 Å²	15	65.9 Å²	65.9	7%	0.066	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	140.6	-175.5	-57.4	-90.4	0	0	0	113	E233 R240 L244 V245 V345 Q348 L349	E233-F237 WeakPolarHBondContact O-CD2 3.29Å; E233-F237 PolarHBondContact O-N 2.84Å; F237-R240 HydrophobicContact CB-CB 4.31Å; F237-R240 HydrophobicContact CD2-CB 4.4Å; F237-R240 HydrophobicContact CG-CB 4.31Å; F237-L244 CarbonylContact C-O 3.51Å; F237-L244 WeakPolarHBondContact CA-O 3.16Å; F237-V245 HydrophobicContact CD1-CB 4.48Å; F237-V245 HydrophobicContact CD1-CG2 3.91Å; F237-V245 HydrophobicContact CE1-CG2 3.63Å; F237-V345 HydrophobicContact CE2-CB 4.35Å; F237-V345 HydrophobicContact CE2-CG1 3.81Å; F237-V345 HydrophobicContact CE2-CG2 3.97Å; F237-V345 HydrophobicContact CZ-CG1 4.28Å; F237-V345 HydrophobicContact CZ-CG2 4.47Å; F237-Q348 HydrophobicContact CE1-CB 4.05Å; F237-Q348 HydrophobicContact CZ-CB 3.93Å; F237-L349 HydrophobicContact CZ-CD2 4.32Å; F237-L349 HydrophobicContact CZ-CG 4.15Å
238	K	96.1	Very high	95.5	Very high	151 Å²	151	65.3 Å²	65.3	66%	0.657	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	-29.5	162.3	-58.8	-170.5	-178.8	-177.7	0	111.8	L244 D246	K238-L244 PolarHBondContact N-O 3.11Å; K238-D246 WeakPolarHBondContact CE-OD1 3.44Å; K238-D246 HydrophobicContact CG-CB 3.8Å; K238-D246 IonicContact NZ-OD1 3.6Å
239	N	92.9	Very high	95.6	Very high	63 Å²	63	60.4 Å²	60.4	34%	0.337	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	106.5	172.7	-175.8	-37.2	0	0	0	109	S241 L242 G243 L244	N239-S241 WeakPolarHBondContact OD1-CB 3.37Å; N239-S241 PolarHBondContact OD1-N 3.48Å; N239-S241 VanDerWaalsContact OD1-N 3.09Å; N239-L242 HydrophobicContact CB-CB 4.36Å; N239-L242 PolarHBondContact O-N 3.02Å; N239-L242 PolarHBondContact OD1-N 3.43Å; N239-L242 VanDerWaalsContact OD1-N 3.11Å; N239-G243 PolarHBondContact O-N 3.47Å; N239-L244 HydrophobicContact CB-CB 4.31Å; N239-L244 HydrophobicContact CB-CD1 4.35Å; N239-L244 PolarHBondContact N-O 3.26Å; N239-L244 PolarHBondContact O-N 2.73Å
240	R	89.3	Confident	95.6	Very high	75 Å²	75	62.6 Å²	62.6	28%	0.283	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-64.3	-40.4	-179.5	179.5	177.1	167.4	179.6	-5.5	112.2	F237 L242 G243 E342 E344 Q348	F237-R240 HydrophobicContact CB-CB 4.31Å; F237-R240 HydrophobicContact CD2-CB 4.4Å; F237-R240 HydrophobicContact CG-CB 4.31Å; R240-L242 PolarHBondContact O-N 3Å; R240-G243 PolarHBondContact O-N 3.42Å; R240-E342 IonicContact CZ-OE1 3.31Å; R240-E342 IonicContact CZ-OE2 3.59Å; R240-E342 IonicContact NH1-OE1 3.06Å; R240-E342 PolarHBondContact NH1-OE1 3.25Å; R240-E342 IonicContact NH1-OE2 3.13Å; R240-E342 VanDerWaalsContact NH2-CD 3.29Å; R240-E342 IonicContact NH2-OE1 2.63Å; R240-E342 PolarHBondContact NH2-OE1 2.76Å; R240-E342 IonicContact NH2-OE2 2.7Å; R240-E342 PolarHBondContact NH2-OE2 2.94Å; R240-E344 IonicContact CZ-OE2 2.72Å; R240-E344 VanDerWaalsContact CZ-OE2 3.31Å; R240-E344 IonicContact NE-OE2 2.81Å; R240-E344 PolarHBondContact NE-OE2 3.3Å; R240-E344 IonicContact NH2-OE2 3.19Å; R240-E344 PolarHBondContact NH2-OE2 2.93Å; R240-Q348 PolarHBondContact O-NE2 3.14Å
241	S	90.6	Very high	95.6	Very high	119 Å²	119	59.7 Å²	59.7	83%	0.832	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-64.6	-19.4	-179.2	-45.6	0	0	0	0	113.9	N239	N239-S241 WeakPolarHBondContact OD1-CB 3.37Å; N239-S241 PolarHBondContact OD1-N 3.48Å; N239-S241 VanDerWaalsContact OD1-N 3.09Å
242	L	91.4	Very high	95.7	Very high	118 Å²	118	56.9 Å²	56.9	62%	0.618	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-107	6.1	173.9	-61.4	179.9	0	0	0	113	N239 R240 L244	N239-L242 HydrophobicContact CB-CB 4.36Å; N239-L242 PolarHBondContact O-N 3.02Å; N239-L242 PolarHBondContact OD1-N 3.43Å; N239-L242 VanDerWaalsContact OD1-N 3.11Å; R240-L242 PolarHBondContact O-N 3Å; L242-L244 HydrophobicContact CB-CD1 3.95Å; L242-L244 HydrophobicContact CB-CG 3.79Å; L242-L244 HydrophobicContact CD1-CD1 4.02Å; L242-L244 PolarHBondContact O-N 3.46Å; L242-L244 VanDerWaalsContact O-N 3.16Å
243	G	90.4	Very high	95.8	Very high	32 Å²	32	62.2 Å²	62.2	33%	0.33	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.2	16.9	-175.4	0	0	0	0	0	114.7	N239 R240 V245	N239-G243 PolarHBondContact O-N 3.47Å; R240-G243 PolarHBondContact O-N 3.42Å; G243-V245 PolarHBondContact O-N 3.17Å
244	L	95.7	Very high	95.9	Very high	96 Å²	96	61.3 Å²	61.3	50%	0.503	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	86.6	-172.2	-66.1	178.5	0	0	0	111.2	F237 K238 N239 L242	F237-L244 CarbonylContact C-O 3.51Å; F237-L244 WeakPolarHBondContact CA-O 3.16Å; K238-L244 PolarHBondContact N-O 3.11Å; N239-L244 HydrophobicContact CB-CB 4.31Å; N239-L244 HydrophobicContact CB-CD1 4.35Å; N239-L244 PolarHBondContact N-O 3.26Å; N239-L244 PolarHBondContact O-N 2.73Å; L242-L244 HydrophobicContact CB-CD1 3.95Å; L242-L244 HydrophobicContact CB-CG 3.79Å; L242-L244 HydrophobicContact CD1-CD1 4.02Å; L242-L244 PolarHBondContact O-N 3.46Å; L242-L244 VanDerWaalsContact O-N 3.16Å
245	V	97.9	Very high	96	Very high	15 Å²	15	55.2 Å²	55.2	9%	0.091	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	135.9	177.1	179.6	0	0	0	0	111.8	A236 F237 G243 T247 I252 L349 F352	A236-V245 CarbonylContact O-C 3.23Å; A236-V245 VanDerWaalsContact O-CA 3.31Å; A236-V245 WeakPolarHBondContact O-CA 3.32Å; A236-V245 WeakPolarHBondContact O-CG1 3.44Å; F237-V245 HydrophobicContact CD1-CB 4.48Å; F237-V245 HydrophobicContact CD1-CG2 3.91Å; F237-V245 HydrophobicContact CE1-CG2 3.63Å; G243-V245 PolarHBondContact O-N 3.17Å; V245-T247 PolarHBondContact O-N 3.3Å; V245-I252 HydrophobicContact CG1-CB 4.43Å; V245-I252 HydrophobicContact CG1-CD1 4.19Å; V245-I252 HydrophobicContact CG1-CG1 3.93Å; V245-I252 HydrophobicContact CG1-CG2 3.72Å; V245-L349 HydrophobicContact CG1-CD2 3.89Å; V245-L349 HydrophobicContact CG2-CD2 3.77Å; V245-F352 HydrophobicContact CB-CD2 3.85Å; V245-F352 HydrophobicContact CB-CE2 4.13Å; V245-F352 HydrophobicContact CB-CG 4.09Å; V245-F352 HydrophobicContact CG1-CD1 4.09Å; V245-F352 HydrophobicContact CG1-CD2 4.19Å; V245-F352 HydrophobicContact CG1-CE1 4.11Å; V245-F352 HydrophobicContact CG1-CE2 4.2Å; V245-F352 HydrophobicContact CG1-CG 4.15Å; V245-F352 HydrophobicContact CG1-CZ 4.17Å; V245-F352 HydrophobicContact CG2-CB 3.86Å; V245-F352 HydrophobicContact CG2-CD1 4.38Å; V245-F352 HydrophobicContact CG2-CD2 3.89Å; V245-F352 HydrophobicContact CG2-CG 3.76Å
246	D	98.1	Very high	96.1	Very high	22 Å²	22	53.5 Å²	53.5	12%	0.118	29%	0.286	C	S	.	.			trans	-81	98	170.9	-175.7	32.3	0	0	0	112.2	A236 K238 S248 W249 I252	A236-D246 PolarHBondContact O-N 3.07Å; K238-D246 WeakPolarHBondContact CE-OD1 3.44Å; K238-D246 HydrophobicContact CG-CB 3.8Å; K238-D246 IonicContact NZ-OD1 3.6Å; D246-S248 VanDerWaalsContact CG-OG 3.29Å; D246-S248 PolarHBondContact O-N 3.17Å; D246-S248 WeakPolarHBondContact OD1-CB 3.22Å; D246-S248 PolarHBondContact OD1-N 2.68Å; D246-S248 PolarHBondContact OD1-OG 3.14Å; D246-S248 VanDerWaalsContact OD1-OG 3.13Å; D246-S248 WeakPolarHBondContact OD2-CB 3.35Å; D246-S248 PolarHBondContact OD2-OG 3.02Å; D246-W249 PolarHBondContact O-N 3.06Å; D246-W249 PolarHBondContact OD2-N 3.01Å; D246-I252 WeakPolarHBondContact O-CB 3.49Å; D246-I252 WeakPolarHBondContact O-CG1 3.44Å
247	T	97.7	Very high	96.1	Very high	61 Å²	61	53.6 Å²	53.6	37%	0.374	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-10.5	172.1	62.8	0	0	0	0	113.9	V245 R253 M256 F352	V245-T247 PolarHBondContact O-N 3.3Å; T247-R253 WeakPolarHBondContact O-CB 3.45Å; T247-R253 WeakPolarHBondContact O-CD 3.37Å; T247-M256 HydrophobicContact CG2-CE 4.42Å; T247-M256 HydrophobicContact CG2-SD 4.48Å; T247-F352 HydrophobicContact CG2-CE2 3.73Å; T247-F352 HydrophobicContact CG2-CZ 3.61Å
248	S	97.1	Very high	96.2	Very high	79 Å²	79	53 Å²	53	55%	0.552	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-36.3	173.7	100.3	0	0	0	0	111.8	D246 N250	D246-S248 VanDerWaalsContact CG-OG 3.29Å; D246-S248 PolarHBondContact O-N 3.17Å; D246-S248 WeakPolarHBondContact OD1-CB 3.22Å; D246-S248 PolarHBondContact OD1-N 2.68Å; D246-S248 PolarHBondContact OD1-OG 3.14Å; D246-S248 VanDerWaalsContact OD1-OG 3.13Å; D246-S248 WeakPolarHBondContact OD2-CB 3.35Å; D246-S248 PolarHBondContact OD2-OG 3.02Å; S248-N250 PolarHBondContact O-N 3.25Å
249	W	97.9	Very high	96.3	Very high	51 Å²	51	49.6 Å²	49.6	19%	0.193	27%	0.272	C	S	.	.	S	Bend	trans	-62.2	122	179.7	-173.1	45.1	0	0	0	111	Y219 F232 L235 A236 D246 A251 I252 R253	Y219-W249 HydrophobicContact CD2-CH2 4.03Å; Y219-W249 HydrophobicContact CD2-CZ2 4.08Å; Y219-W249 HydrophobicContact CG-CH2 4.38Å; F232-W249 AromaticContact CD2-CH2 3.68Å; F232-W249 HydrophobicContact CD2-CH2 3.68Å; F232-W249 AromaticContact CD2-CZ3 3.96Å; F232-W249 HydrophobicContact CD2-CZ3 3.96Å; F232-W249 AromaticContact CE2-CH2 3.89Å; F232-W249 HydrophobicContact CE2-CH2 3.89Å; F232-W249 AromaticContact CE2-CZ3 3.83Å; F232-W249 HydrophobicContact CE2-CZ3 3.83Å; L235-W249 VanDerWaalsContact C-CE3 3.44Å; L235-W249 HydrophobicContact CB-CD2 3.85Å; L235-W249 HydrophobicContact CB-CE3 3.85Å; L235-W249 HydrophobicContact CB-CH2 3.64Å; L235-W249 HydrophobicContact CB-CZ2 3.64Å; L235-W249 HydrophobicContact CB-CZ3 3.75Å; L235-W249 HydrophobicContact CD1-CH2 4.2Å; L235-W249 HydrophobicContact CD1-CZ2 3.66Å; L235-W249 HydrophobicContact CG-CZ2 4.29Å; A236-W249 HydrophobicContact CB-CZ3 4.18Å; D246-W249 PolarHBondContact O-N 3.06Å; D246-W249 PolarHBondContact OD2-N 3.01Å; W249-A251 HydrophobicContact CD2-CB 3.6Å; W249-A251 VanDerWaalsContact CE2-CB 3.46Å; W249-A251 HydrophobicContact CE3-CB 3.73Å; W249-A251 HydrophobicContact CG-CB 4.38Å; W249-A251 HydrophobicContact CH2-CB 3.66Å; W249-A251 HydrophobicContact CZ2-CB 3.49Å; W249-A251 VanDerWaalsContact CZ2-CB 3.49Å; W249-A251 HydrophobicContact CZ3-CB 3.77Å; W249-A251 PolarHBondContact O-N 2.97Å; W249-I252 HydrophobicContact CE3-CD1 4.25Å; W249-I252 HydrophobicContact CE3-CG1 3.92Å; W249-I252 PolarHBondContact O-N 2.66Å; W249-R253 PolarHBondContact O-N 3.05Å
250	N	96.6	Very high	96.6	Very high	85 Å²	85	47.7 Å²	47.7	46%	0.455	26%	0.261	S	S	.	.	H	α-helix	trans	-61.9	-17.4	-177	-75.8	-44.9	0	0	0	113.7	S248 R253 I254	S248-N250 PolarHBondContact O-N 3.25Å; N250-R253 PolarHBondContact OD1-NE 2.58Å; N250-R253 PolarHBondContact OD1-NH2 3.43Å; N250-I254 VanDerWaalsContact O-CD1 3.25Å; N250-I254 WeakPolarHBondContact O-CD1 3.35Å; N250-I254 WeakPolarHBondContact O-CG1 3.5Å; N250-I254 PolarHBondContact O-N 3.2Å
251	A	97.4	Very high	97	Very high	7 Å²	7	44.1 Å²	44.1	6%	0.058	25%	0.248	C	C	.	.	H	α-helix	trans	-74.7	-29.2	172.3	0	0	0	0	0	112.6	R214 A215 D218 W249	R214-A251 PolarHBondContact NH2-O 3.46Å; A215-A251 VanDerWaalsContact CB-O 3.22Å; A215-A251 WeakPolarHBondContact CB-O 3.23Å; D218-A251 HydrophobicContact CB-CB 4.43Å; W249-A251 HydrophobicContact CD2-CB 3.6Å; W249-A251 VanDerWaalsContact CE2-CB 3.46Å; W249-A251 HydrophobicContact CE3-CB 3.73Å; W249-A251 HydrophobicContact CG-CB 4.38Å; W249-A251 HydrophobicContact CH2-CB 3.66Å; W249-A251 HydrophobicContact CZ2-CB 3.49Å; W249-A251 VanDerWaalsContact CZ2-CB 3.49Å; W249-A251 HydrophobicContact CZ3-CB 3.77Å; W249-A251 PolarHBondContact O-N 2.97Å
252	I	98.5	Very high	97.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-78.1	-54.1	167.4	-57.2	-53.4	0	0	0	110.3	A236 V245 D246 W249 I254 G255 L349 F352 Y353	A236-I252 HydrophobicContact CB-CD1 4.41Å; V245-I252 HydrophobicContact CG1-CB 4.43Å; V245-I252 HydrophobicContact CG1-CD1 4.19Å; V245-I252 HydrophobicContact CG1-CG1 3.93Å; V245-I252 HydrophobicContact CG1-CG2 3.72Å; D246-I252 WeakPolarHBondContact O-CB 3.49Å; D246-I252 WeakPolarHBondContact O-CG1 3.44Å; W249-I252 HydrophobicContact CE3-CD1 4.25Å; W249-I252 HydrophobicContact CE3-CG1 3.92Å; W249-I252 PolarHBondContact O-N 2.66Å; I252-I254 PolarHBondContact O-N 3.36Å; I252-G255 WeakPolarHBondContact O-CA 3.32Å; I252-G255 PolarHBondContact O-N 3.32Å; I252-L349 HydrophobicContact CD1-CD2 3.82Å; I252-F352 HydrophobicContact CG2-CD1 4.47Å; I252-F352 HydrophobicContact CG2-CE1 3.59Å; I252-F352 HydrophobicContact CG2-CZ 3.98Å; I252-Y353 WeakPolarHBondContact CA-OH 2.9Å; I252-Y353 HydrophobicContact CG2-CE1 4.49Å; I252-Y353 PolarHBondContact O-OH 3.03Å; I252-Y353 VanDerWaalsContact O-OH 3.13Å
253	R	98.4	Very high	97.7	Very high	113 Å²	113	37.8 Å²	37.8	43%	0.426	20%	0.203	S	C	.	.	H	α-helix	trans	-57.7	-31.4	-168.3	-160.2	165.7	61.6	107.2	1.8	114.8	T247 W249 N250 G255 M256 H260	T247-R253 WeakPolarHBondContact O-CB 3.45Å; T247-R253 WeakPolarHBondContact O-CD 3.37Å; W249-R253 PolarHBondContact O-N 3.05Å; N250-R253 PolarHBondContact OD1-NE 2.58Å; N250-R253 PolarHBondContact OD1-NH2 3.43Å; R253-G255 VanDerWaalsContact C-N 3.29Å; R253-G255 PolarHBondContact O-N 2.9Å; R253-M256 HydrophobicContact CB-CE 4.37Å; R253-M256 HydrophobicContact CG-CE 3.87Å; R253-H260 PolarHBondContact O-NE2 3.13Å
254	I	98.6	Very high	98.1	Very high	11 Å²	11	36.3 Å²	36.3	6%	0.056	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-24.4	176	-66.2	170.9	0	0	0	112.5	K127 V187 N250 I252 Y257	K127-I254 HydrophobicContact CB-CD1 4.41Å; K127-I254 HydrophobicContact CB-CG2 4.41Å; K127-I254 HydrophobicContact CD-CD1 3.71Å; V187-I254 HydrophobicContact CG1-CG1 4.15Å; V187-I254 HydrophobicContact CG1-CG2 4.34Å; V187-I254 HydrophobicContact CG2-CG1 4.37Å; N250-I254 VanDerWaalsContact O-CD1 3.25Å; N250-I254 WeakPolarHBondContact O-CD1 3.35Å; N250-I254 WeakPolarHBondContact O-CG1 3.5Å; N250-I254 PolarHBondContact O-N 3.2Å; I252-I254 PolarHBondContact O-N 3.36Å; I254-Y257 VanDerWaalsContact O-CD1 3.26Å; I254-Y257 WeakPolarHBondContact O-CD1 2.98Å; I254-Y257 WeakPolarHBondContact O-CE1 3.43Å
255	G	98.6	Very high	98.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-19.8	179.9	0	0	0	0	0	115	I252 R253 Y257	I252-G255 WeakPolarHBondContact O-CA 3.32Å; I252-G255 PolarHBondContact O-N 3.32Å; R253-G255 VanDerWaalsContact C-N 3.29Å; R253-G255 PolarHBondContact O-N 2.9Å; G255-Y257 PolarHBondContact O-N 3.36Å
256	M	98.7	Very high	98.3	Very high	11 Å²	11	40.1 Å²	40.1	5%	0.054	20%	0.203	C	C	.	.			trans	-77.2	65.1	177.9	-60.3	-170	-73	0	0	111	T247 R253 I258 L259 H260 F352 Y353 F356	T247-M256 HydrophobicContact CG2-CE 4.42Å; T247-M256 HydrophobicContact CG2-SD 4.48Å; R253-M256 HydrophobicContact CB-CE 4.37Å; R253-M256 HydrophobicContact CG-CE 3.87Å; M256-I258 VanDerWaalsContact C-N 3.3Å; M256-I258 PolarHBondContact O-N 2.82Å; M256-I258 VanDerWaalsContact O-N 3.16Å; M256-L259 HydrophobicContact CB-CD1 3.82Å; M256-L259 HydrophobicContact CB-CG 4.18Å; M256-L259 HydrophobicContact CE-CD1 3.81Å; M256-L259 HydrophobicContact CG-CD1 4.43Å; M256-L259 PolarHBondContact O-N 3.49Å; M256-L259 VanDerWaalsContact O-N 3.17Å; M256-L259 HydrophobicContact SD-CD1 3.77Å; M256-H260 PolarHBondContact O-CD2 3.05Å; M256-H260 VanDerWaalsContact O-CD2 3.27Å; M256-F352 HydrophobicContact CG-CE1 4.29Å; M256-F352 HydrophobicContact CG-CZ 4.33Å; M256-F352 HydrophobicContact SD-CE1 4.31Å; M256-F352 HydrophobicContact SD-CZ 3.76Å; M256-Y353 HydrophobicContact CG-CD1 4.45Å; M256-Y353 HydrophobicContact CG-CE1 4.14Å; M256-F356 HydrophobicContact CB-CD1 4.3Å; M256-F356 HydrophobicContact CB-CG 4.41Å; M256-F356 HydrophobicContact CG-CD1 4.43Å; M256-F356 HydrophobicContact CG-CD2 4.29Å; M256-F356 HydrophobicContact CG-CE2 4.37Å; M256-F356 HydrophobicContact CG-CG 4.32Å; M256-F356 HydrophobicContact CG-CZ 4.49Å; M256-F356 HydrophobicContact SD-CD1 4.42Å; M256-F356 HydrophobicContact SD-CD2 4.44Å; M256-F356 HydrophobicContact SD-CE1 3.93Å; M256-F356 HydrophobicContact SD-CE2 3.95Å; M256-F356 HydrophobicContact SD-CZ 3.67Å
257	Y	98.9	Very high	98.3	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.008	21%	0.214	C	C	.	.	H	α-helix	trans	-57.3	-35.6	-163.7	-58.8	-41.3	0	0	0	114.9	V126 F186 V208 R209 P211 R214 I254 G255 L259 H260 L261 W370	V126-Y257 HydrophobicContact CB-CE1 4.17Å; V126-Y257 HydrophobicContact CG1-CD1 3.99Å; V126-Y257 HydrophobicContact CG1-CE1 3.78Å; V126-Y257 HydrophobicContact CG2-CE1 3.84Å; F186-Y257 HydrophobicContact CE1-CD1 4.18Å; V208-Y257 HydrophobicContact CB-CD2 4.47Å; V208-Y257 HydrophobicContact CB-CE2 4.13Å; V208-Y257 HydrophobicContact CG1-CD2 4.19Å; V208-Y257 HydrophobicContact CG1-CE2 4.26Å; V208-Y257 HydrophobicContact CG1-CG 4.47Å; R209-Y257 VanDerWaalsContact O-CE2 3.26Å; R209-Y257 WeakPolarHBondContact O-CE2 3.28Å; R209-Y257 PolarHBondContact O-OH 3.1Å; P211-Y257 HydrophobicContact CG-CD2 4.4Å; P211-Y257 HydrophobicContact CG-CE2 3.83Å; R214-Y257 VanDerWaalsContact CD-OH 3.28Å; R214-Y257 WeakPolarHBondContact CD-OH 3.43Å; I254-Y257 VanDerWaalsContact O-CD1 3.26Å; I254-Y257 WeakPolarHBondContact O-CD1 2.98Å; I254-Y257 WeakPolarHBondContact O-CE1 3.43Å; G255-Y257 PolarHBondContact O-N 3.36Å; Y257-L259 PolarHBondContact O-N 3.17Å; Y257-H260 PolarHBondContact O-N 3.2Å; Y257-L261 WeakPolarHBondContact O-CB 3.44Å; Y257-L261 PolarHBondContact O-N 3.09Å; Y257-W370 AromaticContact CD2-CH2 3.74Å; Y257-W370 HydrophobicContact CD2-CH2 3.74Å; Y257-W370 AromaticContact CD2-CZ3 3.71Å; Y257-W370 HydrophobicContact CD2-CZ3 3.71Å; Y257-W370 AromaticContact CE2-CH2 3.5Å; Y257-W370 HydrophobicContact CE2-CH2 3.5Å; Y257-W370 HydrophobicContact CE2-CZ2 4.32Å; Y257-W370 AromaticContact CE2-CZ3 3.64Å; Y257-W370 HydrophobicContact CE2-CZ3 3.64Å
258	I	98.8	Very high	98.4	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.01	20%	0.198	C	C	.	.	H	α-helix	trans	-60.6	-40.8	179.8	-174.4	56.4	0	0	0	112.8	M256 H260 L261 E262 F356 K359 F360 T363	M256-I258 VanDerWaalsContact C-N 3.3Å; M256-I258 PolarHBondContact O-N 2.82Å; M256-I258 VanDerWaalsContact O-N 3.16Å; I258-H260 PolarHBondContact O-N 3.24Å; I258-L261 HydrophobicContact CD1-CD2 4.28Å; I258-L261 PolarHBondContact O-N 2.91Å; I258-L261 VanDerWaalsContact O-N 3.1Å; I258-E262 HydrophobicContact CD1-CG 4.2Å; I258-E262 HydrophobicContact CG1-CG 4.38Å; I258-E262 WeakPolarHBondContact O-CG 3.41Å; I258-E262 PolarHBondContact O-N 2.93Å; I258-F356 HydrophobicContact CG2-CB 4.06Å; I258-F356 HydrophobicContact CG2-CD1 3.97Å; I258-K359 HydrophobicContact CD1-CG 4.43Å; I258-K359 HydrophobicContact CG1-CB 4.31Å; I258-K359 HydrophobicContact CG1-CD 3.86Å; I258-K359 HydrophobicContact CG1-CG 3.94Å; I258-F360 HydrophobicContact CB-CB 4.19Å; I258-T363 HydrophobicContact CD1-CG2 3.92Å; I258-T363 WeakPolarHBondContact CD1-OG1 3.09Å
259	L	98.4	Very high	98.4	Very high	80 Å²	80	44.3 Å²	44.3	42%	0.419	20%	0.199	S	C	.	.	H	α-helix	trans	-64.1	-27.8	-179.4	-56.3	-178.6	0	0	0	112.6	M256 Y257 F356	M256-L259 HydrophobicContact CB-CD1 3.82Å; M256-L259 HydrophobicContact CB-CG 4.18Å; M256-L259 HydrophobicContact CE-CD1 3.81Å; M256-L259 HydrophobicContact CG-CD1 4.43Å; M256-L259 PolarHBondContact O-N 3.49Å; M256-L259 VanDerWaalsContact O-N 3.17Å; M256-L259 HydrophobicContact SD-CD1 3.77Å; Y257-L259 PolarHBondContact O-N 3.17Å; L259-F356 HydrophobicContact CD1-CD1 4.38Å; L259-F356 HydrophobicContact CD1-CE1 3.96Å; L259-F356 HydrophobicContact CD2-CD1 4.47Å; L259-F356 HydrophobicContact CD2-CE1 4.29Å; L259-F356 HydrophobicContact CG-CD1 4.25Å; L259-F356 HydrophobicContact CG-CE1 4.22Å
260	H	98.8	Very high	98.4	Very high	23 Å²	23	45 Å²	45	11%	0.106	21%	0.207	C	C	.	.	H	α-helix	trans	-82.6	-42.8	173.4	-57.7	-71.9	0	0	0	110.6	F186 R253 M256 Y257 I258 E262 N263 W264	F186-H260 HydrophobicContact CD1-CB 3.94Å; F186-H260 HydrophobicContact CE1-CB 3.51Å; F186-H260 HydrophobicContact CZ-CB 3.84Å; R253-H260 PolarHBondContact O-NE2 3.13Å; M256-H260 PolarHBondContact O-CD2 3.05Å; M256-H260 VanDerWaalsContact O-CD2 3.27Å; Y257-H260 PolarHBondContact O-N 3.2Å; I258-H260 PolarHBondContact O-N 3.24Å; H260-E262 VanDerWaalsContact C-N 3.29Å; H260-E262 PolarHBondContact O-N 2.93Å; H260-N263 WeakPolarHBondContact O-CB 3.35Å; H260-N263 PolarHBondContact O-N 3.43Å; H260-W264 VanDerWaalsContact O-CD1 3.25Å; H260-W264 PolarHBondContact O-N 3.45Å
261	L	98.9	Very high	98.5	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-58.6	-38.1	178.4	179.6	59.8	0	0	0	112.5	Y257 I258 N263 W264 L265 M273 F275 F360 T363 V364	Y257-L261 WeakPolarHBondContact O-CB 3.44Å; Y257-L261 PolarHBondContact O-N 3.09Å; I258-L261 HydrophobicContact CD1-CD2 4.28Å; I258-L261 PolarHBondContact O-N 2.91Å; I258-L261 VanDerWaalsContact O-N 3.1Å; L261-N263 PolarHBondContact O-N 3.16Å; L261-W264 HydrophobicContact CD1-CB 4.41Å; L261-W264 WeakPolarHBondContact O-CA 3.49Å; L261-W264 WeakPolarHBondContact O-CB 3.49Å; L261-W264 PolarHBondContact O-N 2.94Å; L261-L265 HydrophobicContact CD1-CD1 4.21Å; L261-L265 HydrophobicContact CD1-CD2 4.23Å; L261-L265 HydrophobicContact CD1-CG 3.91Å; L261-L265 HydrophobicContact CD2-CD1 4.35Å; L261-L265 HydrophobicContact CG-CD1 3.85Å; L261-L265 HydrophobicContact CG-CG 4.04Å; L261-L265 WeakPolarHBondContact O-CG 3.01Å; L261-L265 PolarHBondContact O-N 3.18Å; L261-M273 HydrophobicContact CD1-CE 3.87Å; L261-M273 HydrophobicContact CD1-SD 3.82Å; L261-F275 HydrophobicContact CD1-CE1 4.21Å; L261-F275 HydrophobicContact CD1-CZ 3.74Å; L261-F275 HydrophobicContact CD2-CZ 4.31Å; L261-F360 HydrophobicContact CD2-CD2 3.97Å; L261-F360 HydrophobicContact CD2-CE2 3.97Å; L261-T363 HydrophobicContact CD2-CG2 3.71Å; L261-T363 HydrophobicContact CG-CG2 4.47Å; L261-V364 HydrophobicContact CD2-CG1 3.51Å
262	E	98.6	Very high	98.6	Very high	70 Å²	70	46 Å²	46	33%	0.327	22%	0.217	S	C	.	.	H	α-helix	trans	-57.9	-26.3	173.8	-73.8	167.9	168.8	0	0	113.2	I258 H260 Q266 K359	I258-E262 HydrophobicContact CD1-CG 4.2Å; I258-E262 HydrophobicContact CG1-CG 4.38Å; I258-E262 WeakPolarHBondContact O-CG 3.41Å; I258-E262 PolarHBondContact O-N 2.93Å; H260-E262 VanDerWaalsContact C-N 3.29Å; H260-E262 PolarHBondContact O-N 2.93Å; E262-Q266 PolarHBondContact O-NE2 2.9Å; E262-K359 IonicContact OE1-NZ 3.81Å; E262-K359 PolarHBondContact OE1-NZ 3.07Å
263	N	98.6	Very high	98.6	Very high	34 Å²	34	46.5 Å²	46.5	18%	0.182	22%	0.22	C	C	.	.	H	α-helix	trans	-82.9	-25.9	172.2	-169.4	64.1	0	0	0	113	R189 H260 L261 Y267	R189-N263 PolarHBondContact O-ND2 3.35Å; H260-N263 WeakPolarHBondContact O-CB 3.35Å; H260-N263 PolarHBondContact O-N 3.43Å; L261-N263 PolarHBondContact O-N 3.16Å; N263-Y267 WeakPolarHBondContact O-CD2 3.24Å
264	W	98.8	Very high	98.6	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-77	-41	173.8	-73.8	90.5	0	0	0	112.5	V124 Y185 F186 A191 P192 I195 L204 H260 L261 Q266 Y267 F268 M273	V124-W264 HydrophobicContact CB-CH2 3.87Å; V124-W264 HydrophobicContact CB-CZ2 4.03Å; V124-W264 HydrophobicContact CG1-CH2 3.73Å; V124-W264 HydrophobicContact CG1-CZ2 4.4Å; V124-W264 HydrophobicContact CG1-CZ3 4.28Å; V124-W264 HydrophobicContact CG2-CH2 4.05Å; V124-W264 HydrophobicContact CG2-CZ2 4.01Å; Y185-W264 WeakPolarHBondContact O-CZ2 3.39Å; F186-W264 AromaticContact CD2-CD1 3.85Å; F186-W264 AromaticContact CD2-NE1 3.44Å; F186-W264 AromaticContact CE2-CD1 3.88Å; F186-W264 AromaticContact CE2-NE1 3.96Å; F186-W264 PolarHBondContact O-NE1 3.11Å; A191-W264 HydrophobicContact CB-CH2 4.42Å; A191-W264 HydrophobicContact CB-CZ2 4.47Å; P192-W264 HydrophobicContact CB-CD2 4.11Å; P192-W264 HydrophobicContact CB-CE3 3.85Å; P192-W264 HydrophobicContact CB-CZ3 4.21Å; P192-W264 HydrophobicContact CG-CD2 3.59Å; P192-W264 HydrophobicContact CG-CE3 3.79Å; P192-W264 HydrophobicContact CG-CG 3.97Å; P192-W264 HydrophobicContact CG-CH2 4.31Å; P192-W264 HydrophobicContact CG-CZ2 4.1Å; P192-W264 HydrophobicContact CG-CZ3 4.16Å; I195-W264 HydrophobicContact CD1-CH2 3.53Å; I195-W264 HydrophobicContact CD1-CZ3 3.81Å; L204-W264 HydrophobicContact CD1-CD2 4.43Å; L204-W264 HydrophobicContact CD1-CE3 3.36Å; L204-W264 HydrophobicContact CD1-CZ3 3.47Å; L204-W264 VanDerWaalsContact CD1-CZ3 3.47Å; L204-W264 HydrophobicContact CD2-CZ3 4.19Å; L204-W264 HydrophobicContact CG-CZ3 4.47Å; H260-W264 VanDerWaalsContact O-CD1 3.25Å; H260-W264 PolarHBondContact O-N 3.45Å; L261-W264 HydrophobicContact CD1-CB 4.41Å; L261-W264 WeakPolarHBondContact O-CA 3.49Å; L261-W264 WeakPolarHBondContact O-CB 3.49Å; L261-W264 PolarHBondContact O-N 2.94Å; W264-Q266 PolarHBondContact O-N 2.9Å; W264-Y267 PolarHBondContact O-N 3.41Å; W264-F268 AromaticContact CE3-CD2 3.84Å; W264-F268 HydrophobicContact CE3-CD2 3.84Å; W264-F268 AromaticContact CE3-CE2 3.99Å; W264-F268 HydrophobicContact CE3-CE2 3.99Å; W264-F268 HydrophobicContact CZ3-CD2 4.32Å; W264-F268 HydrophobicContact CZ3-CE2 4.02Å; W264-F268 PolarHBondContact O-N 3.07Å; W264-M273 HydrophobicContact CB-CE 3.82Å; W264-M273 HydrophobicContact CB-SD 4.08Å; W264-M273 HydrophobicContact CD2-CE 4.29Å; W264-M273 HydrophobicContact CG-CE 3.99Å
265	L	98.6	Very high	98.6	Very high	65 Å²	65	42.1 Å²	42.1	34%	0.34	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-13.9	-176.9	-67.4	175.4	0	0	0	114	L261 Y267 L270 M273 T363	L261-L265 HydrophobicContact CD1-CD1 4.21Å; L261-L265 HydrophobicContact CD1-CD2 4.23Å; L261-L265 HydrophobicContact CD1-CG 3.91Å; L261-L265 HydrophobicContact CD2-CD1 4.35Å; L261-L265 HydrophobicContact CG-CD1 3.85Å; L261-L265 HydrophobicContact CG-CG 4.04Å; L261-L265 WeakPolarHBondContact O-CG 3.01Å; L261-L265 PolarHBondContact O-N 3.18Å; L265-Y267 PolarHBondContact O-N 2.85Å; L265-L270 HydrophobicContact CD2-CB 4.3Å; L265-L270 HydrophobicContact CD2-CD1 4.17Å; L265-M273 HydrophobicContact CD2-SD 4.28Å; L265-T363 HydrophobicContact CD1-CG2 3.7Å
266	Q	98.4	Very high	98.6	Very high	126 Å²	126	42.1 Å²	42.1	59%	0.589	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-19.3	168.7	-72.3	167.4	55.2	0	0	113.4	E262 W264	E262-Q266 PolarHBondContact O-NE2 2.9Å; W264-Q266 PolarHBondContact O-N 2.9Å
267	Y	98.6	Very high	98.6	Very high	90 Å²	90	42.1 Å²	42.1	35%	0.353	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-128.9	-14.5	-173.2	-58.4	-86.3	0	0	0	114.3	P192 H193 S196 N263 W264 L265	P192-Y267 HydrophobicContact CB-CD2 3.59Å; P192-Y267 HydrophobicContact CB-CE2 4.34Å; P192-Y267 HydrophobicContact CB-CG 4.1Å; H193-Y267 HydrophobicContact CB-CD1 4.1Å; H193-Y267 HydrophobicContact CB-CE1 3.64Å; H193-Y267 HydrophobicContact CB-CE2 4.36Å; H193-Y267 AromaticContact ND1-CE1 3.66Å; S196-Y267 PolarHBondContact OG-O 3.26Å; N263-Y267 WeakPolarHBondContact O-CD2 3.24Å; W264-Y267 PolarHBondContact O-N 3.41Å; L265-Y267 PolarHBondContact O-N 2.85Å
268	F	98.6	Very high	98.6	Very high	6 Å²	6	42.2 Å²	42.2	3%	0.026	21%	0.206	C	C	.	.	S	Bend	trans	-134.5	136.2	-178.5	-68.1	-85.3	0	0	0	111.6	P192 I195 L204 W264 M273	P192-F268 HydrophobicContact CB-CE2 4.35Å; P192-F268 WeakPolarHBondContact O-CE2 3.38Å; I195-F268 HydrophobicContact CB-CE2 4.44Å; I195-F268 HydrophobicContact CB-CZ 4.03Å; I195-F268 HydrophobicContact CG2-CE1 4.45Å; I195-F268 HydrophobicContact CG2-CE2 4.47Å; I195-F268 HydrophobicContact CG2-CZ 3.68Å; L204-F268 HydrophobicContact CD1-CB 4.18Å; L204-F268 HydrophobicContact CD1-CD1 3.76Å; L204-F268 HydrophobicContact CD1-CD2 3.67Å; L204-F268 HydrophobicContact CD1-CE1 4.06Å; L204-F268 HydrophobicContact CD1-CE2 3.96Å; L204-F268 HydrophobicContact CD1-CG 3.56Å; L204-F268 HydrophobicContact CD1-CZ 4.16Å; L204-F268 HydrophobicContact CD2-CE1 4.44Å; L204-F268 HydrophobicContact CG-CD1 4.24Å; L204-F268 HydrophobicContact CG-CE1 4.34Å; W264-F268 AromaticContact CE3-CD2 3.84Å; W264-F268 HydrophobicContact CE3-CD2 3.84Å; W264-F268 AromaticContact CE3-CE2 3.99Å; W264-F268 HydrophobicContact CE3-CE2 3.99Å; W264-F268 HydrophobicContact CZ3-CD2 4.32Å; W264-F268 HydrophobicContact CZ3-CE2 4.02Å; W264-F268 PolarHBondContact O-N 3.07Å; F268-M273 HydrophobicContact CB-CG 4.49Å; F268-M273 HydrophobicContact CB-SD 4.48Å
269	R	98.3	Very high	98.5	Very high	155 Å²	155	44.8 Å²	44.8	59%	0.585	22%	0.218	S	C	*	.			trans	-67.6	144.7	167.6	-65.1	171.6	-68.8	-176.7	-3.9	109.5	S271 Q272	R269-S271 PolarHBondContact O-N 2.98Å; R269-S271 VanDerWaalsContact O-N 3.14Å; R269-Q272 VanDerWaalsContact CZ-OE1 3.27Å; R269-Q272 WeakPolarHBondContact O-CB 3.4Å; R269-Q272 PolarHBondContact O-N 2.65Å
270	L	98.1	Very high	98.5	Very high	66 Å²	66	46.1 Å²	46.1	35%	0.346	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-55.6	-33.2	176.7	-170.5	72.8	0	0	0	112.4	L265 Q272 M273 F275 T363 V364	L265-L270 HydrophobicContact CD2-CB 4.3Å; L265-L270 HydrophobicContact CD2-CD1 4.17Å; L270-Q272 PolarHBondContact O-N 3.21Å; L270-Q272 VanDerWaalsContact O-N 3.16Å; L270-M273 PolarHBondContact O-N 3.32Å; L270-M273 VanDerWaalsContact O-O 3.05Å; L270-F275 HydrophobicContact CD1-CE2 3.78Å; L270-F275 HydrophobicContact CD1-CZ 4.3Å; L270-T363 WeakPolarHBondContact CD2-O 3.14Å; L270-V364 HydrophobicContact CD1-CG1 4.3Å
271	S	98.1	Very high	98.4	Very high	94 Å²	94	45.3 Å²	45.3	66%	0.657	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-65	-12.5	175	55.4	0	0	0	0	115	R269	R269-S271 PolarHBondContact O-N 2.98Å; R269-S271 VanDerWaalsContact O-N 3.14Å
272	Q	98.5	Very high	98.2	Very high	17 Å²	17	47.6 Å²	47.6	8%	0.079	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-96.7	5.8	171.1	-64.8	176.2	-119.3	0	0	112.5	H200 T202 L204 R269 L270 F295	H200-Q272 PolarHBondContact O-NE2 3.41Å; T202-Q272 PolarHBondContact O-NE2 3.2Å; L204-Q272 PolarHBondContact N-O 2.77Å; R269-Q272 VanDerWaalsContact CZ-OE1 3.27Å; R269-Q272 WeakPolarHBondContact O-CB 3.4Å; R269-Q272 PolarHBondContact O-N 2.65Å; L270-Q272 PolarHBondContact O-N 3.21Å; L270-Q272 VanDerWaalsContact O-N 3.16Å; Q272-F295 WeakPolarHBondContact O-CZ 3.46Å
273	M	98.8	Very high	98.1	Very high	11 Å²	11	49.9 Å²	49.9	5%	0.054	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	137.2	178.7	-54.7	-169.2	73.8	0	0	110.2	L204 V206 L261 W264 L265 F268 L270 F275	L204-M273 HydrophobicContact CB-CG 4.27Å; L204-M273 HydrophobicContact CD1-CE 4.14Å; L204-M273 HydrophobicContact CD1-CG 4.16Å; L204-M273 HydrophobicContact CD1-SD 4.5Å; L204-M273 CarbonylContact O-C 3.57Å; L204-M273 WeakPolarHBondContact O-CA 3.42Å; V206-M273 HydrophobicContact CG2-CE 4.03Å; L261-M273 HydrophobicContact CD1-CE 3.87Å; L261-M273 HydrophobicContact CD1-SD 3.82Å; W264-M273 HydrophobicContact CB-CE 3.82Å; W264-M273 HydrophobicContact CB-SD 4.08Å; W264-M273 HydrophobicContact CD2-CE 4.29Å; W264-M273 HydrophobicContact CG-CE 3.99Å; L265-M273 HydrophobicContact CD2-SD 4.28Å; F268-M273 HydrophobicContact CB-CG 4.49Å; F268-M273 HydrophobicContact CB-SD 4.48Å; L270-M273 PolarHBondContact O-N 3.32Å; L270-M273 VanDerWaalsContact O-O 3.05Å; M273-F275 HydrophobicContact CB-CE2 3.71Å; M273-F275 HydrophobicContact CB-CZ 3.85Å; M273-F275 HydrophobicContact CE-CE1 4.45Å; M273-F275 HydrophobicContact CE-CZ 4.02Å; M273-F275 HydrophobicContact SD-CZ 4.24Å
274	H	98.8	Very high	98	Very high	24 Å²	24	50.6 Å²	50.6	11%	0.111	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	125	175	-176.4	54.3	0	0	0	111.6	L204 I205 V206 F295	L204-H274 PolarHBondContact O-N 3.41Å; I205-H274 WeakPolarHBondContact CA-O 3.44Å; V206-H274 PolarHBondContact N-O 2.8Å; H274-F295 HydrophobicContact CB-CB 4.22Å; H274-F295 HydrophobicContact CB-CD1 3.43Å; H274-F295 VanDerWaalsContact CB-CD1 3.43Å; H274-F295 HydrophobicContact CB-CD2 3.71Å; H274-F295 HydrophobicContact CB-CE1 3.55Å; H274-F295 HydrophobicContact CB-CE2 3.82Å; H274-F295 HydrophobicContact CB-CG 3.49Å; H274-F295 VanDerWaalsContact CB-CG 3.49Å; H274-F295 HydrophobicContact CB-CZ 3.73Å; H274-F295 AromaticContact CG-CG 3.88Å
275	F	98.9	Very high	98	Very high	9 Å²	9	51.3 Å²	51.3	4%	0.039	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	104.2	-173.6	-59.4	-86.8	0	0	0	110.2	V206 L261 L270 M273 F360 V364 F368	V206-F275 HydrophobicContact CB-CD1 3.74Å; V206-F275 HydrophobicContact CB-CE1 3.91Å; V206-F275 HydrophobicContact CG1-CD1 4.25Å; V206-F275 HydrophobicContact CG1-CE1 4.37Å; V206-F275 HydrophobicContact CG2-CD1 4.22Å; V206-F275 HydrophobicContact CG2-CE1 3.89Å; V206-F275 CarbonylContact O-C 3.56Å; V206-F275 VanDerWaalsContact O-CA 3.31Å; V206-F275 WeakPolarHBondContact O-CA 3.36Å; L261-F275 HydrophobicContact CD1-CE1 4.21Å; L261-F275 HydrophobicContact CD1-CZ 3.74Å; L261-F275 HydrophobicContact CD2-CZ 4.31Å; L270-F275 HydrophobicContact CD1-CE2 3.78Å; L270-F275 HydrophobicContact CD1-CZ 4.3Å; M273-F275 HydrophobicContact CB-CE2 3.71Å; M273-F275 HydrophobicContact CB-CZ 3.85Å; M273-F275 HydrophobicContact CE-CE1 4.45Å; M273-F275 HydrophobicContact CE-CZ 4.02Å; M273-F275 HydrophobicContact SD-CZ 4.24Å; F275-F360 HydrophobicContact CD1-CE2 4.09Å; F275-F360 AromaticContact CD1-CZ 3.69Å; F275-F360 HydrophobicContact CD1-CZ 3.69Å; F275-F360 HydrophobicContact CE1-CE2 4.01Å; F275-F360 HydrophobicContact CE1-CZ 4.1Å; F275-F360 HydrophobicContact CG-CZ 4.34Å; F275-V364 HydrophobicContact CD1-CG1 4.27Å; F275-V364 HydrophobicContact CD2-CB 3.87Å; F275-V364 HydrophobicContact CD2-CG1 3.83Å; F275-V364 HydrophobicContact CE1-CG1 4.03Å; F275-V364 HydrophobicContact CE2-CB 3.99Å; F275-V364 HydrophobicContact CE2-CG1 3.58Å; F275-V364 HydrophobicContact CG-CB 4.38Å; F275-V364 HydrophobicContact CG-CG1 4.18Å; F275-V364 HydrophobicContact CZ-CG1 3.69Å; F275-F368 HydrophobicContact CB-CE1 4.46Å; F275-F368 HydrophobicContact CB-CE2 4.47Å; F275-F368 HydrophobicContact CB-CZ 3.65Å
276	V	98.8	Very high	98	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	127.6	-177.4	175.1	0	0	0	0	108.8	V134 I205 V206 V207 V208 G278 L281 E288 V292	V134-V276 HydrophobicContact CG2-CG1 4Å; I205-V276 HydrophobicContact CG2-CG2 3.89Å; V206-V276 PolarHBondContact O-N 3.36Å; V207-V276 WeakPolarHBondContact CA-O 3.41Å; V207-V276 HydrophobicContact CB-CB 4.36Å; V207-V276 HydrophobicContact CG1-CB 4.17Å; V207-V276 HydrophobicContact CG1-CG1 4.01Å; V207-V276 HydrophobicContact CG2-CB 4.14Å; V207-V276 HydrophobicContact CG2-CG1 4.45Å; V208-V276 WeakPolarHBondContact CG2-O 3.34Å; V208-V276 PolarHBondContact N-O 2.84Å; V276-G278 PolarHBondContact O-N 3.26Å; V276-L281 HydrophobicContact CG1-CD2 4.46Å; V276-E288 HydrophobicContact CG1-CB 4.38Å; V276-E288 HydrophobicContact CG1-CG 4.32Å; V276-E288 WeakPolarHBondContact CG1-OE2 3.47Å; V276-V292 HydrophobicContact CG2-CG2 3.6Å
277	S	98.6	Very high	98	Very high	10 Å²	10	44.1 Å²	44.1	7%	0.07	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	116.9	175.3	170.5	0	0	0	0	110.2	E279 R280 L281 E288	S277-E279 VanDerWaalsContact C-N 3.28Å; S277-E279 PolarHBondContact O-N 2.97Å; S277-E279 PolarHBondContact OG-N 3.03Å; S277-R280 PolarHBondContact O-N 3.11Å; S277-R280 PolarHBondContact OG-N 3.22Å; S277-L281 VanDerWaalsContact O-CB 3.25Å; S277-L281 WeakPolarHBondContact O-CB 3.44Å; S277-L281 PolarHBondContact O-N 2.75Å; S277-E288 PolarHBondContact N-OE2 2.95Å
278	G	97.9	Very high	97.9	Very high	4 Å²	4	39.9 Å²	39.9	4%	0.041	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-31.7	175.3	0	0	0	0	0	112.9	V208 V276 I282	V208-G278 VanDerWaalsContact O-CA 3.23Å; V208-G278 WeakPolarHBondContact O-CA 3.32Å; V208-G278 PolarHBondContact O-N 3.45Å; V276-G278 PolarHBondContact O-N 3.26Å; G278-I282 WeakPolarHBondContact O-CD1 3.27Å; G278-I282 WeakPolarHBondContact O-CG1 3.49Å
279	E	97.5	Very high	97.9	Very high	56 Å²	56	39.6 Å²	39.6	26%	0.262	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-53.8	171.8	-67.5	66.5	-144.4	0	0	110.7	R209 N210 S277 L281 I282 T283 W370	R209-E279 WeakPolarHBondContact CA-OE1 3.37Å; R209-E279 WeakPolarHBondContact CG-OE1 3.28Å; N210-E279 PolarHBondContact N-OE1 3.35Å; S277-E279 VanDerWaalsContact C-N 3.28Å; S277-E279 PolarHBondContact O-N 2.97Å; S277-E279 PolarHBondContact OG-N 3.03Å; E279-L281 VanDerWaalsContact C-N 3.28Å; E279-L281 PolarHBondContact O-N 3.42Å; E279-I282 WeakPolarHBondContact O-CB 3.42Å; E279-I282 PolarHBondContact O-N 2.94Å; E279-T283 PolarHBondContact O-N 3.36Å; E279-W370 PolarHBondContact OE2-NE1 3.42Å
280	R	97.6	Very high	98	Very high	108 Å²	108	32.5 Å²	32.5	41%	0.408	18%	0.184	S	C	.	.	H	α-helix	trans	-69.3	-26	-178.8	-167.6	172.7	168.9	173.2	3.4	112.5	S277 I282 T283 D284 E288 R291	S277-R280 PolarHBondContact O-N 3.11Å; S277-R280 PolarHBondContact OG-N 3.22Å; R280-I282 PolarHBondContact O-N 3.2Å; R280-I282 VanDerWaalsContact O-N 3.17Å; R280-T283 WeakPolarHBondContact CA-OG1 3.48Å; R280-T283 PolarHBondContact O-N 2.87Å; R280-D284 HydrophobicContact CG-CB 3.87Å; R280-D284 IonicContact CZ-OD2 3.91Å; R280-D284 IonicContact NE-OD2 3.13Å; R280-D284 PolarHBondContact NE-OD2 3.14Å; R280-D284 IonicContact NH2-OD2 3.5Å; R280-D284 PolarHBondContact NH2-OD2 3.43Å; R280-D284 CarbonylContact O-C 3.53Å; R280-D284 WeakPolarHBondContact O-CA 3.37Å; R280-D284 PolarHBondContact O-N 3.04Å; R280-D284 VanDerWaalsContact O-O 3.13Å; R280-E288 HydrophobicContact CB-CG 3.94Å; R280-E288 WeakPolarHBondContact CB-OE1 3.45Å; R280-E288 WeakPolarHBondContact CD-OE1 3.49Å; R280-E288 HydrophobicContact CG-CG 4.02Å; R280-R291 VanDerWaalsContact CZ-NH2 3.28Å; R280-R291 VanDerWaalsContact NE-NH2 3.16Å
281	L	97.1	Very high	98	Very high	6 Å²	6	32.3 Å²	32.3	3%	0.031	18%	0.179	C	C	.	.	H	α-helix	trans	-64.3	-16.8	171.2	-170.6	66.6	0	0	0	112.9	A133 V134 F137 V207 V276 S277 E279 E288 M289	A133-L281 HydrophobicContact CB-CD2 3.9Å; V134-L281 HydrophobicContact CG2-CD1 4.13Å; V134-L281 HydrophobicContact CG2-CD2 3.4Å; V134-L281 HydrophobicContact CG2-CG 4.43Å; F137-L281 HydrophobicContact CD2-CD1 3.96Å; F137-L281 HydrophobicContact CE2-CD1 4Å; F137-L281 HydrophobicContact CE2-CG 4.3Å; V207-L281 HydrophobicContact CG1-CD2 4.21Å; V276-L281 HydrophobicContact CG1-CD2 4.46Å; S277-L281 VanDerWaalsContact O-CB 3.25Å; S277-L281 WeakPolarHBondContact O-CB 3.44Å; S277-L281 PolarHBondContact O-N 2.75Å; E279-L281 VanDerWaalsContact C-N 3.28Å; E279-L281 PolarHBondContact O-N 3.42Å; L281-E288 HydrophobicContact CB-CG 4.22Å; L281-E288 HydrophobicContact CD1-CB 3.97Å; L281-E288 HydrophobicContact CD1-CG 4.5Å; L281-M289 HydrophobicContact CD1-SD 4.18Å
282	I	95.3	Very high	98	Very high	49 Å²	49	27.9 Å²	27.9	25%	0.251	15%	0.147	S	C	.	.	H	α-helix	trans	-91	-42.3	174.4	-60.1	162.7	0	0	0	111	G278 E279 R280 F309 F315 P316	G278-I282 WeakPolarHBondContact O-CD1 3.27Å; G278-I282 WeakPolarHBondContact O-CG1 3.49Å; E279-I282 WeakPolarHBondContact O-CB 3.42Å; E279-I282 PolarHBondContact O-N 2.94Å; R280-I282 PolarHBondContact O-N 3.2Å; R280-I282 VanDerWaalsContact O-N 3.17Å; I282-F309 HydrophobicContact CG2-CE2 4.45Å; I282-F315 HydrophobicContact CD1-CD1 4.26Å; I282-F315 HydrophobicContact CD1-CE1 3.72Å; I282-F315 HydrophobicContact CG1-CD1 4.01Å; I282-F315 HydrophobicContact CG1-CE1 3.98Å; I282-F315 HydrophobicContact CG2-CD1 4.24Å; I282-P316 WeakPolarHBondContact O-CD 3.43Å
283	T	96.3	Very high	98	Very high	117 Å²	117	27 Å²	27	72%	0.718	14%	0.144	S	C	*	.	H	α-helix	trans	-89	-37.7	-174	54.6	0	0	0	0	113.9	E279 R280	E279-T283 PolarHBondContact O-N 3.36Å; R280-T283 WeakPolarHBondContact CA-OG1 3.48Å; R280-T283 PolarHBondContact O-N 2.87Å
284	D	97.6	Very high	98	Very high	50 Å²	50	30.1 Å²	30.1	27%	0.267	16%	0.16	S	C	.	.			trans	-135.5	68.3	179.2	171.9	29.7	0	0	0	110.3	R280 A286 G287 E288	R280-D284 HydrophobicContact CG-CB 3.87Å; R280-D284 IonicContact CZ-OD2 3.91Å; R280-D284 IonicContact NE-OD2 3.13Å; R280-D284 PolarHBondContact NE-OD2 3.14Å; R280-D284 IonicContact NH2-OD2 3.5Å; R280-D284 PolarHBondContact NH2-OD2 3.43Å; R280-D284 CarbonylContact O-C 3.53Å; R280-D284 WeakPolarHBondContact O-CA 3.37Å; R280-D284 PolarHBondContact O-N 3.04Å; R280-D284 VanDerWaalsContact O-O 3.13Å; D284-A286 PolarHBondContact O-N 3.44Å; D284-G287 PolarHBondContact O-N 3.23Å; D284-G287 WeakPolarHBondContact OD1-CA 3.33Å; D284-G287 PolarHBondContact OD1-N 2.87Å; D284-G287 WeakPolarHBondContact OD2-CA 3.32Å; D284-E288 PolarHBondContact O-N 3.28Å
285	P	97.6	Very high	98	Very high	14 Å²	14	30.7 Å²	30.7	9%	0.091	16%	0.162	C	C	.	.	H	α-helix	trans	-62.3	-27.3	177.5	25.9	-35.5	0	0	0	112.5	F137 M289 F307 P316	F137-P285 HydrophobicContact CE2-CB 4.02Å; P285-M289 VanDerWaalsContact O-CB 3.29Å; P285-M289 WeakPolarHBondContact O-CB 3.43Å; P285-M289 WeakPolarHBondContact O-CG 3.27Å; P285-M289 PolarHBondContact O-N 3.07Å; P285-F307 HydrophobicContact CB-CD1 3.95Å; P285-F307 HydrophobicContact CB-CD2 4.17Å; P285-F307 HydrophobicContact CB-CE1 3.97Å; P285-F307 HydrophobicContact CB-CE2 4.18Å; P285-F307 HydrophobicContact CB-CG 4.05Å; P285-F307 HydrophobicContact CB-CZ 4.09Å; P285-F307 HydrophobicContact CG-CB 4.03Å; P285-F307 HydrophobicContact CG-CD1 4.02Å; P285-F307 HydrophobicContact CG-CD2 4.01Å; P285-F307 HydrophobicContact CG-CG 3.74Å; P285-P316 HydrophobicContact CB-CB 4.5Å; P285-P316 HydrophobicContact CB-CG 4.46Å; P285-P316 HydrophobicContact CG-CB 3.96Å; P285-P316 HydrophobicContact CG-CG 4.28Å
286	A	97.8	Very high	98	Very high	22 Å²	22	30.7 Å²	30.7	18%	0.182	16%	0.163	C	C	.	.	H	α-helix	trans	-69.7	-45	178.9	0	0	0	0	0	111.7	D284 M289 G290 D304 F307	D284-A286 PolarHBondContact O-N 3.44Å; A286-M289 PolarHBondContact O-N 3.05Å; A286-G290 PolarHBondContact O-N 3.08Å; A286-D304 HydrophobicContact CB-CB 4.33Å; A286-F307 HydrophobicContact CB-CD2 4.24Å; A286-F307 HydrophobicContact CB-CE2 4.35Å
287	G	98.3	Very high	98	Very high	18 Å²	18	33.7 Å²	33.7	19%	0.186	19%	0.194	C	C	.	.	H	α-helix	trans	-69.2	-39.3	178	0	0	0	0	0	113.6	D284 G290 R291	D284-G287 PolarHBondContact O-N 3.23Å; D284-G287 WeakPolarHBondContact OD1-CA 3.33Å; D284-G287 PolarHBondContact OD1-N 2.87Å; D284-G287 WeakPolarHBondContact OD2-CA 3.32Å; G287-G290 PolarHBondContact O-N 3.01Å; G287-R291 VanDerWaalsContact O-CZ 3.22Å; G287-R291 PolarHBondContact O-N 3.17Å; G287-R291 PolarHBondContact O-NH1 3.06Å; G287-R291 PolarHBondContact O-NH2 3.13Å
288	E	98.4	Very high	97.9	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-61.7	-51	170.3	-77.6	-57.8	139.4	0	0	111.2	V276 S277 R280 L281 D284 G290 R291 V292	V276-E288 HydrophobicContact CG1-CB 4.38Å; V276-E288 HydrophobicContact CG1-CG 4.32Å; V276-E288 WeakPolarHBondContact CG1-OE2 3.47Å; S277-E288 PolarHBondContact N-OE2 2.95Å; R280-E288 HydrophobicContact CB-CG 3.94Å; R280-E288 WeakPolarHBondContact CB-OE1 3.45Å; R280-E288 WeakPolarHBondContact CD-OE1 3.49Å; R280-E288 HydrophobicContact CG-CG 4.02Å; L281-E288 HydrophobicContact CB-CG 4.22Å; L281-E288 HydrophobicContact CD1-CB 3.97Å; L281-E288 HydrophobicContact CD1-CG 4.5Å; D284-E288 PolarHBondContact O-N 3.28Å; E288-G290 PolarHBondContact O-N 2.76Å; E288-R291 PolarHBondContact O-N 3.4Å; E288-R291 VanDerWaalsContact O-N 3.08Å; E288-R291 IonicContact OE1-CZ 3.52Å; E288-R291 IonicContact OE1-NE 2.63Å; E288-R291 IonicContact OE1-NH2 2.73Å; E288-R291 PolarHBondContact OE1-NH2 3.01Å; E288-R291 IonicContact OE2-NE 3.58Å; E288-R291 IonicContact OE2-NH2 3.55Å; E288-V292 WeakPolarHBondContact O-CG2 3.26Å; E288-V292 PolarHBondContact O-N 3.09Å
289	M	98.6	Very high	97.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-66.2	-23.3	179.5	-66.1	-47.6	-51.1	0	0	113.1	V134 F137 I138 L281 P285 A286 V292 Q293 I302 F307	V134-M289 HydrophobicContact CG1-CE 4.28Å; V134-M289 HydrophobicContact CG1-SD 4.17Å; F137-M289 HydrophobicContact CB-CE 4.25Å; F137-M289 HydrophobicContact CB-CG 3.99Å; F137-M289 HydrophobicContact CB-SD 3.87Å; F137-M289 HydrophobicContact CD2-CG 4.08Å; F137-M289 HydrophobicContact CD2-SD 4.19Å; I138-M289 HydrophobicContact CB-CE 3.64Å; I138-M289 HydrophobicContact CD1-CE 3.7Å; I138-M289 HydrophobicContact CG1-CE 4.12Å; L281-M289 HydrophobicContact CD1-SD 4.18Å; P285-M289 VanDerWaalsContact O-CB 3.29Å; P285-M289 WeakPolarHBondContact O-CB 3.43Å; P285-M289 WeakPolarHBondContact O-CG 3.27Å; P285-M289 PolarHBondContact O-N 3.07Å; A286-M289 PolarHBondContact O-N 3.05Å; M289-V292 HydrophobicContact CE-CB 3.88Å; M289-V292 HydrophobicContact CE-CG1 3.88Å; M289-V292 HydrophobicContact CE-CG2 4.27Å; M289-V292 HydrophobicContact SD-CG2 4.34Å; M289-Q293 VanDerWaalsContact O-CG 3.28Å; M289-Q293 WeakPolarHBondContact O-CG 3.42Å; M289-Q293 PolarHBondContact O-N 2.92Å; M289-Q293 PolarHBondContact O-NE2 2.87Å; M289-I302 HydrophobicContact CB-CG2 3.89Å; M289-I302 HydrophobicContact CG-CG2 4.36Å; M289-F307 HydrophobicContact CG-CZ 4.01Å
290	G	98.6	Very high	97.9	Very high	6 Å²	6	46.4 Å²	46.4	6%	0.062	24%	0.242	C	C	.	.	H	α-helix	trans	-57.2	-54.3	166.7	0	0	0	0	0	112	A286 G287 E288 V292 Q293 D294	A286-G290 PolarHBondContact O-N 3.08Å; G287-G290 PolarHBondContact O-N 3.01Å; E288-G290 PolarHBondContact O-N 2.76Å; G290-V292 PolarHBondContact O-N 2.75Å; G290-Q293 PolarHBondContact O-N 2.61Å; G290-D294 VanDerWaalsContact O-CG 3.24Å; G290-D294 PolarHBondContact O-N 3.32Å; G290-D294 VanDerWaalsContact O-N 3.11Å
291	R	98.7	Very high	97.9	Very high	63 Å²	63	44.1 Å²	44.1	24%	0.238	24%	0.238	C	C	.	.	H	α-helix	trans	-61.8	-40	177.2	-73.6	179	-73.9	-72.2	4.2	112.8	R280 G287 E288 Q293 D294 F295	R280-R291 VanDerWaalsContact CZ-NH2 3.28Å; R280-R291 VanDerWaalsContact NE-NH2 3.16Å; G287-R291 VanDerWaalsContact O-CZ 3.22Å; G287-R291 PolarHBondContact O-N 3.17Å; G287-R291 PolarHBondContact O-NH1 3.06Å; G287-R291 PolarHBondContact O-NH2 3.13Å; E288-R291 PolarHBondContact O-N 3.4Å; E288-R291 VanDerWaalsContact O-N 3.08Å; E288-R291 IonicContact OE1-CZ 3.52Å; E288-R291 IonicContact OE1-NE 2.63Å; E288-R291 IonicContact OE1-NH2 2.73Å; E288-R291 PolarHBondContact OE1-NH2 3.01Å; E288-R291 IonicContact OE2-NE 3.58Å; E288-R291 IonicContact OE2-NH2 3.55Å; R291-Q293 VanDerWaalsContact C-N 3.31Å; R291-Q293 PolarHBondContact O-N 2.69Å; R291-D294 PolarHBondContact O-N 3Å; R291-F295 WeakPolarHBondContact O-CB 3.47Å; R291-F295 PolarHBondContact O-N 3.34Å
292	V	98.8	Very high	97.9	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.3	-38.4	176.5	178.3	0	0	0	0	111.6	V134 I138 I205 V276 E288 M289 G290 L296	V134-V292 HydrophobicContact CG1-CG1 4.43Å; V134-V292 HydrophobicContact CG1-CG2 4.43Å; I138-V292 HydrophobicContact CD1-CG1 4.08Å; I138-V292 HydrophobicContact CG1-CG1 4.35Å; I205-V292 HydrophobicContact CD1-CG1 3.95Å; V276-V292 HydrophobicContact CG2-CG2 3.6Å; E288-V292 WeakPolarHBondContact O-CG2 3.26Å; E288-V292 PolarHBondContact O-N 3.09Å; M289-V292 HydrophobicContact CE-CB 3.88Å; M289-V292 HydrophobicContact CE-CG1 3.88Å; M289-V292 HydrophobicContact CE-CG2 4.27Å; M289-V292 HydrophobicContact SD-CG2 4.34Å; G290-V292 PolarHBondContact O-N 2.75Å; V292-L296 HydrophobicContact CG1-CD1 4.03Å; V292-L296 WeakPolarHBondContact O-CB 3.35Å; V292-L296 VanDerWaalsContact O-CG 3.27Å; V292-L296 WeakPolarHBondContact O-CG 3.31Å; V292-L296 PolarHBondContact O-N 2.82Å; V292-L296 VanDerWaalsContact O-N 3.14Å
293	Q	98.8	Very high	98	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-65.2	-50.2	175.7	-73.5	164.6	115.7	0	0	111	I138 M289 G290 R291 F295 L296 G297 L298 K299 R300 I302	I138-Q293 HydrophobicContact CD1-CG 4.04Å; M289-Q293 VanDerWaalsContact O-CG 3.28Å; M289-Q293 WeakPolarHBondContact O-CG 3.42Å; M289-Q293 PolarHBondContact O-N 2.92Å; M289-Q293 PolarHBondContact O-NE2 2.87Å; G290-Q293 PolarHBondContact O-N 2.61Å; R291-Q293 VanDerWaalsContact C-N 3.31Å; R291-Q293 PolarHBondContact O-N 2.69Å; Q293-F295 PolarHBondContact O-N 3.26Å; Q293-L296 PolarHBondContact O-N 2.97Å; Q293-G297 PolarHBondContact O-N 3.5Å; Q293-L298 HydrophobicContact CB-CB 4.12Å; Q293-L298 HydrophobicContact CG-CB 4.41Å; Q293-L298 PolarHBondContact O-N 2.85Å; Q293-K299 PolarHBondContact OE1-O 2.85Å; Q293-R300 HydrophobicContact CB-CG 4.47Å; Q293-I302 PolarHBondContact NE2-O 3.06Å
294	D	98.7	Very high	98	Very high	75 Å²	75	43.2 Å²	43.2	40%	0.401	23%	0.231	S	C	.	.	H	α-helix	trans	-57.8	-48.6	179.4	-51.8	-29.2	0	0	0	111.7	G290 R291 L296 G297 R300	G290-D294 VanDerWaalsContact O-CG 3.24Å; G290-D294 PolarHBondContact O-N 3.32Å; G290-D294 VanDerWaalsContact O-N 3.11Å; R291-D294 PolarHBondContact O-N 3Å; D294-L296 VanDerWaalsContact C-N 3.31Å; D294-L296 PolarHBondContact O-N 3.36Å; D294-G297 PolarHBondContact O-N 3.08Å; D294-R300 WeakPolarHBondContact OD1-CG 3.11Å; D294-R300 IonicContact OD1-CZ 2.72Å; D294-R300 IonicContact OD1-NE 3.76Å; D294-R300 PolarHBondContact OD1-NE 2.82Å; D294-R300 IonicContact OD1-NH2 3.83Å; D294-R300 IonicContact OD2-CZ 2.75Å; D294-R300 IonicContact OD2-NE 3.63Å; D294-R300 PolarHBondContact OD2-NE 3.38Å; D294-R300 IonicContact OD2-NH2 3Å; D294-R300 PolarHBondContact OD2-NH2 3.38Å
295	F	98.7	Very high	97.8	Very high	36 Å²	36	48.5 Å²	48.5	16%	0.158	25%	0.251	C	S	.	.	H	α-helix	trans	-59.5	-40.5	179.3	169.4	-108	0	0	0	112.3	K203 L204 I205 Q272 H274 R291 Q293 G297	K203-F295 HydrophobicContact CB-CE1 3.86Å; K203-F295 HydrophobicContact CB-CZ 3.76Å; K203-F295 HydrophobicContact CD-CE1 4.4Å; K203-F295 HydrophobicContact CD-CZ 4.33Å; K203-F295 WeakPolarHBondContact CD-O 3.45Å; K203-F295 WeakPolarHBondContact CE-O 3.38Å; K203-F295 HydrophobicContact CG-CZ 4.2Å; K203-F295 PolarHBondContact NZ-O 3.26Å; L204-F295 WeakPolarHBondContact O-CE1 3.29Å; L204-F295 WeakPolarHBondContact O-CZ 3.37Å; I205-F295 HydrophobicContact CG1-CD1 4.16Å; I205-F295 HydrophobicContact CG1-CE1 3.83Å; Q272-F295 WeakPolarHBondContact O-CZ 3.46Å; H274-F295 HydrophobicContact CB-CB 4.22Å; H274-F295 HydrophobicContact CB-CD1 3.43Å; H274-F295 VanDerWaalsContact CB-CD1 3.43Å; H274-F295 HydrophobicContact CB-CD2 3.71Å; H274-F295 HydrophobicContact CB-CE1 3.55Å; H274-F295 HydrophobicContact CB-CE2 3.82Å; H274-F295 HydrophobicContact CB-CG 3.49Å; H274-F295 VanDerWaalsContact CB-CG 3.49Å; H274-F295 HydrophobicContact CB-CZ 3.73Å; H274-F295 AromaticContact CG-CG 3.88Å; R291-F295 WeakPolarHBondContact O-CB 3.47Å; R291-F295 PolarHBondContact O-N 3.34Å; Q293-F295 PolarHBondContact O-N 3.26Å; F295-G297 VanDerWaalsContact C-N 3.27Å; F295-G297 PolarHBondContact O-N 2.98Å
296	L	98.3	Very high	97.6	Very high	9 Å²	9	50.3 Å²	50.3	5%	0.047	26%	0.259	C	S	.	.	H	α-helix	trans	-69.8	-24.8	175.5	-72.4	175.9	0	0	0	112.4	A121 I138 I177 K203 I205 V292 Q293 D294 L298	A121-L296 HydrophobicContact CB-CD2 3.53Å; I138-L296 HydrophobicContact CD1-CD1 4.2Å; I138-L296 HydrophobicContact CG1-CD1 4.05Å; I177-L296 HydrophobicContact CD1-CB 3.87Å; K203-L296 VanDerWaalsContact NZ-C 3.33Å; K203-L296 PolarHBondContact NZ-O 3.28Å; I205-L296 HydrophobicContact CD1-CD1 4.41Å; I205-L296 HydrophobicContact CD1-CD2 4.26Å; I205-L296 HydrophobicContact CD1-CG 4.44Å; V292-L296 HydrophobicContact CG1-CD1 4.03Å; V292-L296 WeakPolarHBondContact O-CB 3.35Å; V292-L296 VanDerWaalsContact O-CG 3.27Å; V292-L296 WeakPolarHBondContact O-CG 3.31Å; V292-L296 PolarHBondContact O-N 2.82Å; V292-L296 VanDerWaalsContact O-N 3.14Å; Q293-L296 PolarHBondContact O-N 2.97Å; D294-L296 VanDerWaalsContact C-N 3.31Å; D294-L296 PolarHBondContact O-N 3.36Å; L296-L298 HydrophobicContact CB-CD1 3.87Å; L296-L298 HydrophobicContact CB-CG 3.91Å; L296-L298 HydrophobicContact CD1-CD1 3.83Å
297	G	97.9	Very high	97.5	Very high	63 Å²	63	50 Å²	50	65%	0.649	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.5	23.2	-172.9	0	0	0	0	0	112.9	Q293 D294 F295	Q293-G297 PolarHBondContact O-N 3.5Å; D294-G297 PolarHBondContact O-N 3.08Å; F295-G297 VanDerWaalsContact C-N 3.27Å; F295-G297 PolarHBondContact O-N 2.98Å
298	L	98	Very high	97.2	Very high	19 Å²	19	52.5 Å²	52.5	10%	0.099	26%	0.257	C	S	.	.			trans	-95.3	153.4	-177.5	-63	171.3	0	0	0	111.3	I138 D143 V144 I177 Q293 L296	I138-L298 HydrophobicContact CD1-CD1 4.09Å; D143-L298 HydrophobicContact CB-CD2 4.13Å; V144-L298 HydrophobicContact CG2-CD1 3.41Å; V144-L298 VanDerWaalsContact CG2-CD1 3.41Å; V144-L298 HydrophobicContact CG2-CD2 4.33Å; I177-L298 HydrophobicContact CD1-CD1 4.23Å; I177-L298 HydrophobicContact CD1-CD2 3.64Å; I177-L298 HydrophobicContact CD1-CG 3.84Å; I177-L298 HydrophobicContact CG1-CD2 4.16Å; Q293-L298 HydrophobicContact CB-CB 4.12Å; Q293-L298 HydrophobicContact CG-CB 4.41Å; Q293-L298 PolarHBondContact O-N 2.85Å; L296-L298 HydrophobicContact CB-CD1 3.87Å; L296-L298 HydrophobicContact CB-CG 3.91Å; L296-L298 HydrophobicContact CD1-CD1 3.83Å
299	K	97.9	Very high	96.9	Very high	165 Å²	165	57.8 Å²	57.8	72%	0.717	28%	0.281	S	S	*	.			trans	-64.2	138.6	168.9	-174	173.1	-178.6	174.6	0	109.5	H141 Q293 I301	H141-K299 PolarHBondContact CD2-O 3.21Å; H141-K299 PolarHBondContact NE2-O 3.49Å; Q293-K299 PolarHBondContact OE1-O 2.85Å; K299-I301 VanDerWaalsContact C-N 3.32Å; K299-I301 HydrophobicContact CB-CD1 4.41Å; K299-I301 HydrophobicContact CB-CG1 4.15Å; K299-I301 HydrophobicContact CD-CD1 4.41Å; K299-I301 HydrophobicContact CD-CG1 4.24Å; K299-I301 HydrophobicContact CG-CG1 4.02Å; K299-I301 PolarHBondContact O-N 3.04Å
300	R	97.9	Very high	96.4	Very high	154 Å²	154	59.6 Å²	59.6	58%	0.581	29%	0.29	S	S	*	.	S	Bend	trans	-69.7	85.9	171.9	-71.1	-176.5	174.2	-171.1	1.1	111	Q293 D294	Q293-R300 HydrophobicContact CB-CG 4.47Å; D294-R300 WeakPolarHBondContact OD1-CG 3.11Å; D294-R300 IonicContact OD1-CZ 2.72Å; D294-R300 IonicContact OD1-NE 3.76Å; D294-R300 PolarHBondContact OD1-NE 2.82Å; D294-R300 IonicContact OD1-NH2 3.83Å; D294-R300 IonicContact OD2-CZ 2.75Å; D294-R300 IonicContact OD2-NE 3.63Å; D294-R300 PolarHBondContact OD2-NE 3.38Å; D294-R300 IonicContact OD2-NH2 3Å; D294-R300 PolarHBondContact OD2-NH2 3.38Å
301	I	97.5	Very high	95.9	Very high	60 Å²	60	70.1 Å²	70.1	31%	0.308	33%	0.328	S	S	.	.			trans	-98.4	-42.5	175.6	-62.9	-178.5	0	0	0	110.3	P142 K299 T303 H306	P142-I301 HydrophobicContact CG-CD1 3.87Å; K299-I301 VanDerWaalsContact C-N 3.32Å; K299-I301 HydrophobicContact CB-CD1 4.41Å; K299-I301 HydrophobicContact CB-CG1 4.15Å; K299-I301 HydrophobicContact CD-CD1 4.41Å; K299-I301 HydrophobicContact CD-CG1 4.24Å; K299-I301 HydrophobicContact CG-CG1 4.02Å; K299-I301 PolarHBondContact O-N 3.04Å; I301-T303 PolarHBondContact O-N 3.38Å; I301-T303 PolarHBondContact O-OG1 3.18Å; I301-H306 PolarHBondContact O-CE1 3.05Å
302	I	96.9	Very high	95.1	Very high	3 Å²	3	74 Å²	74	2%	0.015	36%	0.359	C	S	.	.			trans	-69.5	126.9	176.2	-58.2	163.3	0	0	0	108.9	F137 I138 I140 H141 M289 Q293 F307	F137-I302 VanDerWaalsContact O-CD1 3.29Å; F137-I302 WeakPolarHBondContact O-CD1 3.36Å; I138-I302 HydrophobicContact CD1-CD1 3.97Å; I140-I302 HydrophobicContact CB-CD1 4.34Å; I140-I302 HydrophobicContact CB-CG1 4.17Å; I140-I302 HydrophobicContact CG2-CG1 4.2Å; H141-I302 HydrophobicContact CB-CD1 4.06Å; M289-I302 HydrophobicContact CB-CG2 3.89Å; M289-I302 HydrophobicContact CG-CG2 4.36Å; Q293-I302 PolarHBondContact NE2-O 3.06Å; I302-F307 HydrophobicContact CG2-CE2 3.64Å; I302-F307 HydrophobicContact CG2-CZ 3.65Å
303	T	96.6	Very high	94.4	Very high	49 Å²	49	76.3 Å²	76.3	30%	0.301	37%	0.369	S	S	.	.			trans	-150.9	171.6	-165.3	42.2	0	0	0	0	110.2	I301 K305 H306 F307	I301-T303 PolarHBondContact O-N 3.38Å; I301-T303 PolarHBondContact O-OG1 3.18Å; T303-K305 PolarHBondContact O-N 3.35Å; T303-K305 VanDerWaalsContact O-N 3.11Å; T303-H306 PolarHBondContact N-ND1 3.35Å; T303-H306 WeakPolarHBondContact O-CB 3.32Å; T303-H306 PolarHBondContact O-N 3.35Å; T303-H306 PolarHBondContact O-ND1 2.85Å; T303-H306 PolarHBondContact OG1-CE1 3.12Å; T303-H306 VanDerWaalsContact OG1-CE1 3.31Å; T303-H306 PolarHBondContact OG1-ND1 3.47Å; T303-F307 VanDerWaalsContact O-CD2 3.29Å; T303-F307 WeakPolarHBondContact O-CD2 3.24Å
304	D	95.4	Very high	93.8	Very high	101 Å²	101	77.9 Å²	77.9	54%	0.54	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-48.5	-34.5	173.1	71.9	-59	0	0	0	113.5	A286 H306 F307 K319	A286-D304 HydrophobicContact CB-CB 4.33Å; D304-H306 PolarHBondContact O-N 3.29Å; D304-F307 PolarHBondContact O-N 2.84Å; D304-K319 PolarHBondContact O-NZ 2.88Å
305	K	93.8	Very high	93.4	Very high	160 Å²	160	77.2 Å²	77.2	70%	0.696	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-58.4	-17	175.6	-65.4	-174.4	-178.8	-178.3	0	113.6	T303 K319	T303-K305 PolarHBondContact O-N 3.35Å; T303-K305 VanDerWaalsContact O-N 3.11Å; K305-K319 WeakPolarHBondContact O-CD 3.48Å
306	H	94.4	Very high	93.1	Very high	53 Å²	53	76 Å²	76	25%	0.245	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-95.1	-13	178	-61.5	82.7	0	0	0	114.2	I140 I301 T303 D304 K319	I140-H306 HydrophobicContact CD1-CB 4.38Å; I301-H306 PolarHBondContact O-CE1 3.05Å; T303-H306 PolarHBondContact N-ND1 3.35Å; T303-H306 WeakPolarHBondContact O-CB 3.32Å; T303-H306 PolarHBondContact O-N 3.35Å; T303-H306 PolarHBondContact O-ND1 2.85Å; T303-H306 PolarHBondContact OG1-CE1 3.12Å; T303-H306 VanDerWaalsContact OG1-CE1 3.31Å; T303-H306 PolarHBondContact OG1-ND1 3.47Å; D304-H306 PolarHBondContact O-N 3.29Å; H306-K319 PolarHBondContact O-N 2.86Å
307	F	95	Very high	92.8	Very high	14 Å²	14	75.6 Å²	75.6	6%	0.061	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	145.2	-173.9	-58.7	-73.4	0	0	0	113.2	F137 P285 A286 M289 I302 T303 D304 C317 L318 K319	F137-F307 HydrophobicContact CB-CE1 4.22Å; F137-F307 HydrophobicContact CB-CZ 4.31Å; F137-F307 AromaticContact CD1-CE1 3.95Å; F137-F307 HydrophobicContact CD1-CE1 3.95Å; F137-F307 AromaticContact CD2-CE1 3.57Å; F137-F307 HydrophobicContact CD2-CE1 3.57Å; F137-F307 HydrophobicContact CD2-CZ 4.01Å; F137-F307 HydrophobicContact CE1-CE1 4.14Å; F137-F307 HydrophobicContact CE2-CD1 4.44Å; F137-F307 AromaticContact CE2-CE1 3.79Å; F137-F307 HydrophobicContact CE2-CE1 3.79Å; F137-F307 AromaticContact CG-CE1 3.65Å; F137-F307 HydrophobicContact CG-CE1 3.65Å; F137-F307 HydrophobicContact CG-CZ 4.16Å; F137-F307 HydrophobicContact CZ-CD1 4.44Å; F137-F307 HydrophobicContact CZ-CE1 4.06Å; P285-F307 HydrophobicContact CB-CD1 3.95Å; P285-F307 HydrophobicContact CB-CD2 4.17Å; P285-F307 HydrophobicContact CB-CE1 3.97Å; P285-F307 HydrophobicContact CB-CE2 4.18Å; P285-F307 HydrophobicContact CB-CG 4.05Å; P285-F307 HydrophobicContact CB-CZ 4.09Å; P285-F307 HydrophobicContact CG-CB 4.03Å; P285-F307 HydrophobicContact CG-CD1 4.02Å; P285-F307 HydrophobicContact CG-CD2 4.01Å; P285-F307 HydrophobicContact CG-CG 3.74Å; A286-F307 HydrophobicContact CB-CD2 4.24Å; A286-F307 HydrophobicContact CB-CE2 4.35Å; M289-F307 HydrophobicContact CG-CZ 4.01Å; I302-F307 HydrophobicContact CG2-CE2 3.64Å; I302-F307 HydrophobicContact CG2-CZ 3.65Å; T303-F307 VanDerWaalsContact O-CD2 3.29Å; T303-F307 WeakPolarHBondContact O-CD2 3.24Å; D304-F307 PolarHBondContact O-N 2.84Å; F307-C317 WeakPolarHBondContact CA-O 3.33Å; F307-L318 HydrophobicContact CD1-CD2 3.85Å; F307-L318 HydrophobicContact CE1-CD2 3.59Å; F307-K319 WeakPolarHBondContact O-CD 3.32Å; F307-K319 WeakPolarHBondContact O-CE 3.29Å; F307-K319 PolarHBondContact O-NZ 3.31Å
308	Y	92.6	Very high	92.5	Very high	72 Å²	72	73.5 Å²	73.5	28%	0.282	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	146.2	163.3	78.5	-76.9	0	0	0	110.1	N310 P316 C317 L318 K319 P327 C329	Y308-N310 HydrophobicContact CE2-CB 4.06Å; Y308-P316 WeakPolarHBondContact O-CA 3.04Å; Y308-C317 HydrophobicContact CD1-CB 3.98Å; Y308-C317 WeakPolarHBondContact CD1-O 3.25Å; Y308-C317 HydrophobicContact CE1-CB 3.38Å; Y308-C317 HydrophobicContact CE2-CB 4.41Å; Y308-C317 PolarHBondContact N-O 2.72Å; Y308-C317 PolarHBondContact O-N 2.92Å; Y308-L318 WeakPolarHBondContact CE1-O 3.2Å; Y308-K319 HydrophobicContact CD1-CG 3.97Å; Y308-K319 HydrophobicContact CG-CG 4.38Å; Y308-P327 HydrophobicContact CE1-CB 3.58Å; Y308-P327 WeakPolarHBondContact OH-CB 3.32Å; Y308-C329 PolarHBondContact OH-SG 3.09Å; Y308-C329 VanDerWaalsContact OH-SG 3.41Å
309	F	90.9	Very high	92	Very high	112 Å²	112	76.6 Å²	76.6	49%	0.491	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	119.7	176.9	-166.7	-93.4	0	0	0	110.7	I282 R311 G314	I282-F309 HydrophobicContact CG2-CE2 4.45Å; F309-R311 HydrophobicContact CD1-CG 4.21Å; F309-R311 PolarHBondContact O-N 3.03Å; F309-G314 VanDerWaalsContact CZ-C 3.4Å; F309-G314 WeakPolarHBondContact CZ-O 3.46Å
310	N	89.3	Confident	90.8	Very high	38 Å²	38	74.7 Å²	74.7	20%	0.203	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	100.5	175.8	-177.5	-31.6	0	0	0	109.2	Y308 T312 K313 G314 F315 C329	Y308-N310 HydrophobicContact CE2-CB 4.06Å; N310-T312 VanDerWaalsContact C-N 3.33Å; N310-T312 PolarHBondContact O-N 3.23Å; N310-T312 PolarHBondContact OD1-N 3.48Å; N310-K313 HydrophobicContact CB-CB 3.96Å; N310-K313 PolarHBondContact O-N 3.1Å; N310-K313 PolarHBondContact OD1-N 2.76Å; N310-G314 PolarHBondContact O-N 2.96Å; N310-F315 PolarHBondContact N-O 2.93Å; N310-C329 PolarHBondContact ND2-SG 3.09Å; N310-C329 VanDerWaalsContact ND2-SG 3.35Å
311	R	87	Confident	89.3	Confident	227 Å²	227	69.7 Å²	69.7	86%	0.857	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-42.8	-178.4	-68	-172.8	178.7	-167.9	0.3	113	F309 K313 G314	F309-R311 HydrophobicContact CD1-CG 4.21Å; F309-R311 PolarHBondContact O-N 3.03Å; R311-K313 VanDerWaalsContact C-N 3.26Å; R311-K313 PolarHBondContact O-N 2.98Å; R311-G314 PolarHBondContact O-N 2.97Å
312	T	83.6	Confident	87.5	Confident	144 Å²	144	76.9 Å²	76.9	88%	0.883	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-29.1	178.2	-44.1	0	0	0	0	112.7	N310	N310-T312 VanDerWaalsContact C-N 3.33Å; N310-T312 PolarHBondContact O-N 3.23Å; N310-T312 PolarHBondContact OD1-N 3.48Å
313	K	83.6	Confident	85.7	Confident	48 Å²	48	82.4 Å²	82.4	21%	0.209	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-30.2	175.8	-168	179.9	171.3	69.8	0	112.7	N310 R311 F315 C329 L330 G331 K334	N310-K313 HydrophobicContact CB-CB 3.96Å; N310-K313 PolarHBondContact O-N 3.1Å; N310-K313 PolarHBondContact OD1-N 2.76Å; R311-K313 VanDerWaalsContact C-N 3.26Å; R311-K313 PolarHBondContact O-N 2.98Å; K313-F315 HydrophobicContact CD-CB 4.32Å; K313-F315 HydrophobicContact CG-CB 4.34Å; K313-F315 HydrophobicContact CG-CD2 4.29Å; K313-F315 WeakPolarHBondContact O-CD2 3.39Å; K313-C329 HydrophobicContact CD-CB 4.26Å; K313-L330 WeakPolarHBondContact CE-O 3.29Å; K313-L330 PolarHBondContact NZ-O 2.81Å; K313-G331 PolarHBondContact NZ-O 2.86Å; K313-K334 PolarHBondContact NZ-O 3.31Å
314	G	85.3	Confident	84.1	Confident	33 Å²	33	82.2 Å²	82.2	34%	0.34	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.7	17.2	-170.9	0	0	0	0	0	114.5	F309 N310 R311	F309-G314 VanDerWaalsContact CZ-C 3.4Å; F309-G314 WeakPolarHBondContact CZ-O 3.46Å; N310-G314 PolarHBondContact O-N 2.96Å; R311-G314 PolarHBondContact O-N 2.97Å
315	F	91.1	Very high	82.4	Confident	62 Å²	62	82 Å²	82	27%	0.272	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	154	-176.1	-72.8	-88.8	0	0	0	112.2	I282 N310 K313	I282-F315 HydrophobicContact CD1-CD1 4.26Å; I282-F315 HydrophobicContact CD1-CE1 3.72Å; I282-F315 HydrophobicContact CG1-CD1 4.01Å; I282-F315 HydrophobicContact CG1-CE1 3.98Å; I282-F315 HydrophobicContact CG2-CD1 4.24Å; N310-F315 PolarHBondContact N-O 2.93Å; K313-F315 HydrophobicContact CD-CB 4.32Å; K313-F315 HydrophobicContact CG-CB 4.34Å; K313-F315 HydrophobicContact CG-CD2 4.29Å; K313-F315 WeakPolarHBondContact O-CD2 3.39Å
316	P	91.5	Very high	80.9	Confident	10 Å²	10	81 Å²	81	7%	0.065	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	145.6	168.1	28.3	-34.1	0	0	0	111.6	F137 I282 P285 Y308	F137-P316 HydrophobicContact CZ-CG 4.42Å; I282-P316 WeakPolarHBondContact O-CD 3.43Å; P285-P316 HydrophobicContact CB-CB 4.5Å; P285-P316 HydrophobicContact CB-CG 4.46Å; P285-P316 HydrophobicContact CG-CB 3.96Å; P285-P316 HydrophobicContact CG-CG 4.28Å; Y308-P316 WeakPolarHBondContact O-CA 3.04Å
317	C	92.4	Very high	79.8	Confident	1 Å²	1	81.3 Å²	81.3	1%	0.007	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	159.5	177	-63.6	0	0	0	0	110	F307 Y308 C329	F307-C317 WeakPolarHBondContact CA-O 3.33Å; Y308-C317 HydrophobicContact CD1-CB 3.98Å; Y308-C317 WeakPolarHBondContact CD1-O 3.25Å; Y308-C317 HydrophobicContact CE1-CB 3.38Å; Y308-C317 HydrophobicContact CE2-CB 4.41Å; Y308-C317 PolarHBondContact N-O 2.72Å; Y308-C317 PolarHBondContact O-N 2.92Å; C317-C329 HydrophobicContact CB-CB 3.91Å; C317-C329 WeakPolarHBondContact CB-SG 3.4Å; C317-C329 WeakPolarHBondContact SG-CA 3.07Å; C317-C329 WeakPolarHBondContact SG-CB 3.45Å; C317-C329 CovalentContact SG-SG 2.03Å; C317-C329 PolarHBondContact SG-SG 3.17Å
318	L	92	Very high	79.4	Confident	18 Å²	18	87.9 Å²	87.9	9%	0.094	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	127.1	178.1	-58.4	179.8	0	0	0	110.2	F137 I140 F307 Y308 R328	F137-L318 HydrophobicContact CD1-CD1 4.31Å; F137-L318 HydrophobicContact CD1-CD2 3.46Å; F137-L318 VanDerWaalsContact CD1-CD2 3.46Å; F137-L318 HydrophobicContact CD1-CG 4.04Å; F137-L318 HydrophobicContact CE1-CD2 3.78Å; F137-L318 HydrophobicContact CE1-CG 4.18Å; F137-L318 HydrophobicContact CG-CD2 4.24Å; I140-L318 HydrophobicContact CD1-CD1 3.83Å; I140-L318 HydrophobicContact CD1-CD2 3.49Å; I140-L318 VanDerWaalsContact CD1-CD2 3.49Å; I140-L318 HydrophobicContact CD1-CG 4.15Å; I140-L318 HydrophobicContact CG1-CD1 4.32Å; F307-L318 HydrophobicContact CD1-CD2 3.85Å; F307-L318 HydrophobicContact CE1-CD2 3.59Å; Y308-L318 WeakPolarHBondContact CE1-O 3.2Å; L318-R328 HydrophobicContact CB-CB 4.29Å; L318-R328 WeakPolarHBondContact CB-O 3.23Å; L318-R328 PolarHBondContact N-O 3.37Å; L318-R328 PolarHBondContact O-N 2.84Å
319	K	86.6	Confident	79.2	Confident	84 Å²	84	86.7 Å²	86.7	37%	0.365	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-59.2	162.7	169.9	-80.6	166	171.2	152.1	0	110.1	D304 K305 H306 F307 Y308 P321	D304-K319 PolarHBondContact O-NZ 2.88Å; K305-K319 WeakPolarHBondContact O-CD 3.48Å; H306-K319 PolarHBondContact O-N 2.86Å; F307-K319 WeakPolarHBondContact O-CD 3.32Å; F307-K319 WeakPolarHBondContact O-CE 3.29Å; F307-K319 PolarHBondContact O-NZ 3.31Å; Y308-K319 HydrophobicContact CD1-CG 3.97Å; Y308-K319 HydrophobicContact CG-CG 4.38Å; K319-P321 WeakPolarHBondContact O-CD 3.21Å
320	K	73.4	Confident	79.1	Confident	125 Å²	125	83.2 Å²	83.2	54%	0.543	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-62.9	126.5	175	-60.6	-172.2	-173.6	-168	0	109.5	S325 P327	K320-S325 WeakPolarHBondContact CE-O 3.32Å; K320-S325 PolarHBondContact NZ-O 2.79Å; K320-P327 HydrophobicContact CG-CB 4.35Å; K320-P327 HydrophobicContact CG-CG 4.06Å
321	P	66.4	Low	79	Confident	50 Å²	50	83.7 Å²	83.7	33%	0.325	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-59.1	145.7	151.7	-14.2	27.9	0	0	0	108.9	K319 S323 S324	K319-P321 WeakPolarHBondContact O-CD 3.21Å; P321-S323 PolarHBondContact O-N 3.29Å; P321-S323 VanDerWaalsContact O-N 3.11Å; P321-S324 PolarHBondContact O-N 3.28Å
322	E	60	Low	78.9	Confident	211 Å²	211	82.7 Å²	82.7	99%	0.986	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-29.2	177.8	-64.1	173.7	161.4	0	0	112.2	S324	E322-S324 VanDerWaalsContact C-N 3.34Å; E322-S324 PolarHBondContact O-N 3.09Å
323	S	58.7	Low	79	Confident	119 Å²	119	79 Å²	79	83%	0.832	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	9.1	175.5	57	0	0	0	0	115.6	P321	P321-S323 PolarHBondContact O-N 3.29Å; P321-S323 VanDerWaalsContact O-N 3.11Å
324	S	62.2	Low	79.3	Confident	45 Å²	45	80.1 Å²	80.1	32%	0.315	43%	0.433	S	S	.	.			trans	-144.4	128.5	-178	-162.3	0	0	0	0	114.2	P321 E322 Q326	P321-S324 PolarHBondContact O-N 3.28Å; E322-S324 VanDerWaalsContact C-N 3.34Å; E322-S324 PolarHBondContact O-N 3.09Å; S324-Q326 VanDerWaalsContact C-N 3.33Å; S324-Q326 PolarHBondContact O-N 2.64Å
325	S	59.7	Low	79.4	Confident	95 Å²	95	80.3 Å²	80.3	66%	0.664	44%	0.435	S	S	*	.	S	Bend	trans	-70.7	-16.3	-168.2	58	0	0	0	0	115.8	K320	K320-S325 WeakPolarHBondContact CE-O 3.32Å; K320-S325 PolarHBondContact NZ-O 2.79Å
326	Q	63.4	Low	79.3	Confident	141 Å²	141	80.7 Å²	80.7	66%	0.659	44%	0.435	S	S	*	.	S	Bend	trans	-128.7	143.5	-173.7	-64	-166.5	2.2	0	0	114.1	S324	S324-Q326 VanDerWaalsContact C-N 3.33Å; S324-Q326 PolarHBondContact O-N 2.64Å
327	P	71.6	Confident	79.1	Confident	58 Å²	58	86.5 Å²	86.5	38%	0.377	47%	0.47	S	S	.	.			trans	-73.4	148.3	176.2	-5	22.7	0	0	0	110.9	Y308 K320	Y308-P327 HydrophobicContact CE1-CB 3.58Å; Y308-P327 WeakPolarHBondContact OH-CB 3.32Å; K320-P327 HydrophobicContact CG-CB 4.35Å; K320-P327 HydrophobicContact CG-CG 4.06Å
328	R	85.3	Confident	79.1	Confident	153 Å²	153	88.9 Å²	88.9	58%	0.577	48%	0.481	S	S	*	.	B	Isolated β-bridge	trans	-108.5	90.6	-176	-72	-166.6	-84.1	-158.1	-3.8	112.3	L318	L318-R328 HydrophobicContact CB-CB 4.29Å; L318-R328 WeakPolarHBondContact CB-O 3.23Å; L318-R328 PolarHBondContact N-O 3.37Å; L318-R328 PolarHBondContact O-N 2.84Å
329	C	88.9	Confident	79	Confident	47 Å²	47	90.2 Å²	90.2	32%	0.318	49%	0.49	S	S	.	.			trans	-76.9	151.4	162.3	-76.4	0	0	0	0	111.8	Y308 N310 K313 C317	Y308-C329 PolarHBondContact OH-SG 3.09Å; Y308-C329 VanDerWaalsContact OH-SG 3.41Å; N310-C329 PolarHBondContact ND2-SG 3.09Å; N310-C329 VanDerWaalsContact ND2-SG 3.35Å; K313-C329 HydrophobicContact CD-CB 4.26Å; C317-C329 HydrophobicContact CB-CB 3.91Å; C317-C329 WeakPolarHBondContact CB-SG 3.4Å; C317-C329 WeakPolarHBondContact SG-CA 3.07Å; C317-C329 WeakPolarHBondContact SG-CB 3.45Å; C317-C329 CovalentContact SG-SG 2.03Å; C317-C329 PolarHBondContact SG-SG 3.17Å
330	L	88.4	Confident	79.4	Confident	39 Å²	39	94.7 Å²	94.7	20%	0.204	51%	0.512	C	S	.	.			trans	-65.1	138.8	166	-61.9	178.3	0	0	0	110.6	R132 A133 E136 K313 K334	R132-L330 HydrophobicContact CG-CD2 4.34Å; A133-L330 HydrophobicContact CB-CD1 3.92Å; E136-L330 HydrophobicContact CB-CD2 4.25Å; E136-L330 HydrophobicContact CG-CD2 3.81Å; K313-L330 WeakPolarHBondContact CE-O 3.29Å; K313-L330 PolarHBondContact NZ-O 2.81Å; L330-K334 HydrophobicContact CB-CB 3.85Å; L330-K334 HydrophobicContact CB-CG 4.11Å; L330-K334 HydrophobicContact CD1-CB 4.22Å; L330-K334 HydrophobicContact CD1-CG 4.42Å
331	G	86.8	Confident	80.4	Confident	47 Å²	47	89.9 Å²	89.9	49%	0.485	49%	0.492	S	S	.	.			trans	-63.1	174.5	-175.2	0	0	0	0	0	115.3	K313 S333 K334	K313-G331 PolarHBondContact NZ-O 2.86Å; G331-S333 PolarHBondContact O-N 3.15Å; G331-K334 PolarHBondContact O-N 3.19Å
332	K	86.4	Confident	81.8	Confident	207 Å²	207	92.3 Å²	92.3	90%	0.9	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-26.2	-174.8	-62.1	-175.4	179.7	-177.2	0	114.4	K334	K332-K334 PolarHBondContact O-N 3.42Å
333	S	85.4	Confident	83.5	Confident	66 Å²	66	87.5 Å²	87.5	46%	0.462	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	3.8	178.3	67.4	0	0	0	0	115.2	G331 R336	G331-S333 PolarHBondContact O-N 3.15Å; S333-R336 PolarHBondContact O-NH1 3.42Å
334	K	90.6	Very high	85.3	Confident	72 Å²	72	86.4 Å²	86.4	31%	0.313	46%	0.458	S	S	.	.	S	Bend	trans	-128.5	128.2	177.5	-52	-64	167.4	-179.8	0	109.1	K313 L330 G331 K332	K313-K334 PolarHBondContact NZ-O 3.31Å; L330-K334 HydrophobicContact CB-CB 3.85Å; L330-K334 HydrophobicContact CB-CG 4.11Å; L330-K334 HydrophobicContact CD1-CB 4.22Å; L330-K334 HydrophobicContact CD1-CG 4.42Å; G331-K334 PolarHBondContact O-N 3.19Å; K332-K334 PolarHBondContact O-N 3.42Å
335	G	85.9	Confident	86.9	Confident	37 Å²	37	84.2 Å²	84.2	38%	0.381	44%	0.443	S	S	.	.	S	Bend	trans	69.4	62.4	-166.4	0	0	0	0	0	111.5
336	R	88.8	Confident	88.7	Confident	70 Å²	70	81.7 Å²	81.7	26%	0.264	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-77.5	146.7	164.1	-70.8	176.5	-177.5	65.8	-4.5	108	T220 S224 S333 H338	T220-R336 HydrophobicContact CG2-CB 4.09Å; S224-R336 VanDerWaalsContact OG-CZ 3.31Å; S224-R336 PolarHBondContact OG-NE 2.95Å; S224-R336 PolarHBondContact OG-NH2 3.27Å; S333-R336 PolarHBondContact O-NH1 3.42Å; R336-H338 PolarHBondContact O-CD2 3.04Å; R336-H338 PolarHBondContact O-N 2.91Å
337	T	89	Confident	90.3	Very high	131 Å²	131	79.9 Å²	79.9	80%	0.804	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-52.3	132.6	155.5	-40.9	0	0	0	0	108.5	T220	T220-T337 WeakPolarHBondContact CG2-O 3.16Å
338	H	91.4	Very high	91.5	Very high	51 Å²	51	79.2 Å²	79.2	24%	0.236	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-82.2	156.2	172.1	-70.8	-170.4	0	0	0	109.6	I216 S217 R336	I216-H338 HydrophobicContact CG2-CB 3.96Å; S217-H338 VanDerWaalsContact CB-CE1 3.48Å; S217-H338 WeakPolarHBondContact CB-CE1 3.17Å; S217-H338 VanDerWaalsContact CB-NE2 3.29Å; S217-H338 WeakPolarHBondContact CB-NE2 3.27Å; S217-H338 PolarHBondContact OG-NE2 3.11Å; R336-H338 PolarHBondContact O-CD2 3.04Å; R336-H338 PolarHBondContact O-N 2.91Å
339	V	90.7	Very high	92.1	Very high	47 Å²	47	72 Å²	72	29%	0.285	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-56.8	150	159.9	-71.3	0	0	0	0	109.8	I216 Y219 L223 I341	I216-V339 HydrophobicContact CG2-CG2 4.18Å; Y219-V339 HydrophobicContact CD1-CG2 3.85Å; Y219-V339 HydrophobicContact CE1-CG1 4.17Å; Y219-V339 HydrophobicContact CE1-CG2 3.78Å; L223-V339 HydrophobicContact CD2-CG1 3.74Å; V339-I341 HydrophobicContact CB-CD1 4.45Å; V339-I341 HydrophobicContact CG2-CD1 3.53Å; V339-I341 HydrophobicContact CG2-CG1 4.12Å
340	Q	93.4	Very high	92.6	Very high	177 Å²	177	72.4 Å²	72.4	83%	0.827	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-74	138.4	163.7	-57.6	-53.2	-81.9	0	0	107.8
341	I	95.6	Very high	93	Very high	24 Å²	24	75.8 Å²	75.8	12%	0.123	39%	0.39	C	S	.	.			trans	-123.6	144	-179.5	-61	-58.2	0	0	0	106.1	I216 F232 E233 V339 V345 I346	I216-I341 HydrophobicContact CD1-CB 4.31Å; I216-I341 HydrophobicContact CD1-CG1 3.82Å; I216-I341 HydrophobicContact CG1-CG1 3.99Å; I216-I341 HydrophobicContact CG2-CG1 4.02Å; F232-I341 HydrophobicContact CB-CD1 3.47Å; F232-I341 VanDerWaalsContact CB-CD1 3.47Å; F232-I341 HydrophobicContact CD1-CD1 3.6Å; F232-I341 HydrophobicContact CD1-CG1 4.14Å; F232-I341 HydrophobicContact CD1-CG2 3.95Å; F232-I341 HydrophobicContact CE1-CG2 4.19Å; F232-I341 HydrophobicContact CG-CD1 3.64Å; F232-I341 HydrophobicContact CG-CG1 4.48Å; E233-I341 WeakPolarHBondContact OE1-CD1 3.31Å; V339-I341 HydrophobicContact CB-CD1 4.45Å; V339-I341 HydrophobicContact CG2-CD1 3.53Å; V339-I341 HydrophobicContact CG2-CG1 4.12Å; I341-V345 HydrophobicContact CG2-CB 4.05Å; I341-V345 HydrophobicContact CG2-CG1 3.61Å; I341-I346 HydrophobicContact CB-CD1 4.37Å; I341-I346 HydrophobicContact CB-CG1 4.24Å; I341-I346 HydrophobicContact CG2-CG1 3.86Å
342	E	95.6	Very high	93.5	Very high	102 Å²	102	75.6 Å²	75.6	48%	0.477	38%	0.376	S	S	.	.			trans	-63	139.8	178.9	-68.2	-178.3	-115.5	0	0	111.8	R240 E344 V345 I346	R240-E342 IonicContact CZ-OE1 3.31Å; R240-E342 IonicContact CZ-OE2 3.59Å; R240-E342 IonicContact NH1-OE1 3.06Å; R240-E342 PolarHBondContact NH1-OE1 3.25Å; R240-E342 IonicContact NH1-OE2 3.13Å; R240-E342 VanDerWaalsContact NH2-CD 3.29Å; R240-E342 IonicContact NH2-OE1 2.63Å; R240-E342 PolarHBondContact NH2-OE1 2.76Å; R240-E342 IonicContact NH2-OE2 2.7Å; R240-E342 PolarHBondContact NH2-OE2 2.94Å; E342-E344 VanDerWaalsContact C-N 3.32Å; E342-E344 PolarHBondContact O-N 3.02Å; E342-V345 HydrophobicContact CB-CB 4.44Å; E342-V345 HydrophobicContact CB-CG2 4.38Å; E342-V345 WeakPolarHBondContact O-CB 3.04Å; E342-V345 PolarHBondContact O-N 2.87Å; E342-I346 PolarHBondContact O-N 2.83Å; E342-I346 VanDerWaalsContact O-N 3.11Å
343	Q	96.3	Very high	94.1	Very high	110 Å²	110	65.8 Å²	65.8	51%	0.514	33%	0.334	S	S	.	.	H	α-helix	trans	-62	-38.9	-174.7	-179.3	58.7	27.7	0	0	112.3	V345 I346 E347	Q343-V345 VanDerWaalsContact C-N 3.26Å; Q343-V345 PolarHBondContact O-N 2.82Å; Q343-I346 WeakPolarHBondContact O-CB 3.37Å; Q343-I346 PolarHBondContact O-N 2.93Å; Q343-I346 VanDerWaalsContact O-N 3.15Å; Q343-E347 WeakPolarHBondContact CG-OE1 3.5Å; Q343-E347 PolarHBondContact NE2-OE1 3.28Å; Q343-E347 WeakPolarHBondContact O-CG 3.45Å; Q343-E347 PolarHBondContact O-N 3.19Å
344	E	95.8	Very high	94.8	Very high	95 Å²	95	66.6 Å²	66.6	44%	0.444	33%	0.326	S	S	.	.	H	α-helix	trans	-54.7	-41.9	171.9	-179	-166	-125.2	0	0	111.8	R240 E342 E347 Q348	R240-E344 IonicContact CZ-OE2 2.72Å; R240-E344 VanDerWaalsContact CZ-OE2 3.31Å; R240-E344 IonicContact NE-OE2 2.81Å; R240-E344 PolarHBondContact NE-OE2 3.3Å; R240-E344 IonicContact NH2-OE2 3.19Å; R240-E344 PolarHBondContact NH2-OE2 2.93Å; E342-E344 VanDerWaalsContact C-N 3.32Å; E342-E344 PolarHBondContact O-N 3.02Å; E344-E347 PolarHBondContact O-N 2.93Å; E344-Q348 HydrophobicContact CG-CG 4.41Å; E344-Q348 WeakPolarHBondContact O-CB 3.31Å; E344-Q348 VanDerWaalsContact O-CG 3.31Å; E344-Q348 WeakPolarHBondContact O-CG 3.31Å; E344-Q348 PolarHBondContact O-N 2.83Å
345	V	96.3	Very high	95.1	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-71	-34.4	-179.5	162.7	0	0	0	0	111.6	F232 E233 F237 I341 E342 Q343 L349	F232-V345 HydrophobicContact CD1-CG1 4.2Å; F232-V345 HydrophobicContact CE1-CG1 4.08Å; E233-V345 HydrophobicContact CG-CG1 4.28Å; E233-V345 HydrophobicContact CG-CG2 3.96Å; F237-V345 HydrophobicContact CE2-CB 4.35Å; F237-V345 HydrophobicContact CE2-CG1 3.81Å; F237-V345 HydrophobicContact CE2-CG2 3.97Å; F237-V345 HydrophobicContact CZ-CG1 4.28Å; F237-V345 HydrophobicContact CZ-CG2 4.47Å; I341-V345 HydrophobicContact CG2-CB 4.05Å; I341-V345 HydrophobicContact CG2-CG1 3.61Å; E342-V345 HydrophobicContact CB-CB 4.44Å; E342-V345 HydrophobicContact CB-CG2 4.38Å; E342-V345 WeakPolarHBondContact O-CB 3.04Å; E342-V345 PolarHBondContact O-N 2.87Å; Q343-V345 VanDerWaalsContact C-N 3.26Å; Q343-V345 PolarHBondContact O-N 2.82Å; V345-L349 HydrophobicContact CG1-CD1 4.22Å; V345-L349 WeakPolarHBondContact O-CB 3.49Å; V345-L349 VanDerWaalsContact O-CG 3.27Å; V345-L349 WeakPolarHBondContact O-CG 3.48Å; V345-L349 PolarHBondContact O-N 3.25Å; V345-L349 VanDerWaalsContact O-N 3.14Å
346	I	97.1	Very high	95.7	Very high	41 Å²	41	67.8 Å²	67.8	21%	0.21	33%	0.33	C	S	.	.	H	α-helix	trans	-63.6	-47.4	171.7	-62.1	175	0	0	0	109.5	V212 I341 E342 Q343 L349 Q350	V212-I346 HydrophobicContact CG1-CG2 4.24Å; I341-I346 HydrophobicContact CB-CD1 4.37Å; I341-I346 HydrophobicContact CB-CG1 4.24Å; I341-I346 HydrophobicContact CG2-CG1 3.86Å; E342-I346 PolarHBondContact O-N 2.83Å; E342-I346 VanDerWaalsContact O-N 3.11Å; Q343-I346 WeakPolarHBondContact O-CB 3.37Å; Q343-I346 PolarHBondContact O-N 2.93Å; Q343-I346 VanDerWaalsContact O-N 3.15Å; I346-L349 PolarHBondContact O-N 3.39Å; I346-Q350 WeakPolarHBondContact O-CG 3.42Å; I346-Q350 PolarHBondContact O-N 3Å
347	E	96.8	Very high	96.2	Very high	103 Å²	103	64.6 Å²	64.6	48%	0.481	32%	0.318	S	S	.	.	H	α-helix	trans	-65.3	-47.5	-178.9	-73.1	166	-174.1	0	0	112.4	Q343 E344 L349 Q350 E351	Q343-E347 WeakPolarHBondContact CG-OE1 3.5Å; Q343-E347 PolarHBondContact NE2-OE1 3.28Å; Q343-E347 WeakPolarHBondContact O-CG 3.45Å; Q343-E347 PolarHBondContact O-N 3.19Å; E344-E347 PolarHBondContact O-N 2.93Å; E347-L349 VanDerWaalsContact C-N 3.26Å; E347-L349 PolarHBondContact O-N 3.02Å; E347-Q350 PolarHBondContact O-N 3.12Å; E347-Q350 VanDerWaalsContact O-N 3.12Å; E347-E351 WeakPolarHBondContact O-CB 3.32Å; E347-E351 PolarHBondContact O-N 3.28Å
348	Q	97.3	Very high	96.7	Very high	45 Å²	45	62 Å²	62	21%	0.21	30%	0.298	C	S	.	.	H	α-helix	trans	-56.3	-39.4	173.4	-75.9	-178.4	-8.9	0	0	112	F237 R240 E344 F352	F237-Q348 HydrophobicContact CE1-CB 4.05Å; F237-Q348 HydrophobicContact CZ-CB 3.93Å; R240-Q348 PolarHBondContact O-NE2 3.14Å; E344-Q348 HydrophobicContact CG-CG 4.41Å; E344-Q348 WeakPolarHBondContact O-CB 3.31Å; E344-Q348 VanDerWaalsContact O-CG 3.31Å; E344-Q348 WeakPolarHBondContact O-CG 3.31Å; E344-Q348 PolarHBondContact O-N 2.83Å; Q348-F352 WeakPolarHBondContact O-CB 3.43Å; Q348-F352 PolarHBondContact O-N 2.03Å
349	L	98.2	Very high	97	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-74.4	-35.1	176.3	-71.6	174.8	0	0	0	112.7	V212 F232 A236 F237 V245 I252 V345 I346 E347 F352 Y353	V212-L349 HydrophobicContact CG1-CB 4.07Å; V212-L349 HydrophobicContact CG1-CD1 4.24Å; V212-L349 HydrophobicContact CG2-CB 3.81Å; F232-L349 HydrophobicContact CE1-CD1 3.52Å; F232-L349 HydrophobicContact CZ-CD1 3.7Å; A236-L349 HydrophobicContact CB-CD1 4.44Å; F237-L349 HydrophobicContact CZ-CD2 4.32Å; F237-L349 HydrophobicContact CZ-CG 4.15Å; V245-L349 HydrophobicContact CG1-CD2 3.89Å; V245-L349 HydrophobicContact CG2-CD2 3.77Å; I252-L349 HydrophobicContact CD1-CD2 3.82Å; V345-L349 HydrophobicContact CG1-CD1 4.22Å; V345-L349 WeakPolarHBondContact O-CB 3.49Å; V345-L349 VanDerWaalsContact O-CG 3.27Å; V345-L349 WeakPolarHBondContact O-CG 3.48Å; V345-L349 PolarHBondContact O-N 3.25Å; V345-L349 VanDerWaalsContact O-N 3.14Å; I346-L349 PolarHBondContact O-N 3.39Å; E347-L349 VanDerWaalsContact C-N 3.26Å; E347-L349 PolarHBondContact O-N 3.02Å; L349-F352 PolarHBondContact O-N 3.41Å; L349-Y353 HydrophobicContact CB-CE2 4.47Å; L349-Y353 WeakPolarHBondContact O-CD2 3.29Å; L349-Y353 PolarHBondContact O-N 3.35Å
350	Q	98	Very high	97.4	Very high	56 Å²	56	61.9 Å²	61.9	26%	0.262	29%	0.293	S	S	.	.	H	α-helix	trans	-61.3	-46.9	171.7	-74.3	178.1	-87.5	0	0	110.7	V212 I346 E347 F352 Y353 R354	V212-Q350 HydrophobicContact CG2-CG 3.9Å; I346-Q350 WeakPolarHBondContact O-CG 3.42Å; I346-Q350 PolarHBondContact O-N 3Å; E347-Q350 PolarHBondContact O-N 3.12Å; E347-Q350 VanDerWaalsContact O-N 3.12Å; Q350-F352 VanDerWaalsContact C-N 3.34Å; Q350-F352 PolarHBondContact O-N 3.12Å; Q350-Y353 PolarHBondContact O-N 3.32Å; Q350-R354 PolarHBondContact O-N 3.46Å
351	E	97.7	Very high	97.7	Very high	111 Å²	111	54.5 Å²	54.5	52%	0.519	26%	0.258	S	S	.	.	H	α-helix	trans	-57.1	-46.4	176.2	-160.1	62.5	-144.5	0	0	111.4	E347 Y353 R354 P355	E347-E351 WeakPolarHBondContact O-CB 3.32Å; E347-E351 PolarHBondContact O-N 3.28Å; E351-Y353 PolarHBondContact O-N 2.99Å; E351-R354 IonicContact OE1-CZ 3.8Å; E351-R354 IonicContact OE1-NH1 2.75Å; E351-R354 PolarHBondContact OE1-NH1 2.67Å; E351-R354 IonicContact OE2-CZ 3.19Å; E351-R354 IonicContact OE2-NH1 2.83Å; E351-R354 PolarHBondContact OE2-NH1 3.45Å; E351-R354 IonicContact OE2-NH2 2.7Å; E351-R354 PolarHBondContact OE2-NH2 3.47Å; E351-P355 WeakPolarHBondContact O-CD 3.32Å
352	F	98.3	Very high	97.8	Very high	43 Å²	43	60 Å²	60	19%	0.189	28%	0.283	C	S	.	.	H	α-helix	trans	-60.6	-41.9	175.1	167.3	-94.2	0	0	0	113.5	V245 T247 I252 M256 Q348 L349 Q350 F356	V245-F352 HydrophobicContact CB-CD2 3.85Å; V245-F352 HydrophobicContact CB-CE2 4.13Å; V245-F352 HydrophobicContact CB-CG 4.09Å; V245-F352 HydrophobicContact CG1-CD1 4.09Å; V245-F352 HydrophobicContact CG1-CD2 4.19Å; V245-F352 HydrophobicContact CG1-CE1 4.11Å; V245-F352 HydrophobicContact CG1-CE2 4.2Å; V245-F352 HydrophobicContact CG1-CG 4.15Å; V245-F352 HydrophobicContact CG1-CZ 4.17Å; V245-F352 HydrophobicContact CG2-CB 3.86Å; V245-F352 HydrophobicContact CG2-CD1 4.38Å; V245-F352 HydrophobicContact CG2-CD2 3.89Å; V245-F352 HydrophobicContact CG2-CG 3.76Å; T247-F352 HydrophobicContact CG2-CE2 3.73Å; T247-F352 HydrophobicContact CG2-CZ 3.61Å; I252-F352 HydrophobicContact CG2-CD1 4.47Å; I252-F352 HydrophobicContact CG2-CE1 3.59Å; I252-F352 HydrophobicContact CG2-CZ 3.98Å; M256-F352 HydrophobicContact CG-CE1 4.29Å; M256-F352 HydrophobicContact CG-CZ 4.33Å; M256-F352 HydrophobicContact SD-CE1 4.31Å; M256-F352 HydrophobicContact SD-CZ 3.76Å; Q348-F352 WeakPolarHBondContact O-CB 3.43Å; Q348-F352 PolarHBondContact O-N 2.03Å; L349-F352 PolarHBondContact O-N 3.41Å; Q350-F352 VanDerWaalsContact C-N 3.34Å; Q350-F352 PolarHBondContact O-N 3.12Å; F352-F356 HydrophobicContact CE1-CE2 4.34Å; F352-F356 HydrophobicContact CE2-CE2 4.09Å; F352-F356 AromaticContact CZ-CE2 3.9Å; F352-F356 HydrophobicContact CZ-CE2 3.9Å; F352-F356 WeakPolarHBondContact O-CD2 3.38Å; F352-F356 WeakPolarHBondContact O-CE2 3.31Å
353	Y	98.7	Very high	97.9	Very high	1 Å²	1	57.3 Å²	57.3	0%	0.004	27%	0.273	C	S	.	.	H	α-helix	trans	-79.5	-27.9	-178.2	-76.2	-64.3	0	0	0	113.9	P211 V212 I252 M256 L349 Q350 E351 F356 N357	P211-Y353 HydrophobicContact CB-CD1 3.57Å; P211-Y353 HydrophobicContact CB-CD2 3.6Å; P211-Y353 HydrophobicContact CB-CE1 3.58Å; P211-Y353 HydrophobicContact CB-CE2 3.63Å; P211-Y353 HydrophobicContact CB-CG 3.58Å; P211-Y353 HydrophobicContact CG-CD1 4.13Å; P211-Y353 HydrophobicContact CG-CG 4.15Å; V212-Y353 HydrophobicContact CG2-CD2 3.69Å; V212-Y353 HydrophobicContact CG2-CE2 4Å; I252-Y353 WeakPolarHBondContact CA-OH 2.9Å; I252-Y353 HydrophobicContact CG2-CE1 4.49Å; I252-Y353 PolarHBondContact O-OH 3.03Å; I252-Y353 VanDerWaalsContact O-OH 3.13Å; M256-Y353 HydrophobicContact CG-CD1 4.45Å; M256-Y353 HydrophobicContact CG-CE1 4.14Å; L349-Y353 HydrophobicContact CB-CE2 4.47Å; L349-Y353 WeakPolarHBondContact O-CD2 3.29Å; L349-Y353 PolarHBondContact O-N 3.35Å; Q350-Y353 PolarHBondContact O-N 3.32Å; E351-Y353 PolarHBondContact O-N 2.99Å; Y353-F356 CarbonylContact O-C 3.47Å; Y353-F356 WeakPolarHBondContact O-CA 3.47Å; Y353-F356 WeakPolarHBondContact O-CB 3.33Å; Y353-F356 PolarHBondContact O-N 2.68Å; Y353-N357 PolarHBondContact O-N 2.85Å
354	R	98.6	Very high	98	Very high	82 Å²	82	52.9 Å²	52.9	31%	0.309	25%	0.254	S	S	.	.	H	α-helix	trans	-47.9	-48	-173.6	-163.1	-177.3	-56.6	116.3	8	114.9	Q350 E351 F356 N357 I358 D371	Q350-R354 PolarHBondContact O-N 3.46Å; E351-R354 IonicContact OE1-CZ 3.8Å; E351-R354 IonicContact OE1-NH1 2.75Å; E351-R354 PolarHBondContact OE1-NH1 2.67Å; E351-R354 IonicContact OE2-CZ 3.19Å; E351-R354 IonicContact OE2-NH1 2.83Å; E351-R354 PolarHBondContact OE2-NH1 3.45Å; E351-R354 IonicContact OE2-NH2 2.7Å; E351-R354 PolarHBondContact OE2-NH2 3.47Å; R354-F356 VanDerWaalsContact C-N 3.31Å; R354-F356 PolarHBondContact O-N 2.98Å; R354-N357 WeakPolarHBondContact O-CB 3.36Å; R354-N357 PolarHBondContact O-N 2.88Å; R354-I358 HydrophobicContact CG-CD1 3.91Å; R354-I358 HydrophobicContact CG-CG1 4.35Å; R354-I358 WeakPolarHBondContact O-CG1 3.45Å; R354-I358 PolarHBondContact O-N 3.5Å; R354-D371 WeakPolarHBondContact CA-OD1 3.25Å; R354-D371 HydrophobicContact CG-CB 4.19Å
355	P	98.5	Very high	98.1	Very high	83 Å²	83	51.9 Å²	51.9	54%	0.539	27%	0.27	S	S	.	.	H	α-helix	trans	-64.3	-32.1	177.6	24.4	-34.6	0	0	0	113.6	E351 K359	E351-P355 WeakPolarHBondContact O-CD 3.32Å; P355-K359 PolarHBondContact O-N 3.18Å
356	F	98.7	Very high	98.2	Very high	52 Å²	52	54.8 Å²	54.8	23%	0.228	28%	0.283	C	S	.	.	H	α-helix	trans	-74.5	-33.7	174	-57.4	-79.3	0	0	0	112.1	M256 I258 L259 F352 Y353 R354 F360	M256-F356 HydrophobicContact CB-CD1 4.3Å; M256-F356 HydrophobicContact CB-CG 4.41Å; M256-F356 HydrophobicContact CG-CD1 4.43Å; M256-F356 HydrophobicContact CG-CD2 4.29Å; M256-F356 HydrophobicContact CG-CE2 4.37Å; M256-F356 HydrophobicContact CG-CG 4.32Å; M256-F356 HydrophobicContact CG-CZ 4.49Å; M256-F356 HydrophobicContact SD-CD1 4.42Å; M256-F356 HydrophobicContact SD-CD2 4.44Å; M256-F356 HydrophobicContact SD-CE1 3.93Å; M256-F356 HydrophobicContact SD-CE2 3.95Å; M256-F356 HydrophobicContact SD-CZ 3.67Å; I258-F356 HydrophobicContact CG2-CB 4.06Å; I258-F356 HydrophobicContact CG2-CD1 3.97Å; L259-F356 HydrophobicContact CD1-CD1 4.38Å; L259-F356 HydrophobicContact CD1-CE1 3.96Å; L259-F356 HydrophobicContact CD2-CD1 4.47Å; L259-F356 HydrophobicContact CD2-CE1 4.29Å; L259-F356 HydrophobicContact CG-CD1 4.25Å; L259-F356 HydrophobicContact CG-CE1 4.22Å; F352-F356 HydrophobicContact CE1-CE2 4.34Å; F352-F356 HydrophobicContact CE2-CE2 4.09Å; F352-F356 AromaticContact CZ-CE2 3.9Å; F352-F356 HydrophobicContact CZ-CE2 3.9Å; F352-F356 WeakPolarHBondContact O-CD2 3.38Å; F352-F356 WeakPolarHBondContact O-CE2 3.31Å; Y353-F356 CarbonylContact O-C 3.47Å; Y353-F356 WeakPolarHBondContact O-CA 3.47Å; Y353-F356 WeakPolarHBondContact O-CB 3.33Å; Y353-F356 PolarHBondContact O-N 2.68Å; R354-F356 VanDerWaalsContact C-N 3.31Å; R354-F356 PolarHBondContact O-N 2.98Å; F356-F360 VanDerWaalsContact O-CB 3.22Å; F356-F360 WeakPolarHBondContact O-CB 3.02Å; F356-F360 PolarHBondContact O-N 2.96Å
357	N	98.8	Very high	98.2	Very high	3 Å²	3	56.4 Å²	56.4	2%	0.016	29%	0.292	C	S	.	.	H	α-helix	trans	-67.6	-50.4	177	-69	-17.1	0	0	0	111.2	P211 Y353 R354 K359 F360 Y361 D371	P211-N357 WeakPolarHBondContact CG-OD1 3.37Å; Y353-N357 PolarHBondContact O-N 2.85Å; R354-N357 WeakPolarHBondContact O-CB 3.36Å; R354-N357 PolarHBondContact O-N 2.88Å; N357-K359 PolarHBondContact O-N 2.88Å; N357-F360 WeakPolarHBondContact O-CA 3.01Å; N357-F360 WeakPolarHBondContact O-CB 3.4Å; N357-F360 PolarHBondContact O-N 3Å; N357-F360 VanDerWaalsContact O-N 3.11Å; N357-Y361 HydrophobicContact CB-CE1 4.45Å; N357-Y361 HydrophobicContact CB-CE2 4.01Å; N357-Y361 WeakPolarHBondContact O-CD1 3.22Å; N357-Y361 WeakPolarHBondContact O-CD2 3.36Å; N357-Y361 PolarHBondContact O-N 3.33Å; N357-D371 VanDerWaalsContact CB-OD2 3.28Å; N357-D371 WeakPolarHBondContact CB-OD2 3.46Å; N357-D371 PolarHBondContact ND2-OD1 3.31Å; N357-D371 PolarHBondContact ND2-OD2 3.43Å
358	I	98.6	Very high	98.2	Very high	76 Å²	76	52.1 Å²	52.1	39%	0.39	27%	0.272	S	S	.	.	H	α-helix	trans	-55.3	-54.2	177.4	-68.4	168.1	0	0	0	110.2	R354 F360 Y361 E362	R354-I358 HydrophobicContact CG-CD1 3.91Å; R354-I358 HydrophobicContact CG-CG1 4.35Å; R354-I358 WeakPolarHBondContact O-CG1 3.45Å; R354-I358 PolarHBondContact O-N 3.5Å; I358-F360 PolarHBondContact O-N 2.68Å; I358-Y361 WeakPolarHBondContact O-CB 3.45Å; I358-Y361 PolarHBondContact O-N 2.74Å; I358-E362 HydrophobicContact CG2-CG 4.44Å; I358-E362 WeakPolarHBondContact O-CG 3.46Å; I358-E362 PolarHBondContact O-N 3.12Å
359	K	98.7	Very high	98.2	Very high	94 Å²	94	57.6 Å²	57.6	41%	0.409	30%	0.295	S	S	.	.	H	α-helix	trans	-61.2	-33.4	179.1	-164.5	-175.4	176.8	-165	0	112.3	I258 E262 P355 N357 T363	I258-K359 HydrophobicContact CD1-CG 4.43Å; I258-K359 HydrophobicContact CG1-CB 4.31Å; I258-K359 HydrophobicContact CG1-CD 3.86Å; I258-K359 HydrophobicContact CG1-CG 3.94Å; E262-K359 IonicContact OE1-NZ 3.81Å; E262-K359 PolarHBondContact OE1-NZ 3.07Å; P355-K359 PolarHBondContact O-N 3.18Å; N357-K359 PolarHBondContact O-N 2.88Å; K359-T363 VanDerWaalsContact O-CB 3.27Å; K359-T363 WeakPolarHBondContact O-CB 3.49Å; K359-T363 PolarHBondContact O-N 3.23Å; K359-T363 VanDerWaalsContact O-N 3.07Å; K359-T363 PolarHBondContact O-OG1 3.44Å
360	F	98.8	Very high	98.1	Very high	1 Å²	1	58.1 Å²	58.1	0%	0.004	30%	0.297	C	S	.	.	H	α-helix	trans	-65.2	-48.5	172.7	176.5	-103.6	0	0	0	111.6	V208 I258 L261 F275 F356 N357 I358 E362 T363 V364 F368 W370	V208-F360 HydrophobicContact CG1-CE1 4.32Å; V208-F360 HydrophobicContact CG1-CZ 3.84Å; V208-F360 HydrophobicContact CG2-CE1 4.48Å; I258-F360 HydrophobicContact CB-CB 4.19Å; L261-F360 HydrophobicContact CD2-CD2 3.97Å; L261-F360 HydrophobicContact CD2-CE2 3.97Å; F275-F360 HydrophobicContact CD1-CE2 4.09Å; F275-F360 AromaticContact CD1-CZ 3.69Å; F275-F360 HydrophobicContact CD1-CZ 3.69Å; F275-F360 HydrophobicContact CE1-CE2 4.01Å; F275-F360 HydrophobicContact CE1-CZ 4.1Å; F275-F360 HydrophobicContact CG-CZ 4.34Å; F356-F360 VanDerWaalsContact O-CB 3.22Å; F356-F360 WeakPolarHBondContact O-CB 3.02Å; F356-F360 PolarHBondContact O-N 2.96Å; N357-F360 WeakPolarHBondContact O-CA 3.01Å; N357-F360 WeakPolarHBondContact O-CB 3.4Å; N357-F360 PolarHBondContact O-N 3Å; N357-F360 VanDerWaalsContact O-N 3.11Å; I358-F360 PolarHBondContact O-N 2.68Å; F360-E362 PolarHBondContact O-N 2.91Å; F360-T363 PolarHBondContact O-N 2.76Å; F360-V364 HydrophobicContact CD2-CG1 4.1Å; F360-V364 HydrophobicContact CE1-CG2 4.17Å; F360-V364 HydrophobicContact CE2-CG1 3.69Å; F360-V364 HydrophobicContact CZ-CG1 3.95Å; F360-V364 HydrophobicContact CZ-CG2 4.26Å; F360-V364 WeakPolarHBondContact O-CG2 3.22Å; F360-V364 PolarHBondContact O-N 3.48Å; F360-F368 AromaticContact CE1-CD2 4Å; F360-F368 HydrophobicContact CE1-CD2 4Å; F360-F368 AromaticContact CE1-CE2 3.75Å; F360-F368 HydrophobicContact CE1-CE2 3.75Å; F360-F368 HydrophobicContact CE1-CZ 4.45Å; F360-F368 HydrophobicContact CZ-CE2 4.49Å; F360-W370 HydrophobicContact CD1-CH2 4.19Å; F360-W370 HydrophobicContact CD1-CZ3 4.09Å; F360-W370 AromaticContact CE1-CH2 3.9Å; F360-W370 HydrophobicContact CE1-CH2 3.9Å; F360-W370 HydrophobicContact CE1-CZ3 4.28Å
361	Y	98.6	Very high	97.3	Very high	23 Å²	23	60 Å²	60	9%	0.09	31%	0.309	C	S	.	.	H	α-helix	trans	-58.9	-46.3	179	-55.3	-29.2	0	0	0	112.4	N357 I358 V364 G365 Q366 D367 F368 W370 D371	N357-Y361 HydrophobicContact CB-CE1 4.45Å; N357-Y361 HydrophobicContact CB-CE2 4.01Å; N357-Y361 WeakPolarHBondContact O-CD1 3.22Å; N357-Y361 WeakPolarHBondContact O-CD2 3.36Å; N357-Y361 PolarHBondContact O-N 3.33Å; I358-Y361 WeakPolarHBondContact O-CB 3.45Å; I358-Y361 PolarHBondContact O-N 2.74Å; Y361-V364 PolarHBondContact O-N 3.11Å; Y361-G365 WeakPolarHBondContact O-CA 3.13Å; Y361-G365 PolarHBondContact O-N 2.93Å; Y361-Q366 WeakPolarHBondContact CA-O 3.04Å; Y361-Q366 WeakPolarHBondContact CD1-O 3.37Å; Y361-Q366 PolarHBondContact O-N 2.76Å; Y361-Q366 VanDerWaalsContact O-N 3.15Å; Y361-D367 HydrophobicContact CG-CB 4.49Å; Y361-F368 AromaticContact CD1-CD2 3.8Å; Y361-F368 HydrophobicContact CD1-CD2 3.8Å; Y361-F368 HydrophobicContact CE1-CB 3.81Å; Y361-F368 AromaticContact CE1-CD2 3.86Å; Y361-F368 HydrophobicContact CE1-CD2 3.86Å; Y361-F368 HydrophobicContact CE1-CG 4.31Å; Y361-W370 HydrophobicContact CE1-CD2 4.31Å; Y361-W370 AromaticContact CE1-CE3 3.72Å; Y361-W370 HydrophobicContact CE1-CE3 3.72Å; Y361-W370 HydrophobicContact CE1-CH2 4.43Å; Y361-W370 AromaticContact CE1-CZ3 3.78Å; Y361-W370 HydrophobicContact CE1-CZ3 3.78Å; Y361-W370 AromaticContact CZ-CE3 3.89Å; Y361-W370 WeakPolarHBondContact OH-CB 3.37Å; Y361-W370 PolarHBondContact OH-N 3.23Å; Y361-D371 WeakPolarHBondContact CE2-OD2 2.99Å; Y361-D371 PolarHBondContact OH-OD2 3.47Å
362	E	98.4	Very high	97.3	Very high	140 Å²	140	57.5 Å²	57.5	65%	0.654	30%	0.298	S	S	*	.	H	α-helix	trans	-57.9	-48	174.9	-68.7	169.6	161.5	0	0	111.1	I358 F360 V364 G365	I358-E362 HydrophobicContact CG2-CG 4.44Å; I358-E362 WeakPolarHBondContact O-CG 3.46Å; I358-E362 PolarHBondContact O-N 3.12Å; F360-E362 PolarHBondContact O-N 2.91Å; E362-V364 PolarHBondContact O-N 3.07Å; E362-G365 PolarHBondContact O-N 3.31Å
363	T	98.6	Very high	97.2	Very high	44 Å²	44	58.2 Å²	58.2	27%	0.27	30%	0.304	S	S	.	.	H	α-helix	trans	-66.9	-33.8	-177.2	-58.2	0	0	0	0	112.9	I258 L261 L265 L270 K359 F360	I258-T363 HydrophobicContact CD1-CG2 3.92Å; I258-T363 WeakPolarHBondContact CD1-OG1 3.09Å; L261-T363 HydrophobicContact CD2-CG2 3.71Å; L261-T363 HydrophobicContact CG-CG2 4.47Å; L265-T363 HydrophobicContact CD1-CG2 3.7Å; L270-T363 WeakPolarHBondContact CD2-O 3.14Å; K359-T363 VanDerWaalsContact O-CB 3.27Å; K359-T363 WeakPolarHBondContact O-CB 3.49Å; K359-T363 PolarHBondContact O-N 3.23Å; K359-T363 VanDerWaalsContact O-N 3.07Å; K359-T363 PolarHBondContact O-OG1 3.44Å; F360-T363 PolarHBondContact O-N 2.76Å
364	V	98.2	Very high	97.1	Very high	17 Å²	17	61.4 Å²	61.4	10%	0.103	32%	0.321	C	S	.	.	H	α-helix	trans	-97.3	-4.5	-179.7	-52.3	0	0	0	0	114.3	L261 L270 F275 F360 Y361 E362 Q366 F368	L261-V364 HydrophobicContact CD2-CG1 3.51Å; L270-V364 HydrophobicContact CD1-CG1 4.3Å; F275-V364 HydrophobicContact CD1-CG1 4.27Å; F275-V364 HydrophobicContact CD2-CB 3.87Å; F275-V364 HydrophobicContact CD2-CG1 3.83Å; F275-V364 HydrophobicContact CE1-CG1 4.03Å; F275-V364 HydrophobicContact CE2-CB 3.99Å; F275-V364 HydrophobicContact CE2-CG1 3.58Å; F275-V364 HydrophobicContact CG-CB 4.38Å; F275-V364 HydrophobicContact CG-CG1 4.18Å; F275-V364 HydrophobicContact CZ-CG1 3.69Å; F360-V364 HydrophobicContact CD2-CG1 4.1Å; F360-V364 HydrophobicContact CE1-CG2 4.17Å; F360-V364 HydrophobicContact CE2-CG1 3.69Å; F360-V364 HydrophobicContact CZ-CG1 3.95Å; F360-V364 HydrophobicContact CZ-CG2 4.26Å; F360-V364 WeakPolarHBondContact O-CG2 3.22Å; F360-V364 PolarHBondContact O-N 3.48Å; Y361-V364 PolarHBondContact O-N 3.11Å; E362-V364 PolarHBondContact O-N 3.07Å; V364-Q366 VanDerWaalsContact C-N 3.25Å; V364-Q366 HydrophobicContact CG2-CB 4.1Å; V364-Q366 PolarHBondContact O-N 3.47Å; V364-F368 HydrophobicContact CG2-CE2 3.95Å
365	G	97.9	Very high	97.1	Very high	75 Å²	75	60.2 Å²	60.2	77%	0.773	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	22.5	-176.9	0	0	0	0	0	114.3	Y361 E362	Y361-G365 WeakPolarHBondContact O-CA 3.13Å; Y361-G365 PolarHBondContact O-N 2.93Å; E362-G365 PolarHBondContact O-N 3.31Å
366	Q	97.1	Very high	97	Very high	60 Å²	60	58.8 Å²	58.8	28%	0.28	31%	0.308	S	S	.	.			trans	-145.4	121.3	-177	-179.2	-179.9	-23.9	0	0	111.3	Y361 V364 F368	Y361-Q366 WeakPolarHBondContact CA-O 3.04Å; Y361-Q366 WeakPolarHBondContact CD1-O 3.37Å; Y361-Q366 PolarHBondContact O-N 2.76Å; Y361-Q366 VanDerWaalsContact O-N 3.15Å; V364-Q366 VanDerWaalsContact C-N 3.25Å; V364-Q366 HydrophobicContact CG2-CB 4.1Å; V364-Q366 PolarHBondContact O-N 3.47Å; Q366-F368 HydrophobicContact CB-CE2 3.87Å; Q366-F368 HydrophobicContact CB-CZ 4.27Å; Q366-F368 HydrophobicContact CG-CD2 4.2Å; Q366-F368 HydrophobicContact CG-CE1 4.49Å; Q366-F368 HydrophobicContact CG-CE2 3.68Å; Q366-F368 HydrophobicContact CG-CZ 3.83Å; Q366-F368 WeakPolarHBondContact O-CD2 3.43Å; Q366-F368 VanDerWaalsContact O-CE2 3.24Å; Q366-F368 WeakPolarHBondContact O-CE2 3.36Å
367	D	97.5	Very high	96.9	Very high	76 Å²	76	59.2 Å²	59.2	41%	0.406	31%	0.313	S	S	.	.			trans	-82.5	131.2	169.4	-177.8	-18.8	0	0	0	110.1	Y361 K369	Y361-D367 HydrophobicContact CG-CB 4.49Å; D367-K369 WeakPolarHBondContact OD1-CD 3.16Å; D367-K369 PolarHBondContact OD1-N 3.44Å; D367-K369 IonicContact OD1-NZ 2.73Å; D367-K369 WeakPolarHBondContact OD2-CE 3.39Å; D367-K369 IonicContact OD2-NZ 3.48Å; D367-K369 PolarHBondContact OD2-NZ 3.47Å
368	F	97.7	Very high	96.7	Very high	13 Å²	13	63.2 Å²	63.2	6%	0.057	33%	0.334	C	S	.	.			trans	-103.9	-0.4	-178.5	-68.5	-101.4	0	0	0	114.3	V208 F275 F360 Y361 V364 Q366 W370	V208-F368 HydrophobicContact CG2-CD1 3.64Å; V208-F368 HydrophobicContact CG2-CE1 3.31Å; V208-F368 HydrophobicContact CG2-CE2 4.41Å; V208-F368 HydrophobicContact CG2-CG 4.34Å; V208-F368 HydrophobicContact CG2-CZ 3.76Å; F275-F368 HydrophobicContact CB-CE1 4.46Å; F275-F368 HydrophobicContact CB-CE2 4.47Å; F275-F368 HydrophobicContact CB-CZ 3.65Å; F360-F368 AromaticContact CE1-CD2 4Å; F360-F368 HydrophobicContact CE1-CD2 4Å; F360-F368 AromaticContact CE1-CE2 3.75Å; F360-F368 HydrophobicContact CE1-CE2 3.75Å; F360-F368 HydrophobicContact CE1-CZ 4.45Å; F360-F368 HydrophobicContact CZ-CE2 4.49Å; Y361-F368 AromaticContact CD1-CD2 3.8Å; Y361-F368 HydrophobicContact CD1-CD2 3.8Å; Y361-F368 HydrophobicContact CE1-CB 3.81Å; Y361-F368 AromaticContact CE1-CD2 3.86Å; Y361-F368 HydrophobicContact CE1-CD2 3.86Å; Y361-F368 HydrophobicContact CE1-CG 4.31Å; V364-F368 HydrophobicContact CG2-CE2 3.95Å; Q366-F368 HydrophobicContact CB-CE2 3.87Å; Q366-F368 HydrophobicContact CB-CZ 4.27Å; Q366-F368 HydrophobicContact CG-CD2 4.2Å; Q366-F368 HydrophobicContact CG-CE1 4.49Å; Q366-F368 HydrophobicContact CG-CE2 3.68Å; Q366-F368 HydrophobicContact CG-CZ 3.83Å; Q366-F368 WeakPolarHBondContact O-CD2 3.43Å; Q366-F368 VanDerWaalsContact O-CE2 3.24Å; Q366-F368 WeakPolarHBondContact O-CE2 3.36Å; F368-W370 HydrophobicContact CB-CD2 3.84Å; F368-W370 HydrophobicContact CB-CE3 4.39Å; F368-W370 HydrophobicContact CB-CG 4.31Å; F368-W370 HydrophobicContact CB-CH2 4.02Å; F368-W370 HydrophobicContact CB-CZ2 3.44Å; F368-W370 VanDerWaalsContact CB-CZ2 3.44Å; F368-W370 HydrophobicContact CB-CZ3 4.47Å; F368-W370 HydrophobicContact CD1-CH2 4.45Å; F368-W370 AromaticContact CD1-CZ2 3.83Å; F368-W370 HydrophobicContact CD1-CZ2 3.83Å; F368-W370 HydrophobicContact CD2-CH2 4.28Å; F368-W370 HydrophobicContact CD2-CZ2 4.34Å; F368-W370 AromaticContact CG-CH2 3.99Å; F368-W370 HydrophobicContact CG-CH2 3.99Å; F368-W370 AromaticContact CG-CZ2 3.61Å; F368-W370 HydrophobicContact CG-CZ2 3.61Å
369	K	96.2	Very high	96.6	Very high	160 Å²	160	62.2 Å²	62.2	70%	0.696	33%	0.33	S	S	*	.			trans	54.6	52.9	177.2	-55.2	-62.2	178.8	-168.7	0	113.3	D367	D367-K369 WeakPolarHBondContact OD1-CD 3.16Å; D367-K369 PolarHBondContact OD1-N 3.44Å; D367-K369 IonicContact OD1-NZ 2.73Å; D367-K369 WeakPolarHBondContact OD2-CE 3.39Å; D367-K369 IonicContact OD2-NZ 3.48Å; D367-K369 PolarHBondContact OD2-NZ 3.47Å
370	W	96.9	Very high	96.4	Very high	11 Å²	11	59.6 Å²	59.6	4%	0.042	32%	0.324	C	S	.	.			trans	-97.2	-8	173.2	-54.7	-32.4	0	0	0	114.1	V208 R209 N210 P211 Y257 E279 F360 Y361 F368	V208-W370 HydrophobicContact CB-CH2 3.76Å; V208-W370 HydrophobicContact CB-CZ2 3.84Å; V208-W370 HydrophobicContact CG2-CH2 3.83Å; V208-W370 HydrophobicContact CG2-CZ2 3.7Å; R209-W370 VanDerWaalsContact C-CE2 3.43Å; N210-W370 VanDerWaalsContact CA-CG 3.49Å; N210-W370 HydrophobicContact CB-CB 3.98Å; N210-W370 HydrophobicContact CB-CD2 4.39Å; N210-W370 HydrophobicContact CB-CG 3.71Å; N210-W370 VanDerWaalsContact N-CE2 3.35Å; N210-W370 VanDerWaalsContact N-NE1 3.14Å; N210-W370 PolarHBondContact ND2-O 3.4Å; P211-W370 HydrophobicContact CG-CE3 4.28Å; P211-W370 HydrophobicContact CG-CZ3 4.45Å; Y257-W370 AromaticContact CD2-CH2 3.74Å; Y257-W370 HydrophobicContact CD2-CH2 3.74Å; Y257-W370 AromaticContact CD2-CZ3 3.71Å; Y257-W370 HydrophobicContact CD2-CZ3 3.71Å; Y257-W370 AromaticContact CE2-CH2 3.5Å; Y257-W370 HydrophobicContact CE2-CH2 3.5Å; Y257-W370 HydrophobicContact CE2-CZ2 4.32Å; Y257-W370 AromaticContact CE2-CZ3 3.64Å; Y257-W370 HydrophobicContact CE2-CZ3 3.64Å; E279-W370 PolarHBondContact OE2-NE1 3.42Å; F360-W370 HydrophobicContact CD1-CH2 4.19Å; F360-W370 HydrophobicContact CD1-CZ3 4.09Å; F360-W370 AromaticContact CE1-CH2 3.9Å; F360-W370 HydrophobicContact CE1-CH2 3.9Å; F360-W370 HydrophobicContact CE1-CZ3 4.28Å; Y361-W370 HydrophobicContact CE1-CD2 4.31Å; Y361-W370 AromaticContact CE1-CE3 3.72Å; Y361-W370 HydrophobicContact CE1-CE3 3.72Å; Y361-W370 HydrophobicContact CE1-CH2 4.43Å; Y361-W370 AromaticContact CE1-CZ3 3.78Å; Y361-W370 HydrophobicContact CE1-CZ3 3.78Å; Y361-W370 AromaticContact CZ-CE3 3.89Å; Y361-W370 WeakPolarHBondContact OH-CB 3.37Å; Y361-W370 PolarHBondContact OH-N 3.23Å; F368-W370 HydrophobicContact CB-CD2 3.84Å; F368-W370 HydrophobicContact CB-CE3 4.39Å; F368-W370 HydrophobicContact CB-CG 4.31Å; F368-W370 HydrophobicContact CB-CH2 4.02Å; F368-W370 HydrophobicContact CB-CZ2 3.44Å; F368-W370 VanDerWaalsContact CB-CZ2 3.44Å; F368-W370 HydrophobicContact CB-CZ3 4.47Å; F368-W370 HydrophobicContact CD1-CH2 4.45Å; F368-W370 AromaticContact CD1-CZ2 3.83Å; F368-W370 HydrophobicContact CD1-CZ2 3.83Å; F368-W370 HydrophobicContact CD2-CH2 4.28Å; F368-W370 HydrophobicContact CD2-CZ2 4.34Å; F368-W370 AromaticContact CG-CH2 3.99Å; F368-W370 HydrophobicContact CG-CH2 3.99Å; F368-W370 AromaticContact CG-CZ2 3.61Å; F368-W370 HydrophobicContact CG-CZ2 3.61Å
371	D	80.9	Confident	96.2	Very high	95 Å²	95	64.9 Å²	64.9	51%	0.508	35%	0.353	S	S	.	.			trans	-128	0	-170.7	-46.4	-92.4	0	0	0	110.2	R354 N357 Y361	R354-D371 WeakPolarHBondContact CA-OD1 3.25Å; R354-D371 HydrophobicContact CG-CB 4.19Å; N357-D371 VanDerWaalsContact CB-OD2 3.28Å; N357-D371 WeakPolarHBondContact CB-OD2 3.46Å; N357-D371 PolarHBondContact ND2-OD1 3.31Å; N357-D371 PolarHBondContact ND2-OD2 3.43Å; Y361-D371 WeakPolarHBondContact CE2-OD2 2.99Å; Y361-D371 PolarHBondContact OH-OD2 3.47Å

Retrieved 371 of 371 residues in 225.5 ms (Link to these results)

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