A0A087YD24_POEFO Loading...

Glucagon receptor b

AlphaFold DB , UniProt , Accession A0A087YD24, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 419 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	K	44.8	Very low	48.5	Very low	156 Å²	156	109 Å²	109	68%	0.678	55%	0.55	S	S	*	*				0	-49.9	0	-86.1	-173.9	169.6	-167.7	0	112.9	S164	K1-S164 PolarHBondContact NZ-O 2.78Å
2	T	39.8	Very low	48.5	Very low	105 Å²	105	103.5 Å²	103.5	64%	0.644	52%	0.523	S	S	*	.	H	α-helix	trans	-76.9	-28.9	-174.9	-15.9	0	0	0	0	115.6	K6	T2-K6 WeakPolarHBondContact O-CG 3.34Å; T2-K6 PolarHBondContact O-N 3.05Å
3	R	44.3	Very low	48.6	Very low	226 Å²	226	103 Å²	103	85%	0.853	52%	0.522	S	S	*	.	H	α-helix	trans	-69.9	-39	179.7	-70.9	-173.6	-175.8	178.4	1.1	113.4	K6 A7	R3-K6 PolarHBondContact O-N 3.1Å; R3-A7 WeakPolarHBondContact O-CB 3.41Å; R3-A7 PolarHBondContact O-N 2.93Å
4	I	47.2	Very low	48.8	Very low	118 Å²	118	105.5 Å²	105.5	61%	0.605	53%	0.528	S	S	*	.	H	α-helix	trans	-69.2	-41.1	-179.9	-65.5	163.8	0	0	0	111	A7 L8	I4-A7 PolarHBondContact O-N 3.5Å; I4-L8 HydrophobicContact CG2-CD1 4.06Å; I4-L8 PolarHBondContact O-N 3.28Å
5	V	43.8	Very low	48.8	Very low	58 Å²	58	100.3 Å²	100.3	35%	0.352	50%	0.502	S	S	.	.	H	α-helix	trans	-66.3	-42.1	177.1	178.2	0	0	0	0	111	A7 L8 V9	V5-A7 VanDerWaalsContact C-N 3.35Å; V5-A7 PolarHBondContact O-N 3.35Å; V5-L8 PolarHBondContact O-N 3.27Å; V5-V9 WeakPolarHBondContact O-CG2 3.4Å; V5-V9 PolarHBondContact O-N 3.18Å
6	K	48.8	Very low	48.5	Very low	146 Å²	146	101 Å²	101	64%	0.635	51%	0.507	S	S	*	.	H	α-helix	trans	-62.3	-40.8	174.1	-77.8	-173.4	175.9	-170.4	0	112.3	T2 R3 V9 L10	T2-K6 WeakPolarHBondContact O-CG 3.34Å; T2-K6 PolarHBondContact O-N 3.05Å; R3-K6 PolarHBondContact O-N 3.1Å; K6-V9 PolarHBondContact O-N 3.38Å; K6-L10 WeakPolarHBondContact O-CB 3.49Å; K6-L10 PolarHBondContact O-N 3.08Å
7	A	55	Low	48.3	Very low	59 Å²	59	103.4 Å²	103.4	49%	0.488	52%	0.521	S	S	.	.	H	α-helix	trans	-64	-42.2	177	0	0	0	0	0	112.3	R3 I4 V5 L10 L11	R3-A7 WeakPolarHBondContact O-CB 3.41Å; R3-A7 PolarHBondContact O-N 2.93Å; I4-A7 PolarHBondContact O-N 3.5Å; V5-A7 VanDerWaalsContact C-N 3.35Å; V5-A7 PolarHBondContact O-N 3.35Å; A7-L10 PolarHBondContact O-N 3.41Å; A7-L11 WeakPolarHBondContact O-CB 3.48Å; A7-L11 PolarHBondContact O-N 3.48Å
8	L	46.2	Very low	47.9	Very low	41 Å²	41	101.3 Å²	101.3	22%	0.215	51%	0.509	C	S	.	.	H	α-helix	trans	-63.7	-41.2	176	-92	151.7	0	0	0	112.7	I4 V5 L11 L12 I156	I4-L8 HydrophobicContact CG2-CD1 4.06Å; I4-L8 PolarHBondContact O-N 3.28Å; V5-L8 PolarHBondContact O-N 3.27Å; L8-L11 PolarHBondContact O-N 3.02Å; L8-L12 WeakPolarHBondContact O-CB 3.49Å; L8-L12 PolarHBondContact O-N 2.91Å; L8-I156 HydrophobicContact CD2-CD1 4.2Å; L8-I156 HydrophobicContact CD2-CG1 4.34Å
9	V	52.7	Low	47.2	Very low	79 Å²	79	101.8 Å²	101.8	48%	0.479	51%	0.513	S	S	.	.	H	α-helix	trans	-68.6	-41.1	178	171.8	0	0	0	0	111.6	V5 K6 L11 L12 L13	V5-V9 WeakPolarHBondContact O-CG2 3.4Å; V5-V9 PolarHBondContact O-N 3.18Å; K6-V9 PolarHBondContact O-N 3.38Å; V9-L11 VanDerWaalsContact C-N 3.35Å; V9-L12 WeakPolarHBondContact O-CB 3.44Å; V9-L12 PolarHBondContact O-N 2.73Å; V9-L13 HydrophobicContact CG1-CD1 4.09Å; V9-L13 PolarHBondContact O-N 2.89Å
10	L	56.4	Low	46.5	Very low	121 Å²	121	105.8 Å²	105.8	63%	0.634	53%	0.53	S	S	*	.	H	α-helix	trans	-63.8	-39.8	174.4	-96.4	148.9	0	0	0	112.2	K6 A7 L12 L13 F14	K6-L10 WeakPolarHBondContact O-CB 3.49Å; K6-L10 PolarHBondContact O-N 3.08Å; A7-L10 PolarHBondContact O-N 3.41Å; L10-L12 VanDerWaalsContact C-N 3.31Å; L10-L12 PolarHBondContact O-N 3.03Å; L10-L13 PolarHBondContact O-N 3.35Å; L10-F14 WeakPolarHBondContact O-CB 3.48Å; L10-F14 PolarHBondContact O-N 3.43Å
11	L	54.4	Low	45.8	Very low	90 Å²	90	106.6 Å²	106.6	47%	0.471	54%	0.54	S	S	.	.	H	α-helix	trans	-61.9	-41.4	174.4	-161.8	85.4	0	0	0	111	A7 L8 V9 F14 I15	A7-L11 WeakPolarHBondContact O-CB 3.48Å; A7-L11 PolarHBondContact O-N 3.48Å; L8-L11 PolarHBondContact O-N 3.02Å; V9-L11 VanDerWaalsContact C-N 3.35Å; L11-F14 PolarHBondContact O-N 3.5Å; L11-I15 HydrophobicContact CD2-CD1 4.28Å; L11-I15 HydrophobicContact CG-CD1 4.07Å; L11-I15 WeakPolarHBondContact O-CD1 3.35Å; L11-I15 WeakPolarHBondContact O-CG1 3.45Å; L11-I15 PolarHBondContact O-N 2.98Å
12	L	48.2	Very low	45.3	Very low	43 Å²	43	101.2 Å²	101.2	23%	0.225	53%	0.529	C	S	.	.	H	α-helix	trans	-66.4	-43.4	179.8	-139.3	135.3	0	0	0	112.4	L8 V9 L10 I15 L16 I156	L8-L12 WeakPolarHBondContact O-CB 3.49Å; L8-L12 PolarHBondContact O-N 2.91Å; V9-L12 WeakPolarHBondContact O-CB 3.44Å; V9-L12 PolarHBondContact O-N 2.73Å; L10-L12 VanDerWaalsContact C-N 3.31Å; L10-L12 PolarHBondContact O-N 3.03Å; L12-I15 PolarHBondContact O-N 3.48Å; L12-L16 HydrophobicContact CD2-CD1 4.05Å; L12-L16 WeakPolarHBondContact O-CG 3.27Å; L12-L16 PolarHBondContact O-N 3.39Å; L12-I156 HydrophobicContact CD1-CD1 3.29Å
13	L	50	Low	45	Very low	97 Å²	97	101 Å²	101	51%	0.508	53%	0.532	S	S	.	.	H	α-helix	trans	-63.5	-40.4	174.1	-86.6	155.4	0	0	0	111.8	V9 L10 I15 L16 L17	V9-L13 HydrophobicContact CG1-CD1 4.09Å; V9-L13 PolarHBondContact O-N 2.89Å; L10-L13 PolarHBondContact O-N 3.35Å; L13-I15 VanDerWaalsContact C-N 3.35Å; L13-L16 PolarHBondContact O-N 2.9Å; L13-L17 WeakPolarHBondContact O-CD1 3.34Å; L13-L17 PolarHBondContact O-N 3.47Å
14	F	51.8	Low	45	Very low	138 Å²	138	90.5 Å²	90.5	61%	0.605	49%	0.494	S	S	*	.	H	α-helix	trans	-65.5	-37.4	176.9	-173.4	-100.4	0	0	0	112.4	L10 L11 L17 Q18	L10-F14 WeakPolarHBondContact O-CB 3.48Å; L10-F14 PolarHBondContact O-N 3.43Å; L11-F14 PolarHBondContact O-N 3.5Å; F14-L17 PolarHBondContact O-N 3.27Å; F14-Q18 WeakPolarHBondContact O-CG 3.4Å
15	I	48.8	Very low	44.8	Very low	27 Å²	27	90.5 Å²	90.5	14%	0.138	49%	0.489	C	S	.	.	H	α-helix	trans	-70.2	-39.4	177.7	-68.4	163.1	0	0	0	111.4	L11 L12 L13 L17 Q18 V188 I191	L11-I15 HydrophobicContact CD2-CD1 4.28Å; L11-I15 HydrophobicContact CG-CD1 4.07Å; L11-I15 WeakPolarHBondContact O-CD1 3.35Å; L11-I15 WeakPolarHBondContact O-CG1 3.45Å; L11-I15 PolarHBondContact O-N 2.98Å; L12-I15 PolarHBondContact O-N 3.48Å; L13-I15 VanDerWaalsContact C-N 3.35Å; I15-L17 VanDerWaalsContact C-N 3.26Å; I15-L17 PolarHBondContact O-N 2.93Å; I15-Q18 PolarHBondContact O-N 3.49Å; I15-V188 HydrophobicContact CD1-CG1 4.23Å; I15-V188 HydrophobicContact CD1-CG2 4.14Å; I15-I191 HydrophobicContact CG2-CG2 4Å
16	L	43.3	Very low	45.1	Very low	112 Å²	112	91.4 Å²	91.4	59%	0.586	50%	0.495	S	S	*	.	H	α-helix	trans	-65.2	-29	177.2	-74.1	167.6	0	0	0	112.9	L12 L13 Q18	L12-L16 HydrophobicContact CD2-CD1 4.05Å; L12-L16 WeakPolarHBondContact O-CG 3.27Å; L12-L16 PolarHBondContact O-N 3.39Å; L13-L16 PolarHBondContact O-N 2.9Å; L16-Q18 VanDerWaalsContact C-N 3.3Å; L16-Q18 PolarHBondContact O-N 3.05Å
17	L	44.8	Very low	45.5	Very low	141 Å²	141	89.4 Å²	89.4	74%	0.738	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-7.4	178	-103.4	117.3	0	0	0	114.6	L13 F14 I15	L13-L17 WeakPolarHBondContact O-CD1 3.34Å; L13-L17 PolarHBondContact O-N 3.47Å; F14-L17 PolarHBondContact O-N 3.27Å; I15-L17 VanDerWaalsContact C-N 3.26Å; I15-L17 PolarHBondContact O-N 2.93Å
18	Q	41.5	Very low	45.4	Very low	67 Å²	67	88.7 Å²	88.7	31%	0.313	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	9.9	-176.2	-65.2	-74.2	-38.9	0	0	113.5	F14 I15 L16 E20	F14-Q18 WeakPolarHBondContact O-CG 3.4Å; I15-Q18 PolarHBondContact O-N 3.49Å; L16-Q18 VanDerWaalsContact C-N 3.3Å; L16-Q18 PolarHBondContact O-N 3.05Å; Q18-E20 PolarHBondContact O-N 3.16Å; Q18-E20 VanDerWaalsContact O-N 3.16Å
19	L	34.1	Very low	46.2	Very low	110 Å²	110	92.3 Å²	92.3	58%	0.576	49%	0.493	S	S	*	.			trans	-85.8	77.7	-177.5	-123.8	92.4	0	0	0	111.3
20	E	33.2	Very low	47.2	Very low	182 Å²	182	90 Å²	90	85%	0.85	48%	0.479	S	S	*	.			trans	-126.2	122.4	160.2	-83.1	-176.7	162.7	0	0	108.9	Q18	Q18-E20 PolarHBondContact O-N 3.16Å; Q18-E20 VanDerWaalsContact O-N 3.16Å
21	T	33.5	Very low	47.8	Very low	123 Å²	123	87.2 Å²	87.2	76%	0.755	46%	0.46	S	S	*	.			trans	-96.4	130.3	-172.2	45.7	0	0	0	0	111.6
22	G	32.8	Very low	48.7	Very low	42 Å²	42	87.5 Å²	87.5	43%	0.433	46%	0.462	S	S	.	.			trans	-147.7	127.6	166.8	0	0	0	0	0	111.2
23	S	33.9	Very low	50.3	Low	102 Å²	102	89.1 Å²	89.1	71%	0.713	47%	0.467	S	S	*	.			trans	-96.4	118.5	-176.3	-177.8	0	0	0	0	110.3
24	G	44	Very low	52.1	Low	5 Å²	5	86.8 Å²	86.8	5%	0.052	45%	0.452	C	S	.	.			trans	-133.8	1.5	-166.9	0	0	0	0	0	118.9	V26 L27	G24-V26 PolarHBondContact O-N 3.07Å; G24-L27 PolarHBondContact O-N 3.5Å
25	K	43.8	Very low	53.5	Low	118 Å²	118	82.1 Å²	82.1	51%	0.513	43%	0.433	S	S	.	.	H	α-helix	trans	-71.3	-35.6	-164	-156.3	-177.8	-178.3	-169.8	0	116.1	L201 V296	K25-L201 HydrophobicContact CB-CD2 4.16Å; K25-L201 HydrophobicContact CG-CD2 4.32Å; K25-V296 VanDerWaalsContact NZ-CG2 3.26Å
26	V	50.4	Low	55.3	Low	76 Å²	76	85.7 Å²	85.7	46%	0.461	45%	0.449	S	S	.	.	H	α-helix	trans	-80.1	-27.2	-178.9	177.7	0	0	0	0	111.7	G24 T30	G24-V26 PolarHBondContact O-N 3.07Å; V26-T30 PolarHBondContact O-OG1 2.88Å
27	L	56.5	Low	57.6	Low	105 Å²	105	81.5 Å²	81.5	55%	0.55	43%	0.425	S	S	.	.	H	α-helix	trans	-72.3	-35	-177.4	-173.1	62.7	0	0	0	111.8	G24 Y31 I205	G24-L27 PolarHBondContact O-N 3.5Å; L27-Y31 VanDerWaalsContact O-CB 3.27Å; L27-Y31 WeakPolarHBondContact O-CB 3.26Å; L27-Y31 PolarHBondContact O-N 3.41Å; L27-I205 HydrophobicContact CD2-CD1 4.27Å; L27-I205 HydrophobicContact CD2-CG1 4.35Å
28	E	54.2	Low	59.7	Low	44 Å²	44	78.4 Å²	78.4	21%	0.206	41%	0.406	C	S	.	.	H	α-helix	trans	-67	-51.9	-176.2	-166	-170.5	157.3	0	0	112.9	T30 Y31 L32 L201	E28-T30 VanDerWaalsContact C-N 3.31Å; E28-T30 PolarHBondContact O-N 3.39Å; E28-Y31 PolarHBondContact O-N 2.93Å; E28-Y31 VanDerWaalsContact O-N 3.15Å; E28-L32 WeakPolarHBondContact O-CG 3.49Å; E28-L32 PolarHBondContact O-N 3.15Å; E28-L201 WeakPolarHBondContact OE2-CD2 3.41Å
29	E	62.6	Low	62	Low	116 Å²	116	79.9 Å²	79.9	54%	0.542	41%	0.413	S	S	.	.	H	α-helix	trans	-62.3	-41.1	179.7	-168.3	-172.9	156	0	0	111.5	Y31 L32 K33	E29-Y31 VanDerWaalsContact C-N 3.32Å; E29-Y31 PolarHBondContact O-N 3.32Å; E29-L32 PolarHBondContact O-N 3.13Å; E29-K33 HydrophobicContact CG-CD 4.46Å; E29-K33 WeakPolarHBondContact O-CG 3.42Å; E29-K33 PolarHBondContact O-N 3.37Å; E29-K33 VanDerWaalsContact O-N 3.09Å; E29-K33 WeakPolarHBondContact OE1-CE 3.35Å; E29-K33 IonicContact OE1-NZ 2.64Å; E29-K33 PolarHBondContact OE1-NZ 3.49Å
30	T	72.6	Confident	64.7	Low	30 Å²	30	77.7 Å²	77.7	18%	0.184	40%	0.402	C	S	.	.	H	α-helix	trans	-60.6	-43.1	175.8	-52.5	0	0	0	0	111.1	V26 E28 W34 P85	V26-T30 PolarHBondContact O-OG1 2.88Å; E28-T30 VanDerWaalsContact C-N 3.31Å; E28-T30 PolarHBondContact O-N 3.39Å; T30-W34 WeakPolarHBondContact O-CB 3.43Å; T30-W34 PolarHBondContact O-N 3.49Å; T30-P85 HydrophobicContact CG2-CG 3.96Å; T30-P85 WeakPolarHBondContact OG1-CG 3.34Å
31	Y	69.8	Low	67.6	Low	63 Å²	63	69.2 Å²	69.2	25%	0.247	36%	0.362	C	S	.	.	H	α-helix	trans	-68.3	-41.9	179.5	-178.9	-97.5	0	0	0	112.7	L27 E28 E29 K33 W34 L35 H208	L27-Y31 VanDerWaalsContact O-CB 3.27Å; L27-Y31 WeakPolarHBondContact O-CB 3.26Å; L27-Y31 PolarHBondContact O-N 3.41Å; E28-Y31 PolarHBondContact O-N 2.93Å; E28-Y31 VanDerWaalsContact O-N 3.15Å; E29-Y31 VanDerWaalsContact C-N 3.32Å; E29-Y31 PolarHBondContact O-N 3.32Å; Y31-K33 VanDerWaalsContact C-N 3.34Å; Y31-K33 PolarHBondContact O-N 3.39Å; Y31-W34 HydrophobicContact CD2-CE3 4.38Å; Y31-W34 HydrophobicContact CE2-CE3 4.11Å; Y31-W34 HydrophobicContact CE2-CZ3 4.23Å; Y31-W34 WeakPolarHBondContact O-CB 3.43Å; Y31-W34 PolarHBondContact O-N 2.84Å; Y31-W34 VanDerWaalsContact O-N 3.17Å; Y31-L35 PolarHBondContact O-N 3.03Å; Y31-H208 AromaticContact CD1-NE2 3.76Å; Y31-H208 HydrophobicContact CE1-CB 4.42Å; Y31-H208 AromaticContact CE1-CD2 3.67Å; Y31-H208 AromaticContact CE1-CE1 3.52Å; Y31-H208 AromaticContact CE1-CG 3.65Å; Y31-H208 AromaticContact CE1-ND1 3.53Å; Y31-H208 AromaticContact CE1-NE2 3.61Å; Y31-H208 AromaticContact CZ-CG 3.88Å
32	L	73.6	Confident	70.4	Confident	96 Å²	96	66.3 Å²	66.3	50%	0.503	34%	0.342	S	S	.	.	H	α-helix	trans	-60.7	-44.7	175.8	-71.8	175.9	0	0	0	111.4	E28 E29 W34 L35 Q36	E28-L32 WeakPolarHBondContact O-CG 3.49Å; E28-L32 PolarHBondContact O-N 3.15Å; E29-L32 PolarHBondContact O-N 3.13Å; L32-W34 VanDerWaalsContact C-N 3.32Å; L32-W34 PolarHBondContact O-N 3.26Å; L32-L35 PolarHBondContact O-N 3.02Å; L32-Q36 PolarHBondContact O-N 3.31Å
33	K	81.8	Confident	73.2	Confident	78 Å²	78	69.5 Å²	69.5	34%	0.339	34%	0.344	S	S	.	.	H	α-helix	trans	-63.6	-37.7	174.4	-70.8	171.8	170.8	167.5	0	111.8	E29 Y31 Q36 Y37 Y83	E29-K33 HydrophobicContact CG-CD 4.46Å; E29-K33 WeakPolarHBondContact O-CG 3.42Å; E29-K33 PolarHBondContact O-N 3.37Å; E29-K33 VanDerWaalsContact O-N 3.09Å; E29-K33 WeakPolarHBondContact OE1-CE 3.35Å; E29-K33 IonicContact OE1-NZ 2.64Å; E29-K33 PolarHBondContact OE1-NZ 3.49Å; Y31-K33 VanDerWaalsContact C-N 3.34Å; Y31-K33 PolarHBondContact O-N 3.39Å; K33-Q36 PolarHBondContact O-N 3.46Å; K33-Y37 WeakPolarHBondContact O-CB 3.36Å; K33-Y37 PolarHBondContact O-N 3.18Å; K33-Y83 VanDerWaalsContact C-CB 3.42Å
34	W	87.2	Confident	75.9	Confident	48 Å²	48	67.3 Å²	67.3	18%	0.182	32%	0.323	C	S	.	.	H	α-helix	trans	-64.8	-39.8	175.4	177.9	90.9	0	0	0	111.9	T30 Y31 L32 Q36 Y37 K38 F61 R63 Y83	T30-W34 WeakPolarHBondContact O-CB 3.43Å; T30-W34 PolarHBondContact O-N 3.49Å; Y31-W34 HydrophobicContact CD2-CE3 4.38Å; Y31-W34 HydrophobicContact CE2-CE3 4.11Å; Y31-W34 HydrophobicContact CE2-CZ3 4.23Å; Y31-W34 WeakPolarHBondContact O-CB 3.43Å; Y31-W34 PolarHBondContact O-N 2.84Å; Y31-W34 VanDerWaalsContact O-N 3.17Å; L32-W34 VanDerWaalsContact C-N 3.32Å; L32-W34 PolarHBondContact O-N 3.26Å; W34-Q36 VanDerWaalsContact C-N 3.35Å; W34-Y37 WeakPolarHBondContact O-CB 3.37Å; W34-Y37 PolarHBondContact O-N 3.41Å; W34-K38 HydrophobicContact CH2-CD 3.82Å; W34-K38 HydrophobicContact CZ2-CD 4.45Å; W34-K38 HydrophobicContact CZ3-CD 4.01Å; W34-K38 WeakPolarHBondContact O-CB 3.27Å; W34-K38 PolarHBondContact O-N 2.86Å; W34-F61 AromaticContact CZ2-CE1 3.91Å; W34-F61 HydrophobicContact CZ2-CE1 3.91Å; W34-F61 AromaticContact CZ2-CZ 3.96Å; W34-F61 HydrophobicContact CZ2-CZ 3.96Å; W34-R63 HydrophobicContact CZ2-CB 4.36Å; W34-R63 PolarHBondContact NE1-O 3.25Å; W34-Y83 HydrophobicContact CB-CD1 4.28Å; W34-Y83 HydrophobicContact CB-CD2 4.03Å; W34-Y83 HydrophobicContact CB-CG 3.9Å; W34-Y83 AromaticContact CD1-CD1 3.9Å; W34-Y83 AromaticContact CD1-CE1 3.58Å; W34-Y83 AromaticContact CD1-CE2 3.76Å; W34-Y83 AromaticContact CD1-CZ 3.56Å; W34-Y83 HydrophobicContact CG-CD1 4.46Å; W34-Y83 HydrophobicContact CG-CD2 4.46Å; W34-Y83 HydrophobicContact CG-CG 4.44Å; W34-Y83 VanDerWaalsContact N-CB 3.34Å
35	L	81	Confident	78.1	Confident	39 Å²	39	69.4 Å²	69.4	20%	0.204	33%	0.332	C	S	.	.	H	α-helix	trans	-63.8	-42.9	176.4	-173	68.3	0	0	0	111.1	Y31 L32 K38 Q39	Y31-L35 PolarHBondContact O-N 3.03Å; L32-L35 PolarHBondContact O-N 3.02Å; L35-K38 PolarHBondContact O-N 2.88Å; L35-Q39 WeakPolarHBondContact O-CG 3.4Å; L35-Q39 PolarHBondContact O-N 3.4Å
36	Q	87.3	Confident	80.3	Confident	103 Å²	103	70.8 Å²	70.8	48%	0.481	34%	0.34	S	S	.	.	H	α-helix	trans	-59.3	-50	173.3	-176.1	179.2	-4.2	0	0	110.9	L32 K33 W34 K38 Q39 D40 F82	L32-Q36 PolarHBondContact O-N 3.31Å; K33-Q36 PolarHBondContact O-N 3.46Å; W34-Q36 VanDerWaalsContact C-N 3.35Å; Q36-K38 VanDerWaalsContact C-N 3.3Å; Q36-K38 PolarHBondContact O-N 2.95Å; Q36-Q39 PolarHBondContact O-N 2.93Å; Q36-Q39 VanDerWaalsContact O-N 3.1Å; Q36-D40 PolarHBondContact O-N 3.37Å; Q36-F82 HydrophobicContact CG-CZ 4.4Å
37	Y	91.7	Very high	82.1	Confident	23 Å²	23	73.4 Å²	73.4	9%	0.09	35%	0.352	C	S	.	.	H	α-helix	trans	-55.9	-43.7	176.9	-175.1	-87.4	0	0	0	112.4	K33 W34 D40 C41 F61 C66 P81 F82 Y83	K33-Y37 WeakPolarHBondContact O-CB 3.36Å; K33-Y37 PolarHBondContact O-N 3.18Å; W34-Y37 WeakPolarHBondContact O-CB 3.37Å; W34-Y37 PolarHBondContact O-N 3.41Å; Y37-D40 PolarHBondContact O-N 3.47Å; Y37-C41 WeakPolarHBondContact O-CB 3.39Å; Y37-C41 PolarHBondContact O-N 3.33Å; Y37-F61 AromaticContact CD1-CE2 3.96Å; Y37-F61 HydrophobicContact CD1-CE2 3.96Å; Y37-F61 AromaticContact CE1-CE2 3.93Å; Y37-F61 HydrophobicContact CE1-CE2 3.93Å; Y37-C66 HydrophobicContact CE1-CB 4.16Å; Y37-C66 PolarHBondContact OH-N 3.48Å; Y37-P81 HydrophobicContact CD2-CB 4.29Å; Y37-P81 HydrophobicContact CE1-CB 4.48Å; Y37-P81 HydrophobicContact CE2-CB 3.9Å; Y37-F82 AromaticContact CD2-CD1 3.68Å; Y37-F82 HydrophobicContact CD2-CD1 3.68Å; Y37-F82 AromaticContact CD2-CE1 3.45Å; Y37-F82 HydrophobicContact CD2-CE1 3.45Å; Y37-F82 VanDerWaalsContact CD2-CE1 3.45Å; Y37-F82 HydrophobicContact CD2-CG 4.41Å; Y37-F82 AromaticContact CD2-CZ 3.97Å; Y37-F82 HydrophobicContact CD2-CZ 3.97Å; Y37-F82 HydrophobicContact CE2-CD1 4.25Å; Y37-F82 HydrophobicContact CE2-CE1 4.28Å; Y37-F82 HydrophobicContact CG-CE1 4.3Å; Y37-F82 HydrophobicContact CG-CZ 4.43Å; Y37-Y83 HydrophobicContact CD1-CD1 4.03Å; Y37-Y83 AromaticContact CD1-CE1 3.97Å; Y37-Y83 HydrophobicContact CD1-CE1 3.97Å; Y37-Y83 HydrophobicContact CD2-CD1 4.12Å; Y37-Y83 HydrophobicContact CE1-CE1 4.35Å; Y37-Y83 AromaticContact CG-CD1 3.71Å; Y37-Y83 HydrophobicContact CG-CD1 3.71Å; Y37-Y83 HydrophobicContact CG-CE1 4.14Å
38	K	88	Confident	83.6	Confident	76 Å²	76	72.3 Å²	72.3	33%	0.33	34%	0.344	S	S	.	.	H	α-helix	trans	-61.5	-44.9	175.7	176.4	-178.7	176.5	-172.9	0	111.9	W34 L35 Q36 C41 I42 F61	W34-K38 HydrophobicContact CH2-CD 3.82Å; W34-K38 HydrophobicContact CZ2-CD 4.45Å; W34-K38 HydrophobicContact CZ3-CD 4.01Å; W34-K38 WeakPolarHBondContact O-CB 3.27Å; W34-K38 PolarHBondContact O-N 2.86Å; L35-K38 PolarHBondContact O-N 2.88Å; Q36-K38 VanDerWaalsContact C-N 3.3Å; Q36-K38 PolarHBondContact O-N 2.95Å; K38-C41 WeakPolarHBondContact O-CB 3.49Å; K38-C41 PolarHBondContact O-N 2.84Å; K38-I42 HydrophobicContact CG-CD1 4.02Å; K38-I42 WeakPolarHBondContact O-CG1 3.32Å; K38-I42 PolarHBondContact O-N 3.31Å; K38-F61 HydrophobicContact CB-CE1 3.91Å; K38-F61 HydrophobicContact CB-CZ 3.93Å; K38-F61 HydrophobicContact CD-CE1 3.92Å; K38-F61 HydrophobicContact CG-CD1 4.06Å; K38-F61 HydrophobicContact CG-CE1 3.61Å; K38-F61 HydrophobicContact CG-CZ 4.16Å
39	Q	89.8	Confident	85	Confident	99 Å²	99	74.9 Å²	74.9	46%	0.463	36%	0.364	S	S	.	.	H	α-helix	trans	-64.3	-42.2	178.8	-74.1	178.2	-0.1	0	0	111.7	L35 Q36 C41 I42 K43	L35-Q39 WeakPolarHBondContact O-CG 3.4Å; L35-Q39 PolarHBondContact O-N 3.4Å; Q36-Q39 PolarHBondContact O-N 2.93Å; Q36-Q39 VanDerWaalsContact O-N 3.1Å; Q39-C41 VanDerWaalsContact C-N 3.32Å; Q39-C41 PolarHBondContact O-N 2.89Å; Q39-I42 PolarHBondContact O-N 3.43Å; Q39-K43 WeakPolarHBondContact O-CG 3.12Å; Q39-K43 PolarHBondContact O-N 3.08Å
40	D	92.1	Very high	85.7	Confident	64 Å²	64	74.3 Å²	74.3	34%	0.342	37%	0.371	S	S	.	.	H	α-helix	trans	-64	-40.1	177.1	-66.7	-21.9	0	0	0	110.9	Q36 Y37 K43 M44	Q36-D40 PolarHBondContact O-N 3.37Å; Y37-D40 PolarHBondContact O-N 3.47Å; D40-K43 PolarHBondContact O-N 3.44Å; D40-K43 IonicContact OD1-NZ 3.4Å; D40-M44 WeakPolarHBondContact O-CB 3.29Å; D40-M44 PolarHBondContact O-N 2.96Å
41	C	92.8	Very high	86	Confident	3 Å²	3	75.2 Å²	75.2	2%	0.02	38%	0.377	C	S	.	.	H	α-helix	trans	-61.7	-44.8	173	-176.1	0	0	0	0	113	Y37 K38 Q39 K43 M44 M45 F61 C66	Y37-C41 WeakPolarHBondContact O-CB 3.39Å; Y37-C41 PolarHBondContact O-N 3.33Å; K38-C41 WeakPolarHBondContact O-CB 3.49Å; K38-C41 PolarHBondContact O-N 2.84Å; Q39-C41 VanDerWaalsContact C-N 3.32Å; Q39-C41 PolarHBondContact O-N 2.89Å; C41-K43 VanDerWaalsContact C-N 3.33Å; C41-K43 PolarHBondContact O-N 2.79Å; C41-M44 WeakPolarHBondContact O-CB 3.47Å; C41-M44 PolarHBondContact O-N 3.45Å; C41-M45 WeakPolarHBondContact O-CG 3.49Å; C41-M45 PolarHBondContact O-N 3.33Å; C41-F61 HydrophobicContact CB-CD2 4.27Å; C41-C66 WeakPolarHBondContact CA-SG 3.47Å; C41-C66 HydrophobicContact CB-CB 3.58Å; C41-C66 WeakPolarHBondContact CB-SG 3.23Å; C41-C66 VanDerWaalsContact SG-CA 3.51Å; C41-C66 WeakPolarHBondContact SG-CB 3.4Å; C41-C66 CovalentContact SG-SG 2.02Å; C41-C66 PolarHBondContact SG-SG 3.43Å
42	I	91.8	Very high	85.8	Confident	63 Å²	63	81.2 Å²	81.2	32%	0.323	41%	0.407	S	S	.	.	H	α-helix	trans	-62.1	-42.8	177.9	-69.5	166.3	0	0	0	110.8	K38 Q39 M45 Q46	K38-I42 HydrophobicContact CG-CD1 4.02Å; K38-I42 WeakPolarHBondContact O-CG1 3.32Å; K38-I42 PolarHBondContact O-N 3.31Å; Q39-I42 PolarHBondContact O-N 3.43Å; I42-M45 HydrophobicContact CB-CE 4.5Å; I42-M45 HydrophobicContact CG1-CE 4.04Å; I42-M45 PolarHBondContact O-N 3.33Å; I42-Q46 WeakPolarHBondContact O-CG 3.22Å; I42-Q46 PolarHBondContact O-N 3.41Å; I42-Q46 VanDerWaalsContact O-N 3.09Å
43	K	92.4	Very high	85.8	Confident	109 Å²	109	85.6 Å²	85.6	47%	0.474	43%	0.425	S	S	.	.	H	α-helix	trans	-61.9	-43.7	175.7	-71.8	171.7	-174.4	166.1	0	111.7	Q39 D40 C41 Q46 N47	Q39-K43 WeakPolarHBondContact O-CG 3.12Å; Q39-K43 PolarHBondContact O-N 3.08Å; D40-K43 PolarHBondContact O-N 3.44Å; D40-K43 IonicContact OD1-NZ 3.4Å; C41-K43 VanDerWaalsContact C-N 3.33Å; C41-K43 PolarHBondContact O-N 2.79Å; K43-Q46 PolarHBondContact O-N 3.42Å; K43-N47 WeakPolarHBondContact O-CB 3.27Å; K43-N47 VanDerWaalsContact O-CG 3.25Å; K43-N47 PolarHBondContact O-N 3.21Å; K43-N47 PolarHBondContact O-ND2 2.78Å
44	M	91.1	Very high	85.8	Confident	55 Å²	55	84.9 Å²	84.9	27%	0.271	44%	0.44	S	S	.	.	H	α-helix	trans	-57.2	-50.3	175.4	-174.4	-162.8	88.4	0	0	110.6	D40 C41 Q46 N47 E48 C66	D40-M44 WeakPolarHBondContact O-CB 3.29Å; D40-M44 PolarHBondContact O-N 2.96Å; C41-M44 WeakPolarHBondContact O-CB 3.47Å; C41-M44 PolarHBondContact O-N 3.45Å; M44-Q46 VanDerWaalsContact C-N 3.26Å; M44-Q46 PolarHBondContact O-N 3.13Å; M44-N47 PolarHBondContact O-N 3.46Å; M44-E48 HydrophobicContact CG-CG 4.25Å; M44-E48 WeakPolarHBondContact CG-OE1 3.48Å; M44-E48 WeakPolarHBondContact O-CB 3.34Å; M44-E48 PolarHBondContact O-N 3.09Å; M44-C66 WeakPolarHBondContact CE-SG 3.4Å
45	M	89.5	Confident	85.8	Confident	50 Å²	50	87.4 Å²	87.4	25%	0.246	46%	0.456	C	S	.	.	H	α-helix	trans	-60.8	-32.2	-179.8	-69.7	-171.7	-67.9	0	0	113.6	C41 I42 R59 F61	C41-M45 WeakPolarHBondContact O-CG 3.49Å; C41-M45 PolarHBondContact O-N 3.33Å; I42-M45 HydrophobicContact CB-CE 4.5Å; I42-M45 HydrophobicContact CG1-CE 4.04Å; I42-M45 PolarHBondContact O-N 3.33Å; M45-R59 HydrophobicContact CB-CG 4.43Å; M45-R59 HydrophobicContact CG-CB 4.46Å; M45-R59 HydrophobicContact CG-CG 4.01Å; M45-R59 PolarHBondContact O-NH1 3.21Å; M45-R59 HydrophobicContact SD-CG 4.37Å; M45-F61 HydrophobicContact CE-CB 4.19Å
46	Q	89.6	Confident	86.3	Confident	147 Å²	147	88.8 Å²	88.8	69%	0.687	46%	0.461	S	S	*	.	H	α-helix	trans	-79.5	-34	178.2	-72.5	175.3	-16.6	0	0	113.6	I42 K43 M44	I42-Q46 WeakPolarHBondContact O-CG 3.22Å; I42-Q46 PolarHBondContact O-N 3.41Å; I42-Q46 VanDerWaalsContact O-N 3.09Å; K43-Q46 PolarHBondContact O-N 3.42Å; M44-Q46 VanDerWaalsContact C-N 3.26Å; M44-Q46 PolarHBondContact O-N 3.13Å
47	N	89.6	Confident	86.5	Confident	131 Å²	131	83.9 Å²	83.9	70%	0.701	44%	0.438	S	S	*	.	H	α-helix	trans	-93.6	-26.3	-171	-68.5	-23.6	0	0	0	113.6	K43 M44	K43-N47 WeakPolarHBondContact O-CB 3.27Å; K43-N47 VanDerWaalsContact O-CG 3.25Å; K43-N47 PolarHBondContact O-N 3.21Å; K43-N47 PolarHBondContact O-ND2 2.78Å; M44-N47 PolarHBondContact O-N 3.46Å
48	E	87.1	Confident	86.4	Confident	81 Å²	81	88 Å²	88	38%	0.379	46%	0.462	S	S	.	.	S	Bend	trans	-72.5	133.9	179.8	-81.7	179.7	174.9	0	0	111.2	M44 R59	M44-E48 HydrophobicContact CG-CG 4.25Å; M44-E48 WeakPolarHBondContact CG-OE1 3.48Å; M44-E48 WeakPolarHBondContact O-CB 3.34Å; M44-E48 PolarHBondContact O-N 3.09Å; E48-R59 PolarHBondContact O-NH1 3.4Å; E48-R59 PolarHBondContact O-NH2 2.83Å; E48-R59 IonicContact OE2-CZ 3.23Å
49	P	84.3	Confident	86.6	Confident	99 Å²	99	86.4 Å²	86.4	64%	0.643	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-63	150.6	179.2	27.2	-33.8	0	0	0	110.8	R59	P49-R59 PolarHBondContact O-NH2 3.48Å
50	P	77.1	Confident	86.7	Confident	104 Å²	104	83.9 Å²	83.9	68%	0.675	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-62.2	145.8	172	26.3	-32.5	0	0	0	110	Q52	P50-Q52 PolarHBondContact O-N 2.94Å
51	P	78.4	Confident	86.7	Confident	48 Å²	48	82.5 Å²	82.5	31%	0.312	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-58.6	135.7	175.7	23.1	-32.1	0	0	0	110.3	F56 D69	P51-F56 HydrophobicContact CB-CD1 4.19Å; P51-F56 HydrophobicContact CB-CE1 4.3Å; P51-F56 HydrophobicContact CB-CG 4.49Å; P51-F56 HydrophobicContact CG-CD1 3.62Å; P51-F56 HydrophobicContact CG-CD2 3.67Å; P51-F56 HydrophobicContact CG-CE1 3.5Å; P51-F56 HydrophobicContact CG-CE2 3.52Å; P51-F56 HydrophobicContact CG-CG 3.74Å; P51-F56 HydrophobicContact CG-CZ 3.46Å; P51-F56 VanDerWaalsContact CG-CZ 3.46Å; P51-D69 HydrophobicContact CG-CB 4.38Å
52	Q	66.3	Low	86.5	Confident	189 Å²	189	84.2 Å²	84.2	88%	0.883	45%	0.445	S	S	*	.	S	Bend	trans	-75	-36	-165.9	-72.2	179.7	-13.4	0	0	113.2	P50	P50-Q52 PolarHBondContact O-N 2.94Å
53	E	73.8	Confident	86.3	Confident	189 Å²	189	91 Å²	91	88%	0.883	47%	0.466	S	S	*	.	S	Bend	trans	-154.8	146.2	177.7	-65.9	-173	164.7	0	0	112.1
54	G	80.4	Confident	86.2	Confident	63 Å²	63	87.3 Å²	87.3	65%	0.649	45%	0.45	S	S	*	.	S	Bend	trans	119.9	172.1	172.4	0	0	0	0	0	115.2	F56	G54-F56 WeakPolarHBondContact O-CD1 3.37Å; G54-F56 WeakPolarHBondContact O-CE1 3.3Å
55	L	88.6	Confident	86.3	Confident	101 Å²	101	84.7 Å²	84.7	53%	0.529	44%	0.437	S	S	.	.			trans	-86.4	125.6	169.6	-167.4	73	0	0	0	108.5	A72 S101 D102	L55-A72 HydrophobicContact CB-CB 4.02Å; L55-A72 HydrophobicContact CD2-CB 4.01Å; L55-A72 HydrophobicContact CG-CB 4.12Å; L55-A72 VanDerWaalsContact O-CB 3.26Å; L55-A72 WeakPolarHBondContact O-CB 3.45Å; L55-A72 PolarHBondContact O-N 3.38Å; L55-S101 VanDerWaalsContact CD2-O 3.29Å; L55-S101 WeakPolarHBondContact CD2-O 3.4Å; L55-D102 VanDerWaalsContact CD2-C 3.47Å
56	F	90.6	Very high	86.5	Confident	67 Å²	67	82.9 Å²	82.9	29%	0.294	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	154.5	-175.5	54.6	-90.7	0	0	0	111.7	P51 G54 N58 A70	P51-F56 HydrophobicContact CB-CD1 4.19Å; P51-F56 HydrophobicContact CB-CE1 4.3Å; P51-F56 HydrophobicContact CB-CG 4.49Å; P51-F56 HydrophobicContact CG-CD1 3.62Å; P51-F56 HydrophobicContact CG-CD2 3.67Å; P51-F56 HydrophobicContact CG-CE1 3.5Å; P51-F56 HydrophobicContact CG-CE2 3.52Å; P51-F56 HydrophobicContact CG-CG 3.74Å; P51-F56 HydrophobicContact CG-CZ 3.46Å; P51-F56 VanDerWaalsContact CG-CZ 3.46Å; G54-F56 WeakPolarHBondContact O-CD1 3.37Å; G54-F56 WeakPolarHBondContact O-CE1 3.3Å; F56-N58 WeakPolarHBondContact CE2-OD1 3.04Å; F56-A70 CarbonylContact C-O 3.6Å; F56-A70 WeakPolarHBondContact CA-O 3.4Å; F56-A70 VanDerWaalsContact CB-O 3.22Å; F56-A70 WeakPolarHBondContact CB-O 3.42Å
57	C	91.5	Very high	86.7	Confident	1 Å²	1	75.9 Å²	75.9	1%	0.007	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	129.3	167.2	-63.8	0	0	0	0	109.7	D69 A70 C99 G103 L104 W105	C57-D69 WeakPolarHBondContact O-CA 2.85Å; C57-A70 HydrophobicContact CB-CB 4.3Å; C57-A70 PolarHBondContact N-O 2.83Å; C57-A70 PolarHBondContact O-N 3.36Å; C57-A70 VanDerWaalsContact O-N 3.14Å; C57-C99 HydrophobicContact CB-CB 3.89Å; C57-C99 WeakPolarHBondContact CB-SG 3.36Å; C57-C99 PolarHBondContact N-SG 3.48Å; C57-C99 WeakPolarHBondContact SG-CA 3.23Å; C57-C99 WeakPolarHBondContact SG-CB 3.36Å; C57-C99 CovalentContact SG-SG 2.03Å; C57-C99 PolarHBondContact SG-SG 3.29Å; C57-G103 VanDerWaalsContact SG-C 3.51Å; C57-G103 PolarHBondContact SG-O 3.36Å; C57-L104 PolarHBondContact SG-O 3.22Å; C57-W105 HydrophobicContact CB-CD2 3.7Å; C57-W105 VanDerWaalsContact CB-CE2 3.47Å; C57-W105 HydrophobicContact CB-CE3 4.07Å; C57-W105 HydrophobicContact CB-CG 4.22Å; C57-W105 HydrophobicContact CB-CH2 4.09Å; C57-W105 HydrophobicContact CB-CZ2 3.69Å; C57-W105 HydrophobicContact CB-CZ3 4.26Å
58	N	90.8	Very high	86.9	Confident	109 Å²	109	71.5 Å²	71.5	58%	0.583	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-63.2	138.8	-180	-68.7	-20.6	0	0	0	112.2	F56 W105	F56-N58 WeakPolarHBondContact CE2-OD1 3.04Å; N58-W105 PolarHBondContact O-NE1 2.97Å
59	R	91.6	Very high	87.1	Confident	42 Å²	42	69.5 Å²	69.5	16%	0.158	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-52.3	141.2	168.1	66.3	-178.1	75.6	161.7	-7.5	111.5	M45 E48 P49 W67 D69	M45-R59 HydrophobicContact CB-CG 4.43Å; M45-R59 HydrophobicContact CG-CB 4.46Å; M45-R59 HydrophobicContact CG-CG 4.01Å; M45-R59 PolarHBondContact O-NH1 3.21Å; M45-R59 HydrophobicContact SD-CG 4.37Å; E48-R59 PolarHBondContact O-NH1 3.4Å; E48-R59 PolarHBondContact O-NH2 2.83Å; E48-R59 IonicContact OE2-CZ 3.23Å; P49-R59 PolarHBondContact O-NH2 3.48Å; R59-W67 CarbonylContact C-O 3.44Å; R59-W67 WeakPolarHBondContact CA-O 3.43Å; R59-W67 VanDerWaalsContact CB-O 3.25Å; R59-W67 WeakPolarHBondContact CB-O 3.47Å; R59-D69 WeakPolarHBondContact CB-OD1 3.32Å; R59-D69 IonicContact CZ-OD2 2.79Å; R59-D69 PolarHBondContact N-OD1 2.92Å; R59-D69 IonicContact NE-OD1 2.65Å; R59-D69 IonicContact NE-OD2 3.48Å; R59-D69 PolarHBondContact NE-OD2 3.28Å; R59-D69 IonicContact NH2-OD2 2.73Å; R59-D69 PolarHBondContact NH2-OD2 2.94Å
60	T	92.3	Very high	87.4	Confident	47 Å²	47	65 Å²	65	29%	0.288	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	154.4	-175.4	-170.8	0	0	0	0	112.5	W67	T60-W67 HydrophobicContact CG2-CB 4.17Å; T60-W67 HydrophobicContact CG2-CG 4.46Å; T60-W67 PolarHBondContact N-O 3.5Å; T60-W67 WeakPolarHBondContact O-CB 2.92Å; T60-W67 PolarHBondContact O-N 2.92Å
61	F	91.4	Very high	88.1	Confident	34 Å²	34	62.6 Å²	62.6	15%	0.149	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	111.1	168.8	-178.9	-117.3	0	0	0	109.3	W34 Y37 K38 C41 M45 R63 A65	W34-F61 AromaticContact CZ2-CE1 3.91Å; W34-F61 HydrophobicContact CZ2-CE1 3.91Å; W34-F61 AromaticContact CZ2-CZ 3.96Å; W34-F61 HydrophobicContact CZ2-CZ 3.96Å; Y37-F61 AromaticContact CD1-CE2 3.96Å; Y37-F61 HydrophobicContact CD1-CE2 3.96Å; Y37-F61 AromaticContact CE1-CE2 3.93Å; Y37-F61 HydrophobicContact CE1-CE2 3.93Å; K38-F61 HydrophobicContact CB-CE1 3.91Å; K38-F61 HydrophobicContact CB-CZ 3.93Å; K38-F61 HydrophobicContact CD-CE1 3.92Å; K38-F61 HydrophobicContact CG-CD1 4.06Å; K38-F61 HydrophobicContact CG-CE1 3.61Å; K38-F61 HydrophobicContact CG-CZ 4.16Å; C41-F61 HydrophobicContact CB-CD2 4.27Å; M45-F61 HydrophobicContact CE-CB 4.19Å; F61-R63 PolarHBondContact O-N 3.17Å; F61-A65 WeakPolarHBondContact CD2-O 3.44Å
62	D	88.6	Confident	88.7	Confident	39 Å²	39	61.5 Å²	61.5	21%	0.209	32%	0.322	C	S	.	.			trans	-89.9	18.9	-175.5	72.3	-9.8	0	0	0	113.4	Y64 A65 W67 R97 R115	D62-Y64 PolarHBondContact O-N 3Å; D62-Y64 WeakPolarHBondContact OD1-CA 3.35Å; D62-Y64 WeakPolarHBondContact OD1-CB 3.33Å; D62-Y64 PolarHBondContact OD1-N 3.36Å; D62-A65 PolarHBondContact N-O 3.37Å; D62-A65 PolarHBondContact OD1-N 3.09Å; D62-A65 VanDerWaalsContact OD1-O 3.13Å; D62-W67 PolarHBondContact OD2-NE1 3.45Å; D62-R97 IonicContact OD2-NH1 2.69Å; D62-R115 IonicContact OD2-NH1 2.9Å; D62-R115 PolarHBondContact OD2-NH1 2.96Å
63	R	87.4	Confident	89.8	Confident	205 Å²	205	54.9 Å²	54.9	77%	0.774	31%	0.305	S	S	*	.	S	Bend	trans	70.3	1.1	-172.8	-49.8	178.6	178.3	-174.9	-0.6	115.1	W34 F61	W34-R63 HydrophobicContact CZ2-CB 4.36Å; W34-R63 PolarHBondContact NE1-O 3.25Å; F61-R63 PolarHBondContact O-N 3.17Å
64	Y	89.9	Confident	90.6	Very high	33 Å²	33	52.4 Å²	52.4	13%	0.129	29%	0.291	C	S	.	.	S	Bend	trans	-121	-58.9	174.2	-176.2	-87.9	0	0	0	111.4	D62 P81 Y83 L84 V95 R115 I117	D62-Y64 PolarHBondContact O-N 3Å; D62-Y64 WeakPolarHBondContact OD1-CA 3.35Å; D62-Y64 WeakPolarHBondContact OD1-CB 3.33Å; D62-Y64 PolarHBondContact OD1-N 3.36Å; Y64-P81 HydrophobicContact CD1-CG 4.2Å; Y64-P81 HydrophobicContact CE1-CG 3.85Å; Y64-P81 WeakPolarHBondContact O-CG 3.46Å; Y64-Y83 WeakPolarHBondContact CA-OH 3.33Å; Y64-Y83 VanDerWaalsContact CD2-OH 3.31Å; Y64-Y83 WeakPolarHBondContact CD2-OH 3.23Å; Y64-Y83 VanDerWaalsContact O-CE1 3.29Å; Y64-Y83 WeakPolarHBondContact O-CE1 3.35Å; Y64-Y83 PolarHBondContact O-OH 3.38Å; Y64-L84 HydrophobicContact CE2-CD2 4.42Å; Y64-V95 HydrophobicContact CE1-CG1 3.72Å; Y64-R115 VanDerWaalsContact CB-NH1 3.3Å; Y64-I117 HydrophobicContact CE1-CG2 4.2Å
65	A	93.7	Very high	91.2	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.284	C	S	.	.			trans	-122.8	156.3	-179.2	0	0	0	0	0	111.6	F61 D62 W67 P81 V95	F61-A65 WeakPolarHBondContact CD2-O 3.44Å; D62-A65 PolarHBondContact N-O 3.37Å; D62-A65 PolarHBondContact OD1-N 3.09Å; D62-A65 VanDerWaalsContact OD1-O 3.13Å; A65-W67 HydrophobicContact CB-CZ2 4.13Å; A65-P81 HydrophobicContact CB-CG 4.42Å; A65-V95 HydrophobicContact CB-CG2 3.81Å
66	C	94.3	Very high	91.4	Very high	11 Å²	11	51.2 Å²	51.2	7%	0.074	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	113.1	172.1	-162.4	0	0	0	0	109.8	Y37 C41 M44	Y37-C66 HydrophobicContact CE1-CB 4.16Å; Y37-C66 PolarHBondContact OH-N 3.48Å; C41-C66 WeakPolarHBondContact CA-SG 3.47Å; C41-C66 HydrophobicContact CB-CB 3.58Å; C41-C66 WeakPolarHBondContact CB-SG 3.23Å; C41-C66 VanDerWaalsContact SG-CA 3.51Å; C41-C66 WeakPolarHBondContact SG-CB 3.4Å; C41-C66 CovalentContact SG-SG 2.02Å; C41-C66 PolarHBondContact SG-SG 3.43Å; M44-C66 WeakPolarHBondContact CE-SG 3.4Å
67	W	93.6	Very high	91.6	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	122.5	-178.2	-59.8	96.9	0	0	0	110.3	R59 T60 D62 A65 V76 V78 V95 R97 W105	R59-W67 CarbonylContact C-O 3.44Å; R59-W67 WeakPolarHBondContact CA-O 3.43Å; R59-W67 VanDerWaalsContact CB-O 3.25Å; R59-W67 WeakPolarHBondContact CB-O 3.47Å; T60-W67 HydrophobicContact CG2-CB 4.17Å; T60-W67 HydrophobicContact CG2-CG 4.46Å; T60-W67 PolarHBondContact N-O 3.5Å; T60-W67 WeakPolarHBondContact O-CB 2.92Å; T60-W67 PolarHBondContact O-N 2.92Å; D62-W67 PolarHBondContact OD2-NE1 3.45Å; A65-W67 HydrophobicContact CB-CZ2 4.13Å; W67-V76 HydrophobicContact CE3-CG1 4.43Å; W67-V78 HydrophobicContact CE3-CG2 3.85Å; W67-V78 HydrophobicContact CZ3-CG2 4.01Å; W67-V95 HydrophobicContact CH2-CB 4.02Å; W67-V95 HydrophobicContact CH2-CG2 3.67Å; W67-V95 HydrophobicContact CZ2-CB 4.5Å; W67-V95 HydrophobicContact CZ2-CG2 4.06Å; W67-V95 HydrophobicContact CZ3-CG2 4.37Å; W67-R97 VanDerWaalsContact CD1-NH1 3.32Å; W67-R97 HydrophobicContact CD2-CB 4.15Å; W67-R97 HydrophobicContact CE3-CB 3.65Å; W67-R97 HydrophobicContact CE3-CG 4.46Å; W67-R97 HydrophobicContact CH2-CB 3.42Å; W67-R97 VanDerWaalsContact CH2-CB 3.42Å; W67-R97 HydrophobicContact CH2-CG 4.48Å; W67-R97 HydrophobicContact CZ2-CB 3.91Å; W67-R97 HydrophobicContact CZ3-CB 3.26Å; W67-R97 HydrophobicContact CZ3-CG 4.43Å; W67-W105 HydrophobicContact CB-CH2 4.47Å; W67-W105 HydrophobicContact CB-CZ2 4.33Å
68	P	93.3	Very high	91.7	Very high	39 Å²	39	53.9 Å²	53.9	25%	0.253	28%	0.284	S	S	.	.			trans	-75	176.1	171.6	33.6	-35.7	0	0	0	111.1	V76	P68-V76 HydrophobicContact CG-CG1 3.87Å
69	D	91.6	Very high	91.9	Very high	40 Å²	40	52.4 Å²	52.4	21%	0.214	28%	0.282	C	S	.	.			trans	-64.6	141.7	173	-59.5	-58.2	0	0	0	110.7	P51 C57 R59	P51-D69 HydrophobicContact CG-CB 4.38Å; C57-D69 WeakPolarHBondContact O-CA 2.85Å; R59-D69 WeakPolarHBondContact CB-OD1 3.32Å; R59-D69 IonicContact CZ-OD2 2.79Å; R59-D69 PolarHBondContact N-OD1 2.92Å; R59-D69 IonicContact NE-OD1 2.65Å; R59-D69 IonicContact NE-OD2 3.48Å; R59-D69 PolarHBondContact NE-OD2 3.28Å; R59-D69 IonicContact NH2-OD2 2.73Å; R59-D69 PolarHBondContact NH2-OD2 2.94Å
70	A	90.6	Very high	92	Very high	3 Å²	3	50.6 Å²	50.6	3%	0.025	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	129.9	-176.3	0	0	0	0	0	110.6	F56 C57 V76 C99 W105	F56-A70 CarbonylContact C-O 3.6Å; F56-A70 WeakPolarHBondContact CA-O 3.4Å; F56-A70 VanDerWaalsContact CB-O 3.22Å; F56-A70 WeakPolarHBondContact CB-O 3.42Å; C57-A70 HydrophobicContact CB-CB 4.3Å; C57-A70 PolarHBondContact N-O 2.83Å; C57-A70 PolarHBondContact O-N 3.36Å; C57-A70 VanDerWaalsContact O-N 3.14Å; A70-V76 HydrophobicContact CB-CB 4.46Å; A70-V76 HydrophobicContact CB-CG2 3.37Å; A70-C99 HydrophobicContact CB-CB 3.77Å; A70-C99 PolarHBondContact O-SG 3.5Å; A70-W105 HydrophobicContact CB-CH2 3.67Å; A70-W105 HydrophobicContact CB-CZ2 4.48Å; A70-W105 HydrophobicContact CB-CZ3 4.02Å
71	A	90.9	Very high	92.2	Very high	54 Å²	54	48.4 Å²	48.4	45%	0.446	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	142	172.3	0	0	0	0	0	111.1	G73 F74	A71-G73 PolarHBondContact O-N 2.98Å; A71-F74 HydrophobicContact CB-CD2 3.76Å; A71-F74 HydrophobicContact CB-CE2 4.36Å; A71-F74 HydrophobicContact CB-CG 4.47Å; A71-F74 PolarHBondContact O-N 3.29Å; A71-F74 VanDerWaalsContact O-N 3.12Å
72	A	91.6	Very high	92.2	Very high	26 Å²	26	50.4 Å²	50.4	22%	0.215	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	131.9	178.7	0	0	0	0	0	111.8	L55 F74 G100	L55-A72 HydrophobicContact CB-CB 4.02Å; L55-A72 HydrophobicContact CD2-CB 4.01Å; L55-A72 HydrophobicContact CG-CB 4.12Å; L55-A72 VanDerWaalsContact O-CB 3.26Å; L55-A72 WeakPolarHBondContact O-CB 3.45Å; L55-A72 PolarHBondContact O-N 3.38Å; A72-F74 VanDerWaalsContact C-N 3.34Å; A72-G100 VanDerWaalsContact CA-O 3.31Å; A72-G100 WeakPolarHBondContact CA-O 3.44Å; A72-G100 WeakPolarHBondContact CB-O 3.33Å
73	G	89.9	Confident	92.2	Very high	50 Å²	50	49.3 Å²	49.3	52%	0.515	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.7	-4.6	-178.3	0	0	0	0	0	115.8	A71 C99 G100	A71-G73 PolarHBondContact O-N 2.98Å; G73-C99 CarbonylContact C-O 3.42Å; G73-C99 VanDerWaalsContact CA-O 3.26Å; G73-C99 WeakPolarHBondContact CA-O 3.39Å; G73-C99 PolarHBondContact N-O 3.37Å; G73-G100 PolarHBondContact N-O 2.87Å; G73-G100 VanDerWaalsContact N-O 3.14Å
74	F	90.1	Very high	92.3	Very high	137 Å²	137	40.2 Å²	40.2	60%	0.601	23%	0.23	S	C	*	.			trans	-98.5	153.9	179	-72.1	-93.5	0	0	0	113.2	A71 A72 C99	A71-F74 HydrophobicContact CB-CD2 3.76Å; A71-F74 HydrophobicContact CB-CE2 4.36Å; A71-F74 HydrophobicContact CB-CG 4.47Å; A71-F74 PolarHBondContact O-N 3.29Å; A71-F74 VanDerWaalsContact O-N 3.12Å; A72-F74 VanDerWaalsContact C-N 3.34Å; F74-C99 PolarHBondContact O-N 3.21Å
75	K	92.3	Very high	92	Very high	115 Å²	115	41.6 Å²	41.6	50%	0.5	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	136.6	169	-70.4	-177.1	-179.6	-177	0	109.8	R97 R98	K75-R97 WeakPolarHBondContact CA-O 3.43Å; K75-R98 HydrophobicContact CG-CB 4.27Å; K75-R98 HydrophobicContact CG-CG 3.97Å
76	V	93.4	Very high	91.7	Very high	23 Å²	23	44.7 Å²	44.7	14%	0.139	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	135.1	174.2	171.8	0	0	0	0	109.4	W67 P68 A70 V78 R96 R97	W67-V76 HydrophobicContact CE3-CG1 4.43Å; P68-V76 HydrophobicContact CG-CG1 3.87Å; A70-V76 HydrophobicContact CB-CB 4.46Å; A70-V76 HydrophobicContact CB-CG2 3.37Å; V76-V78 HydrophobicContact CG1-CG2 4.21Å; V76-R96 WeakPolarHBondContact O-CA 3.07Å; V76-R97 PolarHBondContact N-O 2.91Å; V76-R97 PolarHBondContact O-N 3.47Å
77	N	94.3	Very high	91.4	Very high	101 Å²	101	46.8 Å²	46.8	54%	0.54	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	132.8	178	-57.5	-10.5	0	0	0	108.4	V95 R96	N77-V95 WeakPolarHBondContact CA-O 3.21Å; N77-R96 WeakPolarHBondContact OD1-CG 3.39Å
78	V	94.1	Very high	91.1	Very high	24 Å²	24	54.9 Å²	54.9	15%	0.145	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	137.7	175.8	-179.4	0	0	0	0	107.6	W67 V76 S94 V95	W67-V78 HydrophobicContact CE3-CG2 3.85Å; W67-V78 HydrophobicContact CZ3-CG2 4.01Å; V76-V78 HydrophobicContact CG1-CG2 4.21Å; V78-S94 CarbonylContact O-C 3.17Å; V78-S94 VanDerWaalsContact O-CA 3.23Å; V78-S94 WeakPolarHBondContact O-CA 3.33Å; V78-S94 WeakPolarHBondContact O-CB 3.39Å; V78-V95 HydrophobicContact CB-CG2 4.01Å; V78-V95 PolarHBondContact N-O 3.26Å; V78-V95 WeakPolarHBondContact O-CG2 3.46Å; V78-V95 PolarHBondContact O-N 2.94Å
79	S	94.3	Very high	90.7	Very high	77 Å²	77	59.3 Å²	59.3	54%	0.538	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	150.1	177.4	-55.4	0	0	0	0	111.8
80	C	95.3	Very high	90.6	Very high	4 Å²	4	58.2 Å²	58.2	3%	0.027	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-51.9	137.8	176.3	-64.1	0	0	0	0	111.2	F82 F87 V90 G93 C120	C80-F82 PolarHBondContact O-N 3.47Å; C80-F87 HydrophobicContact CB-CD2 4.4Å; C80-F87 HydrophobicContact CB-CE2 4.44Å; C80-F87 WeakPolarHBondContact O-CE2 3.33Å; C80-V90 HydrophobicContact CB-CB 4.46Å; C80-V90 HydrophobicContact CB-CG2 3.98Å; C80-V90 PolarHBondContact SG-O 3.15Å; C80-G93 PolarHBondContact N-O 2.89Å; C80-G93 VanDerWaalsContact N-O 3.09Å; C80-G93 PolarHBondContact SG-O 3.42Å; C80-G93 VanDerWaalsContact SG-O 3.32Å; C80-C120 WeakPolarHBondContact CA-SG 3.16Å; C80-C120 HydrophobicContact CB-CB 3.9Å; C80-C120 WeakPolarHBondContact CB-SG 3.45Å; C80-C120 VanDerWaalsContact SG-CA 3.53Å; C80-C120 WeakPolarHBondContact SG-CB 3.32Å; C80-C120 CovalentContact SG-SG 2.02Å; C80-C120 PolarHBondContact SG-SG 3.22Å
81	P	95.2	Very high	90.6	Very high	1 Å²	1	60.7 Å²	60.7	1%	0.006	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-63.4	132.5	-178.3	-23.6	32.7	0	0	0	113.2	Y37 Y64 A65 Y83 L84	Y37-P81 HydrophobicContact CD2-CB 4.29Å; Y37-P81 HydrophobicContact CE1-CB 4.48Å; Y37-P81 HydrophobicContact CE2-CB 3.9Å; Y64-P81 HydrophobicContact CD1-CG 4.2Å; Y64-P81 HydrophobicContact CE1-CG 3.85Å; Y64-P81 WeakPolarHBondContact O-CG 3.46Å; A65-P81 HydrophobicContact CB-CG 4.42Å; P81-Y83 HydrophobicContact CB-CD1 3.47Å; P81-Y83 VanDerWaalsContact CB-CD1 3.47Å; P81-Y83 HydrophobicContact CB-CE1 3.13Å; P81-Y83 HydrophobicContact CB-CG 4.31Å; P81-Y83 HydrophobicContact CG-CE1 3.85Å; P81-Y83 PolarHBondContact O-N 2.83Å; P81-Y83 VanDerWaalsContact O-N 3.12Å; P81-L84 WeakPolarHBondContact O-CG 3.35Å; P81-L84 PolarHBondContact O-N 2.96Å
82	F	92.8	Very high	90.6	Very high	76 Å²	76	67.1 Å²	67.1	33%	0.333	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-13.2	-176.9	67.2	-106.9	0	0	0	114.5	Q36 Y37 C80 L84 F87	Q36-F82 HydrophobicContact CG-CZ 4.4Å; Y37-F82 AromaticContact CD2-CD1 3.68Å; Y37-F82 HydrophobicContact CD2-CD1 3.68Å; Y37-F82 AromaticContact CD2-CE1 3.45Å; Y37-F82 HydrophobicContact CD2-CE1 3.45Å; Y37-F82 VanDerWaalsContact CD2-CE1 3.45Å; Y37-F82 HydrophobicContact CD2-CG 4.41Å; Y37-F82 AromaticContact CD2-CZ 3.97Å; Y37-F82 HydrophobicContact CD2-CZ 3.97Å; Y37-F82 HydrophobicContact CE2-CD1 4.25Å; Y37-F82 HydrophobicContact CE2-CE1 4.28Å; Y37-F82 HydrophobicContact CG-CE1 4.3Å; Y37-F82 HydrophobicContact CG-CZ 4.43Å; C80-F82 PolarHBondContact O-N 3.47Å; F82-L84 PolarHBondContact O-N 3.44Å; F82-F87 HydrophobicContact CB-CD1 4.15Å; F82-F87 HydrophobicContact CB-CD2 4.42Å; F82-F87 HydrophobicContact CB-CE1 4.07Å; F82-F87 HydrophobicContact CB-CE2 4.35Å; F82-F87 HydrophobicContact CB-CG 4.33Å; F82-F87 HydrophobicContact CB-CZ 4.17Å
83	Y	87.9	Confident	90.6	Very high	16 Å²	16	66.3 Å²	66.3	6%	0.063	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-15.1	178.5	69	-104.9	0	0	0	113.1	K33 W34 Y37 Y64 P81	K33-Y83 VanDerWaalsContact C-CB 3.42Å; W34-Y83 HydrophobicContact CB-CD1 4.28Å; W34-Y83 HydrophobicContact CB-CD2 4.03Å; W34-Y83 HydrophobicContact CB-CG 3.9Å; W34-Y83 AromaticContact CD1-CD1 3.9Å; W34-Y83 AromaticContact CD1-CE1 3.58Å; W34-Y83 AromaticContact CD1-CE2 3.76Å; W34-Y83 AromaticContact CD1-CZ 3.56Å; W34-Y83 HydrophobicContact CG-CD1 4.46Å; W34-Y83 HydrophobicContact CG-CD2 4.46Å; W34-Y83 HydrophobicContact CG-CG 4.44Å; W34-Y83 VanDerWaalsContact N-CB 3.34Å; Y37-Y83 HydrophobicContact CD1-CD1 4.03Å; Y37-Y83 AromaticContact CD1-CE1 3.97Å; Y37-Y83 HydrophobicContact CD1-CE1 3.97Å; Y37-Y83 HydrophobicContact CD2-CD1 4.12Å; Y37-Y83 HydrophobicContact CE1-CE1 4.35Å; Y37-Y83 AromaticContact CG-CD1 3.71Å; Y37-Y83 HydrophobicContact CG-CD1 3.71Å; Y37-Y83 HydrophobicContact CG-CE1 4.14Å; Y64-Y83 WeakPolarHBondContact CA-OH 3.33Å; Y64-Y83 VanDerWaalsContact CD2-OH 3.31Å; Y64-Y83 WeakPolarHBondContact CD2-OH 3.23Å; Y64-Y83 VanDerWaalsContact O-CE1 3.29Å; Y64-Y83 WeakPolarHBondContact O-CE1 3.35Å; Y64-Y83 PolarHBondContact O-OH 3.38Å; P81-Y83 HydrophobicContact CB-CD1 3.47Å; P81-Y83 VanDerWaalsContact CB-CD1 3.47Å; P81-Y83 HydrophobicContact CB-CE1 3.13Å; P81-Y83 HydrophobicContact CB-CG 4.31Å; P81-Y83 HydrophobicContact CG-CE1 3.85Å; P81-Y83 PolarHBondContact O-N 2.83Å; P81-Y83 VanDerWaalsContact O-N 3.12Å
84	L	89.3	Confident	90.8	Very high	14 Å²	14	65.3 Å²	65.3	7%	0.073	33%	0.328	C	S	.	.	S	Bend	trans	-62.4	134.2	179.9	-65.6	172.5	0	0	0	110.3	Y64 P81 F82 W86 F87 V90 C120	Y64-L84 HydrophobicContact CE2-CD2 4.42Å; P81-L84 WeakPolarHBondContact O-CG 3.35Å; P81-L84 PolarHBondContact O-N 2.96Å; F82-L84 PolarHBondContact O-N 3.44Å; L84-W86 HydrophobicContact CD2-CZ2 3.98Å; L84-W86 PolarHBondContact O-N 3.27Å; L84-W86 VanDerWaalsContact O-N 3.16Å; L84-F87 HydrophobicContact CB-CB 4.36Å; L84-F87 VanDerWaalsContact O-CB 3.26Å; L84-F87 WeakPolarHBondContact O-CB 3.35Å; L84-F87 PolarHBondContact O-N 2.95Å; L84-V90 HydrophobicContact CD1-CG2 4.42Å; L84-C120 HydrophobicContact CD1-CB 4.29Å
85	P	83.1	Confident	91	Very high	63 Å²	63	58.8 Å²	58.8	41%	0.409	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-33.1	179.2	-23.4	32	0	0	0	113.2	T30	T30-P85 HydrophobicContact CG2-CG 3.96Å; T30-P85 WeakPolarHBondContact OG1-CG 3.34Å
86	W	86.9	Confident	91.1	Very high	65 Å²	65	56.5 Å²	56.5	25%	0.246	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	16.3	179.5	54.2	90.5	0	0	0	113.7	L84 H88 K89 V90 C120 E122	L84-W86 HydrophobicContact CD2-CZ2 3.98Å; L84-W86 PolarHBondContact O-N 3.27Å; L84-W86 VanDerWaalsContact O-N 3.16Å; W86-H88 PolarHBondContact O-N 3.46Å; W86-H88 VanDerWaalsContact O-N 3.07Å; W86-K89 WeakPolarHBondContact O-CB 3.47Å; W86-K89 PolarHBondContact O-N 2.87Å; W86-V90 PolarHBondContact O-N 3.37Å; W86-C120 PolarHBondContact NE1-O 3.38Å; W86-E122 HydrophobicContact CB-CG 4.43Å; W86-E122 HydrophobicContact CD2-CB 3.75Å; W86-E122 HydrophobicContact CD2-CG 4.02Å; W86-E122 HydrophobicContact CE3-CB 4.08Å; W86-E122 HydrophobicContact CE3-CG 4.14Å; W86-E122 HydrophobicContact CG-CB 4.09Å; W86-E122 HydrophobicContact CG-CG 4.14Å; W86-E122 HydrophobicContact CH2-CB 4.46Å; W86-E122 HydrophobicContact CZ2-CB 4.15Å; W86-E122 HydrophobicContact CZ3-CB 4.43Å
87	F	88.9	Confident	91.1	Very high	55 Å²	55	56.1 Å²	56.1	24%	0.241	28%	0.284	C	S	.	.	H	α-helix	trans	-51.7	-36.9	-176.9	175.4	-111	0	0	0	113.6	C80 F82 L84 K89 V90 S91	C80-F87 HydrophobicContact CB-CD2 4.4Å; C80-F87 HydrophobicContact CB-CE2 4.44Å; C80-F87 WeakPolarHBondContact O-CE2 3.33Å; F82-F87 HydrophobicContact CB-CD1 4.15Å; F82-F87 HydrophobicContact CB-CD2 4.42Å; F82-F87 HydrophobicContact CB-CE1 4.07Å; F82-F87 HydrophobicContact CB-CE2 4.35Å; F82-F87 HydrophobicContact CB-CG 4.33Å; F82-F87 HydrophobicContact CB-CZ 4.17Å; L84-F87 HydrophobicContact CB-CB 4.36Å; L84-F87 VanDerWaalsContact O-CB 3.26Å; L84-F87 WeakPolarHBondContact O-CB 3.35Å; L84-F87 PolarHBondContact O-N 2.95Å; F87-K89 PolarHBondContact O-N 2.98Å; F87-K89 VanDerWaalsContact O-N 3.16Å; F87-V90 CarbonylContact O-C 3.55Å; F87-V90 PolarHBondContact O-N 3.37Å; F87-V90 VanDerWaalsContact O-N 3.11Å; F87-S91 VanDerWaalsContact O-CA 3.31Å; F87-S91 WeakPolarHBondContact O-CA 3.35Å; F87-S91 VanDerWaalsContact O-CB 3.32Å; F87-S91 WeakPolarHBondContact O-CB 3.29Å; F87-S91 PolarHBondContact O-N 3.09Å
88	H	86.3	Confident	91	Very high	170 Å²	170	55.5 Å²	55.5	79%	0.787	27%	0.274	S	S	*	.	H	α-helix	trans	-57.1	-32.3	177.9	-70.2	-68.5	0	0	0	113.6	W86 S91	W86-H88 PolarHBondContact O-N 3.46Å; W86-H88 VanDerWaalsContact O-N 3.07Å; H88-S91 PolarHBondContact O-OG 3.19Å
89	K	85.5	Confident	91	Very high	131 Å²	131	54.3 Å²	54.3	57%	0.57	27%	0.267	S	S	*	.	H	α-helix	trans	-79.3	-36.5	177.7	-61.7	-177.2	177	-176.3	0	112.3	W86 F87	W86-K89 WeakPolarHBondContact O-CB 3.47Å; W86-K89 PolarHBondContact O-N 2.87Å; F87-K89 PolarHBondContact O-N 2.98Å; F87-K89 VanDerWaalsContact O-N 3.16Å
90	V	90.4	Very high	90.9	Very high	18 Å²	18	51.3 Å²	51.3	11%	0.109	25%	0.248	C	C	.	.	H	α-helix	trans	-102.6	13.1	-175.8	-59.4	0	0	0	0	113.5	C80 L84 W86 F87 Q92 G93	C80-V90 HydrophobicContact CB-CB 4.46Å; C80-V90 HydrophobicContact CB-CG2 3.98Å; C80-V90 PolarHBondContact SG-O 3.15Å; L84-V90 HydrophobicContact CD1-CG2 4.42Å; W86-V90 PolarHBondContact O-N 3.37Å; F87-V90 CarbonylContact O-C 3.55Å; F87-V90 PolarHBondContact O-N 3.37Å; F87-V90 VanDerWaalsContact O-N 3.11Å; V90-Q92 PolarHBondContact O-N 3.06Å; V90-Q92 VanDerWaalsContact O-N 3.08Å; V90-G93 PolarHBondContact O-N 2.89Å
91	S	89.7	Confident	90.7	Very high	55 Å²	55	56.2 Å²	56.2	39%	0.385	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-23.7	-173	57.7	0	0	0	0	114	F87 H88	F87-S91 VanDerWaalsContact O-CA 3.31Å; F87-S91 WeakPolarHBondContact O-CA 3.35Å; F87-S91 VanDerWaalsContact O-CB 3.32Å; F87-S91 WeakPolarHBondContact O-CB 3.29Å; F87-S91 PolarHBondContact O-N 3.09Å; H88-S91 PolarHBondContact O-OG 3.19Å
92	Q	91	Very high	90.5	Very high	188 Å²	188	60.8 Å²	60.8	88%	0.879	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-11.1	176.1	-62.4	-174.8	-10.2	0	0	113.4	V90	V90-Q92 PolarHBondContact O-N 3.06Å; V90-Q92 VanDerWaalsContact O-N 3.08Å
93	G	92.3	Very high	90.2	Very high	10 Å²	10	57.7 Å²	57.7	10%	0.103	30%	0.297	C	S	.	.			trans	-76.7	161.5	179	0	0	0	0	0	112.4	C80 V90	C80-G93 PolarHBondContact N-O 2.89Å; C80-G93 VanDerWaalsContact N-O 3.09Å; C80-G93 PolarHBondContact SG-O 3.42Å; C80-G93 VanDerWaalsContact SG-O 3.32Å; V90-G93 PolarHBondContact O-N 2.89Å
94	S	94.4	Very high	90.4	Very high	29 Å²	29	62.3 Å²	62.3	20%	0.203	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	141.5	175.3	-62.6	0	0	0	0	112.2	V78 E119	V78-S94 CarbonylContact O-C 3.17Å; V78-S94 VanDerWaalsContact O-CA 3.23Å; V78-S94 WeakPolarHBondContact O-CA 3.33Å; V78-S94 WeakPolarHBondContact O-CB 3.39Å; S94-E119 PolarHBondContact N-OE2 2.98Å
95	V	94.6	Very high	90.5	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	143.7	164.9	-65.8	0	0	0	0	110.8	Y64 A65 W67 N77 V78 D116 I117 C120	Y64-V95 HydrophobicContact CE1-CG1 3.72Å; A65-V95 HydrophobicContact CB-CG2 3.81Å; W67-V95 HydrophobicContact CH2-CB 4.02Å; W67-V95 HydrophobicContact CH2-CG2 3.67Å; W67-V95 HydrophobicContact CZ2-CB 4.5Å; W67-V95 HydrophobicContact CZ2-CG2 4.06Å; W67-V95 HydrophobicContact CZ3-CG2 4.37Å; N77-V95 WeakPolarHBondContact CA-O 3.21Å; V78-V95 HydrophobicContact CB-CG2 4.01Å; V78-V95 PolarHBondContact N-O 3.26Å; V78-V95 WeakPolarHBondContact O-CG2 3.46Å; V78-V95 PolarHBondContact O-N 2.94Å; V95-D116 WeakPolarHBondContact CA-O 3.29Å; V95-I117 HydrophobicContact CG1-CB 4.23Å; V95-I117 HydrophobicContact CG1-CG2 3.91Å; V95-C120 HydrophobicContact CG1-CB 4.18Å; V95-C120 WeakPolarHBondContact CG1-SG 3.31Å
96	R	93.9	Very high	91	Very high	67 Å²	67	63.8 Å²	63.8	25%	0.253	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	142.4	-173.5	-54.5	-178.2	-83.1	-123.3	-14.4	111.5	V76 N77 R115 D116 E119	V76-R96 WeakPolarHBondContact O-CA 3.07Å; N77-R96 WeakPolarHBondContact OD1-CG 3.39Å; R96-R115 WeakPolarHBondContact O-CA 3.21Å; R96-D116 HydrophobicContact CB-CB 4.27Å; R96-D116 IonicContact CZ-OD2 3.96Å; R96-D116 PolarHBondContact N-O 3.46Å; R96-D116 IonicContact NE-OD2 3.74Å; R96-D116 PolarHBondContact NE-OD2 3.33Å; R96-D116 IonicContact NH2-OD1 3.79Å; R96-D116 IonicContact NH2-OD2 3.92Å; R96-D116 PolarHBondContact NH2-OD2 3.09Å; R96-D116 PolarHBondContact O-N 2.96Å; R96-E119 IonicContact CZ-OE1 3.33Å; R96-E119 VanDerWaalsContact CZ-OE1 3.25Å; R96-E119 IonicContact NH1-OE1 3.72Å; R96-E119 PolarHBondContact NH1-OE1 3.08Å; R96-E119 IonicContact NH2-OE1 3.16Å; R96-E119 PolarHBondContact NH2-OE1 3.28Å
97	R	93.1	Very high	91.1	Very high	14 Å²	14	64.7 Å²	64.7	5%	0.053	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	149.6	174.8	-170	169.5	170.6	165.7	-9	109.5	D62 W67 K75 V76 W105 V113 W114	D62-R97 IonicContact OD2-NH1 2.69Å; W67-R97 VanDerWaalsContact CD1-NH1 3.32Å; W67-R97 HydrophobicContact CD2-CB 4.15Å; W67-R97 HydrophobicContact CE3-CB 3.65Å; W67-R97 HydrophobicContact CE3-CG 4.46Å; W67-R97 HydrophobicContact CH2-CB 3.42Å; W67-R97 VanDerWaalsContact CH2-CB 3.42Å; W67-R97 HydrophobicContact CH2-CG 4.48Å; W67-R97 HydrophobicContact CZ2-CB 3.91Å; W67-R97 HydrophobicContact CZ3-CB 3.26Å; W67-R97 HydrophobicContact CZ3-CG 4.43Å; K75-R97 WeakPolarHBondContact CA-O 3.43Å; V76-R97 PolarHBondContact N-O 2.91Å; V76-R97 PolarHBondContact O-N 3.47Å; R97-W105 HydrophobicContact CB-CZ3 4.17Å; R97-W105 HydrophobicContact CG-CD2 4.38Å; R97-W105 HydrophobicContact CG-CE3 3.54Å; R97-W105 HydrophobicContact CG-CZ3 3.65Å; R97-W105 VanDerWaalsContact NE-CD2 3.28Å; R97-W105 VanDerWaalsContact NE-CE3 3.35Å; R97-W105 VanDerWaalsContact NH2-CD1 3.26Å; R97-V113 VanDerWaalsContact NE-CG1 3.26Å; R97-V113 VanDerWaalsContact NH2-CG1 3.27Å; R97-W114 WeakPolarHBondContact CG-O 3.44Å
98	R	92.8	Very high	91.1	Very high	88 Å²	88	65.2 Å²	65.2	33%	0.332	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	132.4	-177.9	-164.8	-171.6	-48.5	-135	4	111.1	K75 E106 W114	K75-R98 HydrophobicContact CG-CB 4.27Å; K75-R98 HydrophobicContact CG-CG 3.97Å; R98-E106 HydrophobicContact CB-CB 4.2Å; R98-E106 VanDerWaalsContact CB-OE2 3.22Å; R98-E106 WeakPolarHBondContact CB-OE2 3.37Å; R98-E106 WeakPolarHBondContact CD-OE2 3.49Å; R98-E106 IonicContact CZ-OE2 2.79Å; R98-E106 IonicContact NE-OE1 3.27Å; R98-E106 IonicContact NE-OE2 3.88Å; R98-E106 PolarHBondContact NE-OE2 2.93Å; R98-E106 PolarHBondContact O-N 3.34Å; R98-E106 VanDerWaalsContact O-N 3.09Å; R98-W114 HydrophobicContact CB-CE3 4.31Å; R98-W114 HydrophobicContact CB-CZ3 4.26Å
99	C	93.3	Very high	91	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	35%	0.349	C	S	.	.	B	Isolated β-bridge	trans	-89.5	126.1	167.1	-173.2	0	0	0	0	109.5	C57 A70 G73 F74 W105	C57-C99 HydrophobicContact CB-CB 3.89Å; C57-C99 WeakPolarHBondContact CB-SG 3.36Å; C57-C99 PolarHBondContact N-SG 3.48Å; C57-C99 WeakPolarHBondContact SG-CA 3.23Å; C57-C99 WeakPolarHBondContact SG-CB 3.36Å; C57-C99 CovalentContact SG-SG 2.03Å; C57-C99 PolarHBondContact SG-SG 3.29Å; A70-C99 HydrophobicContact CB-CB 3.77Å; A70-C99 PolarHBondContact O-SG 3.5Å; G73-C99 CarbonylContact C-O 3.42Å; G73-C99 VanDerWaalsContact CA-O 3.26Å; G73-C99 WeakPolarHBondContact CA-O 3.39Å; G73-C99 PolarHBondContact N-O 3.37Å; F74-C99 PolarHBondContact O-N 3.21Å; C99-W105 HydrophobicContact CB-CE3 4.42Å; C99-W105 HydrophobicContact CB-CZ3 4.31Å
100	G	92	Very high	90.7	Very high	14 Å²	14	63.5 Å²	63.5	14%	0.144	35%	0.349	C	S	.	.			trans	-65.5	162.7	175.4	0	0	0	0	0	112	A72 G73 D102 G103 L104	A72-G100 VanDerWaalsContact CA-O 3.31Å; A72-G100 WeakPolarHBondContact CA-O 3.44Å; A72-G100 WeakPolarHBondContact CB-O 3.33Å; G73-G100 PolarHBondContact N-O 2.87Å; G73-G100 VanDerWaalsContact N-O 3.14Å; G100-D102 WeakPolarHBondContact CA-OD1 3.11Å; G100-D102 PolarHBondContact O-N 3.09Å; G100-G103 PolarHBondContact O-N 3.22Å; G100-L104 WeakPolarHBondContact CA-O 3.05Å; G100-L104 PolarHBondContact N-O 3.45Å
101	S	90.9	Very high	90.4	Very high	107 Å²	107	65.3 Å²	65.3	75%	0.748	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-12.2	175.3	49.6	0	0	0	0	113.2	L55	L55-S101 VanDerWaalsContact CD2-O 3.29Å; L55-S101 WeakPolarHBondContact CD2-O 3.4Å
102	D	90.8	Very high	90.2	Very high	97 Å²	97	69 Å²	69	52%	0.519	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-2	174.6	61.5	-16	0	0	0	113.4	L55 G100 L104	L55-D102 VanDerWaalsContact CD2-C 3.47Å; G100-D102 WeakPolarHBondContact CA-OD1 3.11Å; G100-D102 PolarHBondContact O-N 3.09Å; D102-L104 VanDerWaalsContact C-N 3.27Å; D102-L104 PolarHBondContact OD1-N 3.03Å; D102-L104 VanDerWaalsContact OD1-N 3.14Å
103	G	87.7	Confident	90.1	Very high	11 Å²	11	62.8 Å²	62.8	11%	0.113	36%	0.357	C	S	.	.	S	Bend	trans	77.8	11.7	-177	0	0	0	0	0	113.7	C57 G100	C57-G103 VanDerWaalsContact SG-C 3.51Å; C57-G103 PolarHBondContact SG-O 3.36Å; G100-G103 PolarHBondContact O-N 3.22Å
104	L	90.9	Very high	90	Very high	113 Å²	113	66 Å²	66	59%	0.592	37%	0.366	S	S	*	.	S	Bend	trans	-106.3	151.3	173.7	-62.3	175.7	0	0	0	110.5	C57 G100 D102 E106	C57-L104 PolarHBondContact SG-O 3.22Å; G100-L104 WeakPolarHBondContact CA-O 3.05Å; G100-L104 PolarHBondContact N-O 3.45Å; D102-L104 VanDerWaalsContact C-N 3.27Å; D102-L104 PolarHBondContact OD1-N 3.03Å; D102-L104 VanDerWaalsContact OD1-N 3.14Å; L104-E106 PolarHBondContact O-N 2.96Å
105	W	91.8	Very high	89.7	Confident	35 Å²	35	68.6 Å²	68.6	13%	0.133	37%	0.371	C	S	.	.	B	Isolated β-bridge	trans	-68.2	132.3	175.4	-67.3	108.3	0	0	0	110.3	C57 N58 W67 A70 R97 C99 V113	C57-W105 HydrophobicContact CB-CD2 3.7Å; C57-W105 VanDerWaalsContact CB-CE2 3.47Å; C57-W105 HydrophobicContact CB-CE3 4.07Å; C57-W105 HydrophobicContact CB-CG 4.22Å; C57-W105 HydrophobicContact CB-CH2 4.09Å; C57-W105 HydrophobicContact CB-CZ2 3.69Å; C57-W105 HydrophobicContact CB-CZ3 4.26Å; N58-W105 PolarHBondContact O-NE1 2.97Å; W67-W105 HydrophobicContact CB-CH2 4.47Å; W67-W105 HydrophobicContact CB-CZ2 4.33Å; A70-W105 HydrophobicContact CB-CH2 3.67Å; A70-W105 HydrophobicContact CB-CZ2 4.48Å; A70-W105 HydrophobicContact CB-CZ3 4.02Å; R97-W105 HydrophobicContact CB-CZ3 4.17Å; R97-W105 HydrophobicContact CG-CD2 4.38Å; R97-W105 HydrophobicContact CG-CE3 3.54Å; R97-W105 HydrophobicContact CG-CZ3 3.65Å; R97-W105 VanDerWaalsContact NE-CD2 3.28Å; R97-W105 VanDerWaalsContact NE-CE3 3.35Å; R97-W105 VanDerWaalsContact NH2-CD1 3.26Å; C99-W105 HydrophobicContact CB-CE3 4.42Å; C99-W105 HydrophobicContact CB-CZ3 4.31Å; W105-V113 HydrophobicContact CB-CG1 3.49Å; W105-V113 VanDerWaalsContact CB-CG1 3.49Å; W105-V113 HydrophobicContact CB-CG2 4.28Å; W105-V113 HydrophobicContact CG-CG1 4.26Å
106	E	92.9	Very high	89.6	Confident	73 Å²	73	70.4 Å²	70.4	34%	0.341	38%	0.381	S	S	.	.			trans	-60.8	136.5	-178.8	-172	172.8	-141.4	0	0	110.8	R98 L104 V113 W114	R98-E106 HydrophobicContact CB-CB 4.2Å; R98-E106 VanDerWaalsContact CB-OE2 3.22Å; R98-E106 WeakPolarHBondContact CB-OE2 3.37Å; R98-E106 WeakPolarHBondContact CD-OE2 3.49Å; R98-E106 IonicContact CZ-OE2 2.79Å; R98-E106 IonicContact NE-OE1 3.27Å; R98-E106 IonicContact NE-OE2 3.88Å; R98-E106 PolarHBondContact NE-OE2 2.93Å; R98-E106 PolarHBondContact O-N 3.34Å; R98-E106 VanDerWaalsContact O-N 3.09Å; L104-E106 PolarHBondContact O-N 2.96Å; E106-V113 CarbonylContact O-C 3.58Å; E106-V113 WeakPolarHBondContact O-CG1 3.48Å; E106-W114 WeakPolarHBondContact O-CB 3.04Å; E106-W114 PolarHBondContact O-N 3.4Å
107	T	90.9	Very high	89.4	Confident	83 Å²	83	69.1 Å²	69.1	51%	0.509	38%	0.379	S	S	.	.	B	Isolated β-bridge	trans	-105.5	149.3	179.5	53.9	0	0	0	0	112	H112	T107-H112 CarbonylContact C-O 3.45Å; T107-H112 WeakPolarHBondContact CA-O 3.27Å; T107-H112 WeakPolarHBondContact CB-O 3.22Å
108	D	87.3	Confident	89.3	Confident	66 Å²	66	71.5 Å²	71.5	35%	0.353	40%	0.398	S	S	.	.			trans	-74.4	176.6	170.5	73.2	7.6	0	0	0	112.3	G110 G111 H112	D108-G110 PolarHBondContact O-N 3.2Å; D108-G110 VanDerWaalsContact O-N 3.12Å; D108-G110 WeakPolarHBondContact OD1-CA 3.15Å; D108-G110 PolarHBondContact OD1-N 3.41Å; D108-G111 PolarHBondContact O-N 3.02Å; D108-G111 PolarHBondContact OD1-N 3.25Å; D108-H112 PolarHBondContact N-O 3.32Å; D108-H112 PolarHBondContact OD1-N 3.14Å; D108-H112 IonicContact OD1-ND1 2.7Å
109	E	83.9	Confident	89.2	Confident	210 Å²	210	71.2 Å²	71.2	98%	0.981	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-18.3	177.5	-61.9	-174.3	173.3	0	0	113.3
110	G	80.6	Confident	89.1	Confident	56 Å²	56	71.2 Å²	71.2	58%	0.577	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	3.3	176.9	0	0	0	0	0	114.5	D108 H112	D108-G110 PolarHBondContact O-N 3.2Å; D108-G110 VanDerWaalsContact O-N 3.12Å; D108-G110 WeakPolarHBondContact OD1-CA 3.15Å; D108-G110 PolarHBondContact OD1-N 3.41Å; G110-H112 VanDerWaalsContact C-N 3.3Å; G110-H112 PolarHBondContact O-N 2.93Å
111	G	83.3	Confident	88.9	Confident	56 Å²	56	76 Å²	76	58%	0.577	42%	0.419	S	S	*	.	S	Bend	trans	77.2	8.1	-179.2	0	0	0	0	0	115	D108	D108-G111 PolarHBondContact O-N 3.02Å; D108-G111 PolarHBondContact OD1-N 3.25Å
112	H	85.3	Confident	88.5	Confident	131 Å²	131	73.1 Å²	73.1	61%	0.606	39%	0.393	S	S	*	.	S	Bend	trans	-86.8	152.6	171.9	-57.4	95.6	0	0	0	109.8	T107 D108 G110 W114	T107-H112 CarbonylContact C-O 3.45Å; T107-H112 WeakPolarHBondContact CA-O 3.27Å; T107-H112 WeakPolarHBondContact CB-O 3.22Å; D108-H112 PolarHBondContact N-O 3.32Å; D108-H112 PolarHBondContact OD1-N 3.14Å; D108-H112 IonicContact OD1-ND1 2.7Å; G110-H112 VanDerWaalsContact C-N 3.3Å; G110-H112 PolarHBondContact O-N 2.93Å; H112-W114 PolarHBondContact O-N 3.31Å
113	V	89.3	Confident	88	Confident	59 Å²	59	74.8 Å²	74.8	36%	0.358	40%	0.398	S	S	.	.	B	Isolated β-bridge	trans	-66	122.6	176.1	-178.2	0	0	0	0	110.2	R97 W105 E106	R97-V113 VanDerWaalsContact NE-CG1 3.26Å; R97-V113 VanDerWaalsContact NH2-CG1 3.27Å; W105-V113 HydrophobicContact CB-CG1 3.49Å; W105-V113 VanDerWaalsContact CB-CG1 3.49Å; W105-V113 HydrophobicContact CB-CG2 4.28Å; W105-V113 HydrophobicContact CG-CG1 4.26Å; E106-V113 CarbonylContact O-C 3.58Å; E106-V113 WeakPolarHBondContact O-CG1 3.48Å
114	W	90.1	Very high	87.5	Confident	77 Å²	77	82.6 Å²	82.6	29%	0.292	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-64.7	139.6	-177.3	178.2	85.6	0	0	0	111.3	R97 R98 E106 H112 D116	R97-W114 WeakPolarHBondContact CG-O 3.44Å; R98-W114 HydrophobicContact CB-CE3 4.31Å; R98-W114 HydrophobicContact CB-CZ3 4.26Å; E106-W114 WeakPolarHBondContact O-CB 3.04Å; E106-W114 PolarHBondContact O-N 3.4Å; H112-W114 PolarHBondContact O-N 3.31Å; W114-D116 HydrophobicContact CH2-CB 3.65Å; W114-D116 HydrophobicContact CZ2-CB 3.65Å
115	R	89.1	Confident	86.7	Confident	84 Å²	84	85 Å²	85	32%	0.317	44%	0.44	S	S	.	.			trans	-152.7	141.8	175.9	52.5	-176	-113	-171	-5.2	109.7	D62 Y64 R96 I117	D62-R115 IonicContact OD2-NH1 2.9Å; D62-R115 PolarHBondContact OD2-NH1 2.96Å; Y64-R115 VanDerWaalsContact CB-NH1 3.3Å; R96-R115 WeakPolarHBondContact O-CA 3.21Å; R115-I117 HydrophobicContact CG-CG2 4.5Å
116	D	91.3	Very high	85.7	Confident	38 Å²	38	84.1 Å²	84.1	20%	0.203	44%	0.44	C	S	.	.	B	Isolated β-bridge	trans	-109.1	116.5	173.8	174	14	0	0	0	109.1	V95 R96 W114 S118	V95-D116 WeakPolarHBondContact CA-O 3.29Å; R96-D116 HydrophobicContact CB-CB 4.27Å; R96-D116 IonicContact CZ-OD2 3.96Å; R96-D116 PolarHBondContact N-O 3.46Å; R96-D116 IonicContact NE-OD2 3.74Å; R96-D116 PolarHBondContact NE-OD2 3.33Å; R96-D116 IonicContact NH2-OD1 3.79Å; R96-D116 IonicContact NH2-OD2 3.92Å; R96-D116 PolarHBondContact NH2-OD2 3.09Å; R96-D116 PolarHBondContact O-N 2.96Å; W114-D116 HydrophobicContact CH2-CB 3.65Å; W114-D116 HydrophobicContact CZ2-CB 3.65Å; D116-S118 WeakPolarHBondContact OD1-CB 3.3Å; D116-S118 PolarHBondContact OD1-N 2.98Å; D116-S118 VanDerWaalsContact OD1-N 3.14Å; D116-S118 PolarHBondContact OD1-OG 3.28Å
117	I	91.2	Very high	84.7	Confident	39 Å²	39	82.3 Å²	82.3	20%	0.2	44%	0.437	C	S	.	.			trans	-115.6	6.5	-176.7	64.9	172	0	0	0	112.9	Y64 V95 R115 E119 C120 E121	Y64-I117 HydrophobicContact CE1-CG2 4.2Å; V95-I117 HydrophobicContact CG1-CB 4.23Å; V95-I117 HydrophobicContact CG1-CG2 3.91Å; R115-I117 HydrophobicContact CG-CG2 4.5Å; I117-E119 PolarHBondContact O-N 3.08Å; I117-E119 VanDerWaalsContact O-N 3.14Å; I117-C120 PolarHBondContact O-N 3.39Å; I117-E121 HydrophobicContact CD1-CG 4.5Å; I117-E121 HydrophobicContact CG1-CG 4.33Å; I117-E121 PolarHBondContact O-N 3.29Å
118	S	90.3	Very high	84	Confident	65 Å²	65	81.8 Å²	81.8	46%	0.455	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-54.1	-36.1	-172.8	51.7	0	0	0	0	113.7	D116 C120	D116-S118 WeakPolarHBondContact OD1-CB 3.3Å; D116-S118 PolarHBondContact OD1-N 2.98Å; D116-S118 VanDerWaalsContact OD1-N 3.14Å; D116-S118 PolarHBondContact OD1-OG 3.28Å; S118-C120 PolarHBondContact O-N 2.89Å
119	E	90.8	Very high	83.4	Confident	81 Å²	81	84.4 Å²	84.4	38%	0.379	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-74	-10.3	178.4	-64.3	-177.6	-163.8	0	0	114.3	S94 R96 I117	S94-E119 PolarHBondContact N-OE2 2.98Å; R96-E119 IonicContact CZ-OE1 3.33Å; R96-E119 VanDerWaalsContact CZ-OE1 3.25Å; R96-E119 IonicContact NH1-OE1 3.72Å; R96-E119 PolarHBondContact NH1-OE1 3.08Å; R96-E119 IonicContact NH2-OE1 3.16Å; R96-E119 PolarHBondContact NH2-OE1 3.28Å; I117-E119 PolarHBondContact O-N 3.08Å; I117-E119 VanDerWaalsContact O-N 3.14Å
120	C	90.8	Very high	82.9	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-114.5	3	-179.2	-53.3	0	0	0	0	113.3	C80 L84 W86 V95 I117 S118	C80-C120 WeakPolarHBondContact CA-SG 3.16Å; C80-C120 HydrophobicContact CB-CB 3.9Å; C80-C120 WeakPolarHBondContact CB-SG 3.45Å; C80-C120 VanDerWaalsContact SG-CA 3.53Å; C80-C120 WeakPolarHBondContact SG-CB 3.32Å; C80-C120 CovalentContact SG-SG 2.02Å; C80-C120 PolarHBondContact SG-SG 3.22Å; L84-C120 HydrophobicContact CD1-CB 4.29Å; W86-C120 PolarHBondContact NE1-O 3.38Å; V95-C120 HydrophobicContact CG1-CB 4.18Å; V95-C120 WeakPolarHBondContact CG1-SG 3.31Å; I117-C120 PolarHBondContact O-N 3.39Å; S118-C120 PolarHBondContact O-N 2.89Å
121	E	88.2	Confident	82.8	Confident	116 Å²	116	80.3 Å²	80.3	54%	0.542	42%	0.415	S	S	.	.	S	Bend	trans	-73.2	149.2	175.4	-73.6	-178.1	168.8	0	0	111.4	I117	I117-E121 HydrophobicContact CD1-CG 4.5Å; I117-E121 HydrophobicContact CG1-CG 4.33Å; I117-E121 PolarHBondContact O-N 3.29Å
122	E	82.1	Confident	82.6	Confident	46 Å²	46	82.5 Å²	82.5	22%	0.215	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-76.4	135.6	174.8	-169.3	171.4	-152.5	0	0	109.5	W86 E124 A127	W86-E122 HydrophobicContact CB-CG 4.43Å; W86-E122 HydrophobicContact CD2-CB 3.75Å; W86-E122 HydrophobicContact CD2-CG 4.02Å; W86-E122 HydrophobicContact CE3-CB 4.08Å; W86-E122 HydrophobicContact CE3-CG 4.14Å; W86-E122 HydrophobicContact CG-CB 4.09Å; W86-E122 HydrophobicContact CG-CG 4.14Å; W86-E122 HydrophobicContact CH2-CB 4.46Å; W86-E122 HydrophobicContact CZ2-CB 4.15Å; W86-E122 HydrophobicContact CZ3-CB 4.43Å; E122-E124 PolarHBondContact O-N 3.49Å; E122-A127 HydrophobicContact CG-CB 4.22Å
123	E	79.8	Confident	82.1	Confident	132 Å²	132	77.1 Å²	77.1	62%	0.617	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-54.8	126.8	172.8	-68.2	171.1	161.9	0	0	110.6	E125 A126 A127	E123-E125 PolarHBondContact O-N 3.37Å; E123-E125 VanDerWaalsContact O-N 3.16Å; E123-A126 HydrophobicContact CB-CB 4.24Å; E123-A126 WeakPolarHBondContact O-CB 3.46Å; E123-A126 PolarHBondContact O-N 3.01Å; E123-A127 PolarHBondContact O-N 2.92Å
124	E	76.9	Confident	81.5	Confident	174 Å²	174	78.8 Å²	78.8	81%	0.813	39%	0.387	S	S	*	.	H	α-helix	trans	-54.6	-38.6	-175.6	-70.3	-170.9	159.6	0	0	112.8	E122 A127 S128	E122-E124 PolarHBondContact O-N 3.49Å; E124-A127 PolarHBondContact O-N 3.04Å; E124-S128 WeakPolarHBondContact O-CB 3.48Å; E124-S128 PolarHBondContact O-N 3.05Å
125	E	75.3	Confident	81.1	Confident	165 Å²	165	81 Å²	81	77%	0.771	40%	0.401	S	S	*	.	H	α-helix	trans	-62.3	-44	176.7	-67.8	-173.6	176.1	0	0	111.6	E123 S128 Q129	E123-E125 PolarHBondContact O-N 3.37Å; E123-E125 VanDerWaalsContact O-N 3.16Å; E125-S128 PolarHBondContact O-N 2.91Å; E125-S128 PolarHBondContact O-OG 3.35Å; E125-Q129 WeakPolarHBondContact O-CB 3.46Å; E125-Q129 PolarHBondContact O-N 3.06Å
126	A	71.4	Confident	80.8	Confident	15 Å²	15	79.7 Å²	79.7	12%	0.124	40%	0.4	C	S	.	.	H	α-helix	trans	-67.6	-42.4	178.4	0	0	0	0	0	111.9	E123 S128 Q129 E130	E123-A126 HydrophobicContact CB-CB 4.24Å; E123-A126 WeakPolarHBondContact O-CB 3.46Å; E123-A126 PolarHBondContact O-N 3.01Å; A126-S128 PolarHBondContact O-N 3.22Å; A126-Q129 WeakPolarHBondContact O-CA 3.29Å; A126-Q129 WeakPolarHBondContact O-CB 3.07Å; A126-Q129 PolarHBondContact O-N 2.98Å; A126-Q129 VanDerWaalsContact O-N 3.08Å; A126-E130 PolarHBondContact O-N 2.86Å
127	A	71.9	Confident	80.2	Confident	35 Å²	35	82.9 Å²	82.9	29%	0.289	42%	0.415	S	S	.	.	H	α-helix	trans	-62.1	-42.8	176.2	0	0	0	0	0	111.6	E122 E123 E124 Q129 E130 L131	E122-A127 HydrophobicContact CG-CB 4.22Å; E123-A127 PolarHBondContact O-N 2.92Å; E124-A127 PolarHBondContact O-N 3.04Å; A127-Q129 VanDerWaalsContact C-N 3.26Å; A127-Q129 PolarHBondContact O-N 2.78Å; A127-E130 PolarHBondContact O-N 2.88Å; A127-L131 WeakPolarHBondContact O-CB 2.93Å; A127-L131 PolarHBondContact O-N 3.22Å
128	S	75.2	Confident	79.7	Confident	72 Å²	72	84.6 Å²	84.6	50%	0.503	43%	0.427	S	S	.	.	H	α-helix	trans	-61.9	-37.2	173.4	82.7	0	0	0	0	111.4	E124 E125 A126 L131 W132	E124-S128 WeakPolarHBondContact O-CB 3.48Å; E124-S128 PolarHBondContact O-N 3.05Å; E125-S128 PolarHBondContact O-N 2.91Å; E125-S128 PolarHBondContact O-OG 3.35Å; A126-S128 PolarHBondContact O-N 3.22Å; S128-L131 PolarHBondContact O-N 3.18Å; S128-W132 VanDerWaalsContact O-CD1 3.25Å; S128-W132 PolarHBondContact O-N 2.98Å; S128-W132 VanDerWaalsContact O-N 3.15Å
129	Q	74.9	Confident	79.4	Confident	121 Å²	121	83.3 Å²	83.3	57%	0.565	42%	0.424	S	S	*	.	H	α-helix	trans	-66.2	-43.8	-179.7	-154.9	-179.3	-47.3	0	0	112	E125 A126 A127 W132 A133	E125-Q129 WeakPolarHBondContact O-CB 3.46Å; E125-Q129 PolarHBondContact O-N 3.06Å; A126-Q129 WeakPolarHBondContact O-CA 3.29Å; A126-Q129 WeakPolarHBondContact O-CB 3.07Å; A126-Q129 PolarHBondContact O-N 2.98Å; A126-Q129 VanDerWaalsContact O-N 3.08Å; A127-Q129 VanDerWaalsContact C-N 3.26Å; A127-Q129 PolarHBondContact O-N 2.78Å; Q129-W132 VanDerWaalsContact C-CD1 3.42Å; Q129-W132 HydrophobicContact CG-CZ2 4.02Å; Q129-W132 PolarHBondContact O-NE1 3.08Å; Q129-A133 PolarHBondContact O-N 3.46Å
130	E	73.6	Confident	79.2	Confident	82 Å²	82	80.2 Å²	80.2	38%	0.383	41%	0.409	S	S	.	.	H	α-helix	trans	-67.2	-38.5	175.9	-69.6	-151.6	164	0	0	112.7	A126 A127 A133 K134	A126-E130 PolarHBondContact O-N 2.86Å; A127-E130 PolarHBondContact O-N 2.88Å; E130-A133 PolarHBondContact O-N 3.03Å; E130-K134 WeakPolarHBondContact O-CB 3.3Å; E130-K134 VanDerWaalsContact O-CG 3.3Å; E130-K134 WeakPolarHBondContact O-CG 3.41Å; E130-K134 PolarHBondContact O-N 3.49Å; E130-K134 IonicContact OE2-NZ 3.97Å; E130-K134 PolarHBondContact OE2-NZ 3.16Å
131	L	77.8	Confident	78.9	Confident	98 Å²	98	82.9 Å²	82.9	51%	0.513	42%	0.419	S	S	.	.	H	α-helix	trans	-63.1	-45.7	-179	-173.6	67.3	0	0	0	111.3	A127 S128 A133 K134 Q135	A127-L131 WeakPolarHBondContact O-CB 2.93Å; A127-L131 PolarHBondContact O-N 3.22Å; S128-L131 PolarHBondContact O-N 3.18Å; L131-A133 VanDerWaalsContact C-N 3.32Å; L131-A133 PolarHBondContact O-N 3.45Å; L131-K134 PolarHBondContact O-N 3.32Å; L131-Q135 WeakPolarHBondContact O-CG 3.23Å; L131-Q135 PolarHBondContact O-N 3.28Å
132	W	79.1	Confident	78.7	Confident	102 Å²	102	81.2 Å²	81.2	39%	0.386	42%	0.417	S	S	.	.	H	α-helix	trans	-65.2	-37.7	176.9	74.9	-105.9	0	0	0	111.8	S128 Q129 Q135 L136 Y379	S128-W132 VanDerWaalsContact O-CD1 3.25Å; S128-W132 PolarHBondContact O-N 2.98Å; S128-W132 VanDerWaalsContact O-N 3.15Å; Q129-W132 VanDerWaalsContact C-CD1 3.42Å; Q129-W132 HydrophobicContact CG-CZ2 4.02Å; Q129-W132 PolarHBondContact O-NE1 3.08Å; W132-Q135 PolarHBondContact O-N 3.27Å; W132-L136 HydrophobicContact CE3-CD2 4.25Å; W132-L136 HydrophobicContact CZ3-CD2 3.89Å; W132-L136 VanDerWaalsContact O-CB 3.28Å; W132-L136 WeakPolarHBondContact O-CB 3.31Å; W132-L136 PolarHBondContact O-N 3.12Å; W132-Y379 HydrophobicContact CH2-CD2 4.03Å; W132-Y379 AromaticContact CH2-CE2 3.41Å; W132-Y379 HydrophobicContact CH2-CE2 3.41Å; W132-Y379 VanDerWaalsContact CH2-CE2 3.41Å; W132-Y379 AromaticContact CH2-CZ 3.85Å; W132-Y379 HydrophobicContact CZ2-CE2 4.5Å; W132-Y379 HydrophobicContact CZ3-CD2 4.18Å; W132-Y379 AromaticContact CZ3-CE2 3.83Å; W132-Y379 HydrophobicContact CZ3-CE2 3.83Å
133	A	75.5	Confident	79.1	Confident	19 Å²	19	81.2 Å²	81.2	16%	0.157	42%	0.419	C	S	.	.	H	α-helix	trans	-64.3	-42.2	177.7	0	0	0	0	0	111.1	Q129 E130 L131 L136 M137	Q129-A133 PolarHBondContact O-N 3.46Å; E130-A133 PolarHBondContact O-N 3.03Å; L131-A133 VanDerWaalsContact C-N 3.32Å; L131-A133 PolarHBondContact O-N 3.45Å; A133-L136 PolarHBondContact O-N 3.45Å; A133-M137 VanDerWaalsContact O-CG 3.29Å; A133-M137 WeakPolarHBondContact O-CG 3.34Å; A133-M137 PolarHBondContact O-N 3.19Å
134	K	77.3	Confident	79.5	Confident	93 Å²	93	76.4 Å²	76.4	40%	0.404	40%	0.395	S	S	.	.	H	α-helix	trans	-61.5	-48.1	174.2	-73.6	166.8	-172.2	156.1	0	111.1	E130 L131 L136 M137 V138	E130-K134 WeakPolarHBondContact O-CB 3.3Å; E130-K134 VanDerWaalsContact O-CG 3.3Å; E130-K134 WeakPolarHBondContact O-CG 3.41Å; E130-K134 PolarHBondContact O-N 3.49Å; E130-K134 IonicContact OE2-NZ 3.97Å; E130-K134 PolarHBondContact OE2-NZ 3.16Å; L131-K134 PolarHBondContact O-N 3.32Å; K134-L136 VanDerWaalsContact C-N 3.35Å; K134-L136 PolarHBondContact O-N 3.28Å; K134-M137 PolarHBondContact O-N 2.9Å; K134-V138 WeakPolarHBondContact O-CG2 3.37Å; K134-V138 PolarHBondContact O-N 2.93Å
135	Q	80.4	Confident	80.1	Confident	125 Å²	125	69.4 Å²	69.4	58%	0.584	36%	0.364	S	S	*	.	H	α-helix	trans	-61.3	-41.7	177.5	-73.3	177.2	-4	0	0	112.3	L131 W132 M137 V138 G139	L131-Q135 WeakPolarHBondContact O-CG 3.23Å; L131-Q135 PolarHBondContact O-N 3.28Å; W132-Q135 PolarHBondContact O-N 3.27Å; Q135-M137 PolarHBondContact O-N 3.22Å; Q135-V138 PolarHBondContact O-N 3.28Å; Q135-G139 PolarHBondContact O-N 3.43Å
136	L	82.2	Confident	80.8	Confident	56 Å²	56	65.7 Å²	65.7	29%	0.293	35%	0.353	S	S	.	.	H	α-helix	trans	-62.6	-43.2	177.7	-175.3	67.1	0	0	0	111.8	W132 A133 K134 V138 G139 F140 Y379	W132-L136 HydrophobicContact CE3-CD2 4.25Å; W132-L136 HydrophobicContact CZ3-CD2 3.89Å; W132-L136 VanDerWaalsContact O-CB 3.28Å; W132-L136 WeakPolarHBondContact O-CB 3.31Å; W132-L136 PolarHBondContact O-N 3.12Å; A133-L136 PolarHBondContact O-N 3.45Å; K134-L136 VanDerWaalsContact C-N 3.35Å; K134-L136 PolarHBondContact O-N 3.28Å; L136-V138 VanDerWaalsContact C-N 3.34Å; L136-V138 PolarHBondContact O-N 2.82Å; L136-G139 CarbonylContact O-C 3.58Å; L136-G139 WeakPolarHBondContact O-CA 3.35Å; L136-G139 PolarHBondContact O-N 2.95Å; L136-G139 VanDerWaalsContact O-N 3.13Å; L136-F140 HydrophobicContact CD1-CD1 4.39Å; L136-F140 HydrophobicContact CD1-CE1 3.65Å; L136-F140 HydrophobicContact CD1-CZ 3.76Å; L136-F140 HydrophobicContact CD2-CE2 4.15Å; L136-F140 HydrophobicContact CD2-CZ 3.83Å; L136-F140 HydrophobicContact CG-CE1 3.92Å; L136-F140 HydrophobicContact CG-CE2 3.94Å; L136-F140 HydrophobicContact CG-CZ 3.6Å; L136-F140 WeakPolarHBondContact O-CG 3.29Å; L136-F140 PolarHBondContact O-N 2.84Å; L136-Y379 HydrophobicContact CD2-CD1 3.56Å; L136-Y379 HydrophobicContact CD2-CE1 4.11Å; L136-Y379 HydrophobicContact CD2-CG 3.81Å
137	M	79.4	Confident	81.8	Confident	105 Å²	105	65 Å²	65	52%	0.517	35%	0.347	S	S	.	.	H	α-helix	trans	-64.4	-37.7	176.8	-71.2	-65.6	-70.8	0	0	112.3	A133 K134 Q135 G139 F140 R141	A133-M137 VanDerWaalsContact O-CG 3.29Å; A133-M137 WeakPolarHBondContact O-CG 3.34Å; A133-M137 PolarHBondContact O-N 3.19Å; K134-M137 PolarHBondContact O-N 2.9Å; Q135-M137 PolarHBondContact O-N 3.22Å; M137-G139 VanDerWaalsContact C-N 3.34Å; M137-F140 PolarHBondContact O-N 3.46Å; M137-F140 HydrophobicContact SD-CD2 4.06Å; M137-R141 WeakPolarHBondContact O-CB 3.36Å; M137-R141 PolarHBondContact O-N 3.37Å
138	V	81.9	Confident	82.8	Confident	74 Å²	74	64 Å²	64	45%	0.448	34%	0.336	S	S	.	.	H	α-helix	trans	-63	-42.5	170.7	173.7	0	0	0	0	110.6	K134 Q135 L136 F140 R141 T142	K134-V138 WeakPolarHBondContact O-CG2 3.37Å; K134-V138 PolarHBondContact O-N 2.93Å; Q135-V138 PolarHBondContact O-N 3.28Å; L136-V138 VanDerWaalsContact C-N 3.34Å; L136-V138 PolarHBondContact O-N 2.82Å; V138-F140 PolarHBondContact O-N 2.99Å; V138-R141 WeakPolarHBondContact O-CB 3.5Å; V138-R141 PolarHBondContact O-N 2.88Å; V138-T142 PolarHBondContact O-N 3.48Å; V138-T142 PolarHBondContact O-OG1 3.47Å
139	G	83.3	Confident	83.6	Confident	39 Å²	39	62.6 Å²	62.6	40%	0.402	33%	0.326	S	S	.	.	H	α-helix	trans	-58.5	-47	174.2	0	0	0	0	0	113	Q135 L136 M137 R141 T142 L143	Q135-G139 PolarHBondContact O-N 3.43Å; L136-G139 CarbonylContact O-C 3.58Å; L136-G139 WeakPolarHBondContact O-CA 3.35Å; L136-G139 PolarHBondContact O-N 2.95Å; L136-G139 VanDerWaalsContact O-N 3.13Å; M137-G139 VanDerWaalsContact C-N 3.34Å; G139-R141 VanDerWaalsContact C-N 3.27Å; G139-R141 PolarHBondContact O-N 2.83Å; G139-T142 PolarHBondContact O-N 3.05Å; G139-L143 WeakPolarHBondContact O-CB 3.24Å; G139-L143 PolarHBondContact O-N 2.84Å
140	F	86.8	Confident	84.5	Confident	15 Å²	15	60.6 Å²	60.6	7%	0.066	32%	0.319	C	S	.	.	H	α-helix	trans	-60.5	-39	175.3	-67	-13.8	0	0	0	112.1	L136 M137 V138 L143 Y144 Y379 V382 F383 L386	L136-F140 HydrophobicContact CD1-CD1 4.39Å; L136-F140 HydrophobicContact CD1-CE1 3.65Å; L136-F140 HydrophobicContact CD1-CZ 3.76Å; L136-F140 HydrophobicContact CD2-CE2 4.15Å; L136-F140 HydrophobicContact CD2-CZ 3.83Å; L136-F140 HydrophobicContact CG-CE1 3.92Å; L136-F140 HydrophobicContact CG-CE2 3.94Å; L136-F140 HydrophobicContact CG-CZ 3.6Å; L136-F140 WeakPolarHBondContact O-CG 3.29Å; L136-F140 PolarHBondContact O-N 2.84Å; M137-F140 PolarHBondContact O-N 3.46Å; M137-F140 HydrophobicContact SD-CD2 4.06Å; V138-F140 PolarHBondContact O-N 2.99Å; F140-L143 WeakPolarHBondContact O-CB 3.47Å; F140-L143 PolarHBondContact O-N 3.16Å; F140-Y144 WeakPolarHBondContact O-CD1 3.18Å; F140-Y144 PolarHBondContact O-N 2.96Å; F140-Y379 HydrophobicContact CE2-CD1 4.22Å; F140-V382 HydrophobicContact CD2-CG1 3.87Å; F140-V382 HydrophobicContact CE2-CB 4.4Å; F140-V382 HydrophobicContact CE2-CG1 3.98Å; F140-F383 HydrophobicContact CD1-CB 4.46Å; F140-F383 AromaticContact CD1-CD2 3.93Å; F140-F383 HydrophobicContact CD1-CD2 3.93Å; F140-F383 HydrophobicContact CE1-CB 3.75Å; F140-F383 AromaticContact CE1-CD2 3.6Å; F140-F383 HydrophobicContact CE1-CD2 3.6Å; F140-F383 HydrophobicContact CE1-CG 4.13Å; F140-F383 HydrophobicContact CZ-CB 3.87Å; F140-L386 HydrophobicContact CB-CD1 4.08Å
141	R	85.1	Confident	85.5	Confident	56 Å²	56	56.8 Å²	56.8	21%	0.211	30%	0.301	C	S	.	.	H	α-helix	trans	-61.1	-49.6	175.4	178.2	165.1	-164.2	-166.4	0.2	113.1	M137 V138 G139 L143 Y144 T145 D194 D198	M137-R141 WeakPolarHBondContact O-CB 3.36Å; M137-R141 PolarHBondContact O-N 3.37Å; V138-R141 WeakPolarHBondContact O-CB 3.5Å; V138-R141 PolarHBondContact O-N 2.88Å; G139-R141 VanDerWaalsContact C-N 3.27Å; G139-R141 PolarHBondContact O-N 2.83Å; R141-L143 VanDerWaalsContact C-N 3.29Å; R141-L143 PolarHBondContact O-N 3.48Å; R141-Y144 HydrophobicContact CB-CE1 4.02Å; R141-Y144 HydrophobicContact CG-CE1 4.27Å; R141-Y144 HydrophobicContact CG-CE2 4.46Å; R141-Y144 WeakPolarHBondContact CG-OH 3.49Å; R141-T145 VanDerWaalsContact O-CB 3.25Å; R141-T145 WeakPolarHBondContact O-CB 3.39Å; R141-T145 PolarHBondContact O-N 3.25Å; R141-T145 PolarHBondContact O-OG1 3.27Å; R141-D194 PolarHBondContact NH2-O 3.01Å; R141-D198 IonicContact CZ-OD1 3.96Å; R141-D198 VanDerWaalsContact CZ-OD1 3.29Å; R141-D198 IonicContact CZ-OD2 3.25Å; R141-D198 IonicContact NH1-OD1 3.35Å; R141-D198 PolarHBondContact NH1-OD1 3.36Å; R141-D198 IonicContact NH1-OD2 3.15Å; R141-D198 PolarHBondContact NH1-OD2 3.04Å; R141-D198 IonicContact NH2-OD1 2.71Å; R141-D198 PolarHBondContact NH2-OD1 3.17Å; R141-D198 IonicContact NH2-OD2 3.26Å; R141-D198 PolarHBondContact NH2-OD2 3.44Å
142	T	83.9	Confident	86.3	Confident	82 Å²	82	52.5 Å²	52.5	50%	0.503	28%	0.279	S	S	.	.	H	α-helix	trans	-59.2	-44.1	175.9	-57.6	0	0	0	0	110.9	V138 G139 T145 V146	V138-T142 PolarHBondContact O-N 3.48Å; V138-T142 PolarHBondContact O-OG1 3.47Å; G139-T142 PolarHBondContact O-N 3.05Å; T142-T145 PolarHBondContact O-N 3.41Å; T142-V146 HydrophobicContact CG2-CG2 4.48Å; T142-V146 VanDerWaalsContact O-CG2 3.32Å; T142-V146 WeakPolarHBondContact O-CG2 3.45Å; T142-V146 PolarHBondContact O-N 3.48Å
143	L	88.8	Confident	87	Confident	46 Å²	46	50.3 Å²	50.3	24%	0.241	28%	0.279	C	S	.	.	H	α-helix	trans	-57.9	-55.6	179.9	-178.3	70.9	0	0	0	112.5	G139 F140 R141 T145 V146 G147 F383 F387	G139-L143 WeakPolarHBondContact O-CB 3.24Å; G139-L143 PolarHBondContact O-N 2.84Å; F140-L143 WeakPolarHBondContact O-CB 3.47Å; F140-L143 PolarHBondContact O-N 3.16Å; R141-L143 VanDerWaalsContact C-N 3.29Å; R141-L143 PolarHBondContact O-N 3.48Å; L143-T145 VanDerWaalsContact C-N 3.29Å; L143-T145 PolarHBondContact O-N 3.47Å; L143-V146 PolarHBondContact O-N 2.98Å; L143-G147 PolarHBondContact O-N 2.98Å; L143-F383 HydrophobicContact CD2-CD2 3.78Å; L143-F383 HydrophobicContact CD2-CE2 3.41Å; L143-F383 VanDerWaalsContact CD2-CE2 3.41Å; L143-F383 HydrophobicContact CD2-CZ 4.21Å; L143-F387 HydrophobicContact CD1-CD2 4.02Å; L143-F387 HydrophobicContact CD1-CE2 4.43Å; L143-F387 HydrophobicContact CD2-CB 4.17Å; L143-F387 HydrophobicContact CD2-CD2 4.03Å; L143-F387 HydrophobicContact CG-CD2 4.23Å
144	Y	89.8	Confident	87.9	Confident	30 Å²	30	50.7 Å²	50.7	12%	0.118	28%	0.279	C	S	.	.	H	α-helix	trans	-69.7	-29.7	-178.3	72.6	-116.5	0	0	0	111.9	F140 R141 G147 Y148 V190 D194 L386	F140-Y144 WeakPolarHBondContact O-CD1 3.18Å; F140-Y144 PolarHBondContact O-N 2.96Å; R141-Y144 HydrophobicContact CB-CE1 4.02Å; R141-Y144 HydrophobicContact CG-CE1 4.27Å; R141-Y144 HydrophobicContact CG-CE2 4.46Å; R141-Y144 WeakPolarHBondContact CG-OH 3.49Å; Y144-G147 PolarHBondContact O-N 3.36Å; Y144-Y148 AromaticContact CD2-CD2 3.97Å; Y144-Y148 HydrophobicContact CD2-CD2 3.97Å; Y144-Y148 HydrophobicContact CD2-CE2 4.18Å; Y144-Y148 WeakPolarHBondContact O-CB 3.36Å; Y144-Y148 WeakPolarHBondContact O-CD2 3.48Å; Y144-Y148 PolarHBondContact O-N 2.95Å; Y144-V190 HydrophobicContact CD2-CG1 4.41Å; Y144-V190 HydrophobicContact CE2-CG1 4.16Å; Y144-D194 VanDerWaalsContact CE2-OD2 3.23Å; Y144-D194 WeakPolarHBondContact CE2-OD2 3.47Å; Y144-D194 PolarHBondContact OH-OD2 3.25Å; Y144-D194 VanDerWaalsContact OH-OD2 3.05Å; Y144-L386 HydrophobicContact CD1-CD1 4.08Å; Y144-L386 HydrophobicContact CD1-CD2 4.16Å
145	T	88.4	Confident	88.8	Confident	28 Å²	28	46.2 Å²	46.2	17%	0.172	26%	0.26	C	S	.	.	H	α-helix	trans	-66.4	-44.7	178.3	-59.5	0	0	0	0	110.6	R141 T142 L143 S149	R141-T145 VanDerWaalsContact O-CB 3.25Å; R141-T145 WeakPolarHBondContact O-CB 3.39Å; R141-T145 PolarHBondContact O-N 3.25Å; R141-T145 PolarHBondContact O-OG1 3.27Å; T142-T145 PolarHBondContact O-N 3.41Å; L143-T145 VanDerWaalsContact C-N 3.29Å; L143-T145 PolarHBondContact O-N 3.47Å; T145-S149 VanDerWaalsContact O-CB 3.32Å; T145-S149 WeakPolarHBondContact O-CB 3.18Å; T145-S149 PolarHBondContact O-N 3.24Å; T145-S149 PolarHBondContact O-OG 2.97Å
146	V	91.1	Very high	89.5	Confident	87 Å²	87	41 Å²	41	53%	0.527	24%	0.236	S	C	.	.	H	α-helix	trans	-62.2	-46.1	173.1	171.7	0	0	0	0	110.6	T142 L143 S149 L150	T142-V146 HydrophobicContact CG2-CG2 4.48Å; T142-V146 VanDerWaalsContact O-CG2 3.32Å; T142-V146 WeakPolarHBondContact O-CG2 3.45Å; T142-V146 PolarHBondContact O-N 3.48Å; L143-V146 PolarHBondContact O-N 2.98Å; V146-S149 PolarHBondContact O-N 3.21Å; V146-L150 PolarHBondContact O-N 2.87Å
147	G	92.4	Very high	90	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-57.9	-51	177.8	0	0	0	0	0	112.9	L143 Y144 S149 L150 S151 S390	L143-G147 PolarHBondContact O-N 2.98Å; Y144-G147 PolarHBondContact O-N 3.36Å; G147-S149 VanDerWaalsContact C-N 3.35Å; G147-S149 PolarHBondContact O-N 3.36Å; G147-L150 PolarHBondContact O-N 3.41Å; G147-S151 VanDerWaalsContact O-CB 3.32Å; G147-S151 WeakPolarHBondContact O-CB 3.34Å; G147-S151 PolarHBondContact O-N 3.45Å; G147-S390 CarbonylContact C-O 3.56Å
148	Y	92.6	Very high	90.7	Very high	14 Å²	14	38.3 Å²	38.3	6%	0.055	22%	0.221	C	C	.	.	H	α-helix	trans	-64.9	-36.4	178	-78.9	-53.4	0	0	0	112.7	Y144 S151 L152 A187 V190 S389	Y144-Y148 AromaticContact CD2-CD2 3.97Å; Y144-Y148 HydrophobicContact CD2-CD2 3.97Å; Y144-Y148 HydrophobicContact CD2-CE2 4.18Å; Y144-Y148 WeakPolarHBondContact O-CB 3.36Å; Y144-Y148 WeakPolarHBondContact O-CD2 3.48Å; Y144-Y148 PolarHBondContact O-N 2.95Å; Y148-S151 PolarHBondContact O-N 2.8Å; Y148-L152 WeakPolarHBondContact O-CB 3.5Å; Y148-L152 PolarHBondContact O-N 3.22Å; Y148-A187 HydrophobicContact CD1-CB 3.8Å; Y148-A187 HydrophobicContact CG-CB 4.24Å; Y148-V190 HydrophobicContact CD2-CB 4.39Å; Y148-V190 HydrophobicContact CD2-CG1 4.04Å; Y148-V190 HydrophobicContact CD2-CG2 4.43Å; Y148-V190 HydrophobicContact CE2-CB 4.27Å; Y148-V190 HydrophobicContact CE2-CG1 3.89Å; Y148-V190 HydrophobicContact CE2-CG2 3.89Å; Y148-S389 PolarHBondContact OH-OG 2.95Å
149	S	92.1	Very high	91.2	Very high	42 Å²	42	35.5 Å²	35.5	29%	0.294	20%	0.204	S	C	.	.	H	α-helix	trans	-65.4	-42.9	177.4	-60.3	0	0	0	0	112.2	T145 V146 G147 L152 S153	T145-S149 VanDerWaalsContact O-CB 3.32Å; T145-S149 WeakPolarHBondContact O-CB 3.18Å; T145-S149 PolarHBondContact O-N 3.24Å; T145-S149 PolarHBondContact O-OG 2.97Å; V146-S149 PolarHBondContact O-N 3.21Å; G147-S149 VanDerWaalsContact C-N 3.35Å; G147-S149 PolarHBondContact O-N 3.36Å; S149-L152 PolarHBondContact O-N 2.94Å; S149-S153 PolarHBondContact O-N 2.75Å; S149-S153 VanDerWaalsContact O-N 3.11Å; S149-S153 PolarHBondContact O-OG 2.94Å
150	L	93.3	Very high	91.6	Very high	79 Å²	79	35.9 Å²	35.9	41%	0.414	20%	0.196	S	C	.	.	H	α-helix	trans	-66.7	-43.9	175	-179	60.9	0	0	0	111.5	V146 G147 L152 S153 T154 F391 L394	V146-L150 PolarHBondContact O-N 2.87Å; G147-L150 PolarHBondContact O-N 3.41Å; L150-L152 PolarHBondContact O-N 3.42Å; L150-S153 PolarHBondContact O-N 3.08Å; L150-T154 HydrophobicContact CD1-CG2 4.4Å; L150-T154 WeakPolarHBondContact O-CG2 3.49Å; L150-T154 PolarHBondContact O-N 3.41Å; L150-T154 VanDerWaalsContact O-N 3.09Å; L150-T154 PolarHBondContact O-OG1 2.81Å; L150-F391 HydrophobicContact CD2-CE1 4.08Å; L150-L394 HydrophobicContact CD2-CD2 3.74Å; L150-L394 HydrophobicContact CG-CD1 4.4Å; L150-L394 HydrophobicContact CG-CD2 4.18Å
151	S	94.9	Very high	91.8	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.014	20%	0.198	C	C	.	.	H	α-helix	trans	-59.7	-45.7	175	-177.7	0	0	0	0	111.5	G147 Y148 S153 T154 L155 G393 L394	G147-S151 VanDerWaalsContact O-CB 3.32Å; G147-S151 WeakPolarHBondContact O-CB 3.34Å; G147-S151 PolarHBondContact O-N 3.45Å; Y148-S151 PolarHBondContact O-N 2.8Å; S151-S153 PolarHBondContact O-N 3.22Å; S151-T154 PolarHBondContact O-N 3.25Å; S151-T154 PolarHBondContact O-OG1 3.31Å; S151-T154 VanDerWaalsContact O-OG1 3.05Å; S151-L155 VanDerWaalsContact O-CB 3.26Å; S151-L155 WeakPolarHBondContact O-CB 3.41Å; S151-L155 WeakPolarHBondContact O-CD1 3.48Å; S151-L155 VanDerWaalsContact O-CG 3.22Å; S151-L155 WeakPolarHBondContact O-CG 3.44Å; S151-L155 PolarHBondContact O-N 3.27Å; S151-L155 WeakPolarHBondContact OG-CD1 3.47Å; S151-G393 WeakPolarHBondContact OG-CA 3.42Å; S151-L394 PolarHBondContact OG-N 2.86Å; S151-L394 VanDerWaalsContact OG-N 3.13Å
152	L	94.6	Very high	92	Very high	9 Å²	9	34 Å²	34	5%	0.047	19%	0.192	C	C	.	.	H	α-helix	trans	-58.8	-49.5	179.3	-177.7	67.9	0	0	0	111.2	Y148 S149 L150 T154 L155 I156 I184 A187 V188	Y148-L152 WeakPolarHBondContact O-CB 3.5Å; Y148-L152 PolarHBondContact O-N 3.22Å; S149-L152 PolarHBondContact O-N 2.94Å; L150-L152 PolarHBondContact O-N 3.42Å; L152-T154 PolarHBondContact O-N 3.42Å; L152-L155 PolarHBondContact O-N 3.49Å; L152-I156 HydrophobicContact CD1-CD1 3.78Å; L152-I156 HydrophobicContact CD1-CG1 4.38Å; L152-I156 HydrophobicContact CG-CD1 3.84Å; L152-I156 WeakPolarHBondContact O-CB 3.35Å; L152-I156 VanDerWaalsContact O-CG1 3.27Å; L152-I156 WeakPolarHBondContact O-CG1 3.37Å; L152-I156 PolarHBondContact O-N 3.49Å; L152-I184 HydrophobicContact CD1-CB 4.23Å; L152-I184 HydrophobicContact CD1-CG1 4.25Å; L152-I184 HydrophobicContact CD1-CG2 3.78Å; L152-A187 HydrophobicContact CD1-CB 4.45Å; L152-V188 HydrophobicContact CD1-CG2 3.93Å; L152-V188 HydrophobicContact CD2-CG2 4.4Å
153	S	93.9	Very high	92.2	Very high	55 Å²	55	33.7 Å²	33.7	39%	0.385	19%	0.186	S	C	.	.	H	α-helix	trans	-59.6	-46.9	-180	-58.7	0	0	0	0	111.8	S149 L150 S151 M157	S149-S153 PolarHBondContact O-N 2.75Å; S149-S153 VanDerWaalsContact O-N 3.11Å; S149-S153 PolarHBondContact O-OG 2.94Å; L150-S153 PolarHBondContact O-N 3.08Å; S151-S153 PolarHBondContact O-N 3.22Å; S153-M157 WeakPolarHBondContact O-CG 3.48Å; S153-M157 PolarHBondContact O-N 3.31Å
154	T	94.4	Very high	92.1	Very high	27 Å²	27	34.5 Å²	34.5	17%	0.166	20%	0.195	C	C	.	.	H	α-helix	trans	-71.2	-36.5	-178.2	53	0	0	0	0	113.2	L150 S151 L152 A158 L394 Y402	L150-T154 HydrophobicContact CD1-CG2 4.4Å; L150-T154 WeakPolarHBondContact O-CG2 3.49Å; L150-T154 PolarHBondContact O-N 3.41Å; L150-T154 VanDerWaalsContact O-N 3.09Å; L150-T154 PolarHBondContact O-OG1 2.81Å; S151-T154 PolarHBondContact O-N 3.25Å; S151-T154 PolarHBondContact O-OG1 3.31Å; S151-T154 VanDerWaalsContact O-OG1 3.05Å; L152-T154 PolarHBondContact O-N 3.42Å; T154-A158 WeakPolarHBondContact O-CB 2.86Å; T154-A158 PolarHBondContact O-N 3.23Å; T154-L394 HydrophobicContact CG2-CD1 3.54Å; T154-L394 WeakPolarHBondContact OG1-CD1 3.46Å; T154-Y402 PolarHBondContact O-OH 3.12Å
155	L	95.4	Very high	92	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-69.3	-40.6	176.3	-77	165.1	0	0	0	112.8	S151 L152 M157 A158 L159 F180 F183 I184 G393 A397	S151-L155 VanDerWaalsContact O-CB 3.26Å; S151-L155 WeakPolarHBondContact O-CB 3.41Å; S151-L155 WeakPolarHBondContact O-CD1 3.48Å; S151-L155 VanDerWaalsContact O-CG 3.22Å; S151-L155 WeakPolarHBondContact O-CG 3.44Å; S151-L155 PolarHBondContact O-N 3.27Å; S151-L155 WeakPolarHBondContact OG-CD1 3.47Å; L152-L155 PolarHBondContact O-N 3.49Å; L155-M157 VanDerWaalsContact C-N 3.32Å; L155-M157 PolarHBondContact O-N 3.36Å; L155-A158 PolarHBondContact O-N 3.14Å; L155-L159 WeakPolarHBondContact O-CB 3.45Å; L155-L159 PolarHBondContact O-N 3.44Å; L155-F180 HydrophobicContact CD2-CB 3.97Å; L155-F180 HydrophobicContact CD2-CD1 3.69Å; L155-F180 HydrophobicContact CD2-CE1 4.47Å; L155-F180 HydrophobicContact CD2-CG 3.98Å; L155-F183 HydrophobicContact CD1-CB 3.43Å; L155-F183 VanDerWaalsContact CD1-CB 3.43Å; L155-F183 HydrophobicContact CD1-CG 4.24Å; L155-F183 HydrophobicContact CD2-CB 4.48Å; L155-I184 HydrophobicContact CB-CD1 4.11Å; L155-I184 HydrophobicContact CB-CG1 3.81Å; L155-I184 HydrophobicContact CD1-CG1 4.37Å; L155-G393 WeakPolarHBondContact CD2-O 3.43Å; L155-A397 HydrophobicContact CD2-CB 3.89Å; L155-A397 HydrophobicContact CG-CB 4.24Å
156	I	94.6	Very high	91.7	Very high	16 Å²	16	43.1 Å²	43.1	8%	0.082	23%	0.226	C	C	.	.	H	α-helix	trans	-62.9	-44.2	177.6	-73.2	171.5	0	0	0	110	L8 L12 L152 A158 L159 I160 I184	L8-I156 HydrophobicContact CD2-CD1 4.2Å; L8-I156 HydrophobicContact CD2-CG1 4.34Å; L12-I156 HydrophobicContact CD1-CD1 3.29Å; L152-I156 HydrophobicContact CD1-CD1 3.78Å; L152-I156 HydrophobicContact CD1-CG1 4.38Å; L152-I156 HydrophobicContact CG-CD1 3.84Å; L152-I156 WeakPolarHBondContact O-CB 3.35Å; L152-I156 VanDerWaalsContact O-CG1 3.27Å; L152-I156 WeakPolarHBondContact O-CG1 3.37Å; L152-I156 PolarHBondContact O-N 3.49Å; I156-A158 PolarHBondContact O-N 2.98Å; I156-L159 PolarHBondContact O-N 3.37Å; I156-I160 HydrophobicContact CG2-CD1 3.88Å; I156-I160 VanDerWaalsContact O-CG1 3.25Å; I156-I160 WeakPolarHBondContact O-CG1 3.44Å; I156-I160 PolarHBondContact O-N 2.78Å; I156-I184 HydrophobicContact CG1-CD1 3.72Å; I156-I184 HydrophobicContact CG1-CG1 4.06Å
157	M	93.3	Very high	91.3	Very high	103 Å²	103	45.5 Å²	45.5	51%	0.507	23%	0.229	S	C	.	.	H	α-helix	trans	-62	-42.5	174.8	-71.3	-57.3	-64.1	0	0	112	S153 L155 I160 I161 Y402	S153-M157 WeakPolarHBondContact O-CG 3.48Å; S153-M157 PolarHBondContact O-N 3.31Å; L155-M157 VanDerWaalsContact C-N 3.32Å; L155-M157 PolarHBondContact O-N 3.36Å; M157-I160 PolarHBondContact O-N 3.01Å; M157-I160 HydrophobicContact SD-CD1 4.41Å; M157-I161 VanDerWaalsContact O-CG1 3.3Å; M157-I161 WeakPolarHBondContact O-CG1 3.11Å; M157-I161 PolarHBondContact O-N 3.39Å; M157-Y402 WeakPolarHBondContact CB-OH 3.14Å
158	A	93.5	Very high	90.8	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.6	-43.5	176	0	0	0	0	0	112.3	T154 L155 I156 I160 I161 V162 F180 A397 C401 Y402	T154-A158 WeakPolarHBondContact O-CB 2.86Å; T154-A158 PolarHBondContact O-N 3.23Å; L155-A158 PolarHBondContact O-N 3.14Å; I156-A158 PolarHBondContact O-N 2.98Å; A158-I160 PolarHBondContact O-N 2.67Å; A158-I161 WeakPolarHBondContact O-CB 3.43Å; A158-I161 PolarHBondContact O-N 3.16Å; A158-V162 WeakPolarHBondContact O-CG2 3.44Å; A158-V162 PolarHBondContact O-N 3.1Å; A158-F180 HydrophobicContact CB-CD2 4.4Å; A158-F180 HydrophobicContact CB-CE2 4.18Å; A158-A397 HydrophobicContact CB-CB 4.22Å; A158-C401 HydrophobicContact CB-CB 3.72Å; A158-Y402 HydrophobicContact CB-CE2 4.3Å; A158-Y402 PolarHBondContact N-OH 3.13Å
159	L	93.5	Very high	90.4	Very high	16 Å²	16	48.3 Å²	48.3	8%	0.084	24%	0.243	C	C	.	.	H	α-helix	trans	-62.7	-43.1	177	-175	64.1	0	0	0	111.2	L155 I156 I161 V162 L163 A177 I184	L155-L159 WeakPolarHBondContact O-CB 3.45Å; L155-L159 PolarHBondContact O-N 3.44Å; I156-L159 PolarHBondContact O-N 3.37Å; L159-I161 VanDerWaalsContact C-N 3.33Å; L159-I161 PolarHBondContact O-N 3.27Å; L159-V162 PolarHBondContact O-N 3.02Å; L159-L163 HydrophobicContact CD1-CD1 3.87Å; L159-L163 HydrophobicContact CD1-CG 4.1Å; L159-L163 HydrophobicContact CG-CD1 3.81Å; L159-L163 HydrophobicContact CG-CG 4.37Å; L159-L163 WeakPolarHBondContact O-CB 3.43Å; L159-L163 VanDerWaalsContact O-CG 3.23Å; L159-L163 WeakPolarHBondContact O-CG 3.21Å; L159-L163 PolarHBondContact O-N 3.16Å; L159-A177 HydrophobicContact CD1-CB 3.88Å; L159-I184 HydrophobicContact CD2-CD1 3.91Å
160	I	91.6	Very high	90	Very high	46 Å²	46	49.3 Å²	49.3	24%	0.236	25%	0.249	C	C	.	.	H	α-helix	trans	-59.6	-44.1	175.1	-70.7	166.1	0	0	0	110.8	I156 M157 A158 S164	I156-I160 HydrophobicContact CG2-CD1 3.88Å; I156-I160 VanDerWaalsContact O-CG1 3.25Å; I156-I160 WeakPolarHBondContact O-CG1 3.44Å; I156-I160 PolarHBondContact O-N 2.78Å; M157-I160 PolarHBondContact O-N 3.01Å; M157-I160 HydrophobicContact SD-CD1 4.41Å; A158-I160 PolarHBondContact O-N 2.67Å; I160-S164 WeakPolarHBondContact O-CB 3.41Å; I160-S164 PolarHBondContact O-N 2.84Å; I160-S164 PolarHBondContact O-OG 2.86Å
161	I	90.6	Very high	89.5	Confident	22 Å²	22	48.8 Å²	48.8	11%	0.113	25%	0.249	C	C	.	.	H	α-helix	trans	-59	-56.5	177.9	-71.8	164.8	0	0	0	110.1	M157 A158 L159 L163 S164 F165 Y402 V407	M157-I161 VanDerWaalsContact O-CG1 3.3Å; M157-I161 WeakPolarHBondContact O-CG1 3.11Å; M157-I161 PolarHBondContact O-N 3.39Å; A158-I161 WeakPolarHBondContact O-CB 3.43Å; A158-I161 PolarHBondContact O-N 3.16Å; L159-I161 VanDerWaalsContact C-N 3.33Å; L159-I161 PolarHBondContact O-N 3.27Å; I161-L163 VanDerWaalsContact C-N 3.32Å; I161-L163 PolarHBondContact O-N 3.33Å; I161-S164 PolarHBondContact O-N 3.45Å; I161-S164 VanDerWaalsContact O-N 3.16Å; I161-F165 HydrophobicContact CG2-CD2 4.04Å; I161-F165 HydrophobicContact CG2-CE2 3.99Å; I161-F165 WeakPolarHBondContact O-CD2 3.33Å; I161-F165 PolarHBondContact O-N 2.87Å; I161-Y402 HydrophobicContact CD1-CD1 4.46Å; I161-Y402 HydrophobicContact CD1-CE1 3.76Å; I161-V407 HydrophobicContact CG2-CG1 3.61Å
162	V	88.7	Confident	88.9	Confident	11 Å²	11	52.7 Å²	52.7	7%	0.067	26%	0.263	C	S	.	.	H	α-helix	trans	-61	-39.5	-176.3	175	0	0	0	0	111.9	A158 L159 H169 N173 F180	A158-V162 WeakPolarHBondContact O-CG2 3.44Å; A158-V162 PolarHBondContact O-N 3.1Å; L159-V162 PolarHBondContact O-N 3.02Å; V162-H169 PolarHBondContact O-CD2 2.95Å; V162-H169 PolarHBondContact O-NE2 3.05Å; V162-N173 HydrophobicContact CG1-CB 4.1Å; V162-F180 HydrophobicContact CG2-CE2 4.35Å
163	L	88.6	Confident	88.6	Confident	75 Å²	75	52.6 Å²	52.6	39%	0.393	26%	0.263	S	S	.	.	H	α-helix	trans	-75.9	-25.6	179.4	-65.3	178.6	0	0	0	113.6	L159 I161 H169	L159-L163 HydrophobicContact CD1-CD1 3.87Å; L159-L163 HydrophobicContact CD1-CG 4.1Å; L159-L163 HydrophobicContact CG-CD1 3.81Å; L159-L163 HydrophobicContact CG-CG 4.37Å; L159-L163 WeakPolarHBondContact O-CB 3.43Å; L159-L163 VanDerWaalsContact O-CG 3.23Å; L159-L163 WeakPolarHBondContact O-CG 3.21Å; L159-L163 PolarHBondContact O-N 3.16Å; I161-L163 VanDerWaalsContact C-N 3.32Å; I161-L163 PolarHBondContact O-N 3.33Å; L163-H169 PolarHBondContact O-NE2 2.88Å
164	S	87.8	Confident	88.3	Confident	62 Å²	62	55.7 Å²	55.7	43%	0.434	27%	0.267	S	S	.	.	H	α-helix	trans	-76	-43.6	-177	-67.6	0	0	0	0	112.5	K1 I160 I161 R166	K1-S164 PolarHBondContact NZ-O 2.78Å; I160-S164 WeakPolarHBondContact O-CB 3.41Å; I160-S164 PolarHBondContact O-N 2.84Å; I160-S164 PolarHBondContact O-OG 2.86Å; I161-S164 PolarHBondContact O-N 3.45Å; I161-S164 VanDerWaalsContact O-N 3.16Å; S164-R166 PolarHBondContact O-N 2.81Å
165	F	86.8	Confident	88	Confident	34 Å²	34	54.9 Å²	54.9	15%	0.149	26%	0.262	C	S	.	.			trans	-85.8	104.5	-177.6	-62.4	-72.5	0	0	0	111.5	I161 K167 L168 H169 L411 K414	I161-F165 HydrophobicContact CG2-CD2 4.04Å; I161-F165 HydrophobicContact CG2-CE2 3.99Å; I161-F165 WeakPolarHBondContact O-CD2 3.33Å; I161-F165 PolarHBondContact O-N 2.87Å; F165-K167 PolarHBondContact O-N 3.4Å; F165-K167 VanDerWaalsContact O-N 3.12Å; F165-L168 HydrophobicContact CB-CB 4.39Å; F165-L168 HydrophobicContact CB-CD1 3.84Å; F165-L168 HydrophobicContact CB-CG 3.93Å; F165-L168 HydrophobicContact CD2-CD1 4.08Å; F165-L168 HydrophobicContact CG-CD1 4.32Å; F165-L168 WeakPolarHBondContact O-CB 3.39Å; F165-L168 PolarHBondContact O-N 3.33Å; F165-H169 PolarHBondContact O-CD2 2.7Å; F165-L411 HydrophobicContact CE2-CD2 4.08Å; F165-L411 HydrophobicContact CE2-CG 4.38Å; F165-L411 HydrophobicContact CZ-CD2 4.09Å; F165-K414 HydrophobicContact CE1-CB 3.93Å; F165-K414 HydrophobicContact CE1-CG 4.06Å; F165-K414 HydrophobicContact CZ-CB 4.37Å
166	R	82.9	Confident	87.7	Confident	206 Å²	206	55.6 Å²	55.6	78%	0.777	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-54.6	-32.1	177.1	-71.9	-174.6	178	164.7	-0.1	113.5	S164 L168 H169	S164-R166 PolarHBondContact O-N 2.81Å; R166-L168 PolarHBondContact O-N 3.14Å; R166-H169 WeakPolarHBondContact O-CB 3.46Å; R166-H169 PolarHBondContact O-N 3.28Å; R166-H169 VanDerWaalsContact O-N 3.08Å
167	K	81.9	Confident	87.6	Confident	137 Å²	137	55.2 Å²	55.2	60%	0.596	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-64.7	-18.5	177.4	-72.2	-165.6	175.8	-168.7	0	113.9	F165 E410	F165-K167 PolarHBondContact O-N 3.4Å; F165-K167 VanDerWaalsContact O-N 3.12Å; K167-E410 WeakPolarHBondContact CD-OE1 3.3Å; K167-E410 IonicContact NZ-OE1 2.88Å
168	L	82.9	Confident	87.6	Confident	4 Å²	4	52 Å²	52	2%	0.021	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-93.2	5.1	176.6	-59.9	178.4	0	0	0	112.1	F165 R166 C170 N173 E406 V407 E410	F165-L168 HydrophobicContact CB-CB 4.39Å; F165-L168 HydrophobicContact CB-CD1 3.84Å; F165-L168 HydrophobicContact CB-CG 3.93Å; F165-L168 HydrophobicContact CD2-CD1 4.08Å; F165-L168 HydrophobicContact CG-CD1 4.32Å; F165-L168 WeakPolarHBondContact O-CB 3.39Å; F165-L168 PolarHBondContact O-N 3.33Å; R166-L168 PolarHBondContact O-N 3.14Å; L168-C170 PolarHBondContact O-N 3.27Å; L168-N173 WeakPolarHBondContact O-CB 3.45Å; L168-N173 PolarHBondContact O-ND2 3.05Å; L168-E406 HydrophobicContact CD2-CB 4.44Å; L168-V407 HydrophobicContact CD1-CG1 4.4Å; L168-V407 HydrophobicContact CD1-CG2 4.01Å; L168-V407 HydrophobicContact CD2-CG2 4.35Å; L168-E410 HydrophobicContact CD2-CG 4.44Å
169	H	82.9	Confident	87.5	Confident	69 Å²	69	52 Å²	52	32%	0.319	25%	0.249	S	C	.	.			trans	-82.2	82.2	-179.3	-68.5	-173.2	0	0	0	110.8	V162 L163 F165 R166 Y174	V162-H169 PolarHBondContact O-CD2 2.95Å; V162-H169 PolarHBondContact O-NE2 3.05Å; L163-H169 PolarHBondContact O-NE2 2.88Å; F165-H169 PolarHBondContact O-CD2 2.7Å; R166-H169 WeakPolarHBondContact O-CB 3.46Å; R166-H169 PolarHBondContact O-N 3.28Å; R166-H169 VanDerWaalsContact O-N 3.08Å; H169-Y174 HydrophobicContact CB-CE2 4.28Å
170	C	83.9	Confident	87.6	Confident	62 Å²	62	51.3 Å²	51.3	42%	0.419	25%	0.246	S	C	.	.			trans	-120.7	157.5	174.7	-59.1	0	0	0	0	110	L168 R172 N173 Y174	L168-C170 PolarHBondContact O-N 3.27Å; C170-R172 VanDerWaalsContact C-N 3.26Å; C170-R172 PolarHBondContact O-N 2.99Å; C170-N173 PolarHBondContact O-N 2.8Å; C170-Y174 WeakPolarHBondContact O-CD2 3.06Å; C170-Y174 PolarHBondContact O-N 3.36Å
171	T	82.3	Confident	87.7	Confident	68 Å²	68	52.2 Å²	52.2	42%	0.417	25%	0.25	S	S	.	.	H	α-helix	trans	-51	-44	178	-49.4	0	0	0	0	112.5	N173 Y174 I175	T171-N173 PolarHBondContact O-N 3.01Å; T171-Y174 WeakPolarHBondContact O-CB 3.44Å; T171-Y174 PolarHBondContact O-N 3.24Å; T171-I175 PolarHBondContact O-N 2.79Å; T171-I175 VanDerWaalsContact O-N 3.09Å
172	R	83.6	Confident	88	Confident	84 Å²	84	51.2 Å²	51.2	32%	0.317	25%	0.245	S	C	.	.	H	α-helix	trans	-53.1	-50	173.2	179.2	-178.9	66.9	-173.7	-5	112.3	C170 Y174 I175 H176 Y247 E406	C170-R172 VanDerWaalsContact C-N 3.26Å; C170-R172 PolarHBondContact O-N 2.99Å; R172-Y174 VanDerWaalsContact C-N 3.3Å; R172-Y174 PolarHBondContact O-N 3.47Å; R172-I175 PolarHBondContact O-N 2.88Å; R172-H176 WeakPolarHBondContact CG-NE2 3.19Å; R172-H176 PolarHBondContact O-CD2 3.42Å; R172-H176 PolarHBondContact O-N 3.36Å; R172-Y247 HydrophobicContact CB-CE1 4.37Å; R172-Y247 HydrophobicContact CG-CE1 4.33Å; R172-E406 IonicContact CZ-OE1 2.98Å; R172-E406 IonicContact NH1-OE1 2.78Å; R172-E406 IonicContact NH2-OE1 2.69Å; R172-E406 PolarHBondContact NH2-OE1 3.38Å; R172-E406 IonicContact NH2-OE2 3.21Å; R172-E406 PolarHBondContact NH2-OE2 3.12Å
173	N	87.4	Confident	88.2	Confident	7 Å²	7	50.9 Å²	50.9	4%	0.037	24%	0.243	C	C	.	.	H	α-helix	trans	-74.3	-24.1	-175.5	-65.8	0.8	0	0	0	111.8	V162 L168 C170 T171 A177	V162-N173 HydrophobicContact CG1-CB 4.1Å; L168-N173 WeakPolarHBondContact O-CB 3.45Å; L168-N173 PolarHBondContact O-ND2 3.05Å; C170-N173 PolarHBondContact O-N 2.8Å; T171-N173 PolarHBondContact O-N 3.01Å; N173-A177 VanDerWaalsContact O-CB 3.24Å; N173-A177 WeakPolarHBondContact O-CB 3.11Å; N173-A177 PolarHBondContact O-N 3.02Å
174	Y	87.9	Confident	88.6	Confident	120 Å²	120	47.6 Å²	47.6	47%	0.471	23%	0.226	S	C	.	.	H	α-helix	trans	-67.7	-40.5	168.2	-84.1	-71.1	0	0	0	112.5	H169 C170 T171 R172 A177 N178	H169-Y174 HydrophobicContact CB-CE2 4.28Å; C170-Y174 WeakPolarHBondContact O-CD2 3.06Å; C170-Y174 PolarHBondContact O-N 3.36Å; T171-Y174 WeakPolarHBondContact O-CB 3.44Å; T171-Y174 PolarHBondContact O-N 3.24Å; R172-Y174 VanDerWaalsContact C-N 3.3Å; R172-Y174 PolarHBondContact O-N 3.47Å; Y174-A177 PolarHBondContact O-N 2.82Å; Y174-N178 PolarHBondContact O-N 3.19Å; Y174-N178 PolarHBondContact O-ND2 3.01Å
175	I	88.3	Confident	88.9	Confident	11 Å²	11	47.7 Å²	47.7	6%	0.056	22%	0.221	C	C	.	.	H	α-helix	trans	-63.5	-48.4	174.2	-65.1	170.3	0	0	0	109.6	T171 R172 A177 N178 L179 E244 Y247	T171-I175 PolarHBondContact O-N 2.79Å; T171-I175 VanDerWaalsContact O-N 3.09Å; R172-I175 PolarHBondContact O-N 2.88Å; I175-A177 VanDerWaalsContact C-N 3.31Å; I175-A177 PolarHBondContact O-N 3.35Å; I175-N178 PolarHBondContact O-N 3.24Å; I175-L179 PolarHBondContact O-N 3.17Å; I175-E244 HydrophobicContact CG2-CB 4.32Å; I175-Y247 HydrophobicContact CD1-CD1 4.04Å; I175-Y247 HydrophobicContact CD1-CD2 3.3Å; I175-Y247 HydrophobicContact CD1-CE1 4.41Å; I175-Y247 HydrophobicContact CD1-CE2 3.72Å; I175-Y247 HydrophobicContact CD1-CG 3.48Å; I175-Y247 VanDerWaalsContact CD1-CG 3.48Å
176	H	89.7	Confident	89.3	Confident	14 Å²	14	46.8 Å²	46.8	7%	0.065	22%	0.217	C	C	.	.	H	α-helix	trans	-60.2	-38.2	175.4	-61.3	-43.4	0	0	0	112.7	R172 L179 F180 E244 Y400	R172-H176 WeakPolarHBondContact CG-NE2 3.19Å; R172-H176 PolarHBondContact O-CD2 3.42Å; R172-H176 PolarHBondContact O-N 3.36Å; H176-L179 WeakPolarHBondContact O-CB 3.4Å; H176-L179 PolarHBondContact O-N 2.92Å; H176-F180 HydrophobicContact CB-CZ 4.32Å; H176-F180 WeakPolarHBondContact O-CD1 3.37Å; H176-F180 WeakPolarHBondContact O-CD2 3.04Å; H176-F180 WeakPolarHBondContact O-CG 3Å; H176-F180 PolarHBondContact O-N 3.33Å; H176-E244 IonicContact CE1-OE1 3.67Å; H176-E244 PolarHBondContact CE1-OE1 2.98Å; H176-E244 IonicContact ND1-OE1 3.4Å; H176-E244 PolarHBondContact ND1-OE1 3.03Å; H176-Y400 AromaticContact CE1-CD1 3.8Å; H176-Y400 AromaticContact CE1-CE1 3.71Å; H176-Y400 AromaticContact CE1-CZ 3.81Å; H176-Y400 AromaticContact ND1-CD2 3.77Å; H176-Y400 AromaticContact ND1-CE2 3.85Å; H176-Y400 AromaticContact ND1-CG 3.97Å
177	A	91.8	Very high	89.8	Confident	9 Å²	9	37 Å²	37	7%	0.074	18%	0.18	C	C	.	.	H	α-helix	trans	-65.1	-40.4	177	0	0	0	0	0	112.6	L159 N173 Y174 I175 F180 L181	L159-A177 HydrophobicContact CD1-CB 3.88Å; N173-A177 VanDerWaalsContact O-CB 3.24Å; N173-A177 WeakPolarHBondContact O-CB 3.11Å; N173-A177 PolarHBondContact O-N 3.02Å; Y174-A177 PolarHBondContact O-N 2.82Å; I175-A177 VanDerWaalsContact C-N 3.31Å; I175-A177 PolarHBondContact O-N 3.35Å; A177-F180 PolarHBondContact O-N 2.59Å; A177-L181 WeakPolarHBondContact O-CB 3.25Å; A177-L181 PolarHBondContact O-N 3.2Å
178	N	92.7	Very high	90.3	Very high	35 Å²	35	31.7 Å²	31.7	19%	0.187	16%	0.159	C	C	.	.	H	α-helix	trans	-68.7	-37.1	174.4	-80.3	-83.9	0	0	0	111.8	Y174 I175 L181 S182 W240 W271	Y174-N178 PolarHBondContact O-N 3.19Å; Y174-N178 PolarHBondContact O-ND2 3.01Å; I175-N178 PolarHBondContact O-N 3.24Å; N178-L181 WeakPolarHBondContact O-CB 3.35Å; N178-L181 PolarHBondContact O-N 3.19Å; N178-S182 PolarHBondContact O-N 3.49Å; N178-W240 HydrophobicContact CB-CD2 3.88Å; N178-W240 HydrophobicContact CB-CE3 3.69Å; N178-W240 HydrophobicContact CB-CH2 3.32Å; N178-W240 HydrophobicContact CB-CZ2 3.51Å; N178-W240 HydrophobicContact CB-CZ3 3.41Å; N178-W240 VanDerWaalsContact CB-CZ3 3.41Å; N178-W271 PolarHBondContact OD1-NE1 3.39Å
179	L	92.1	Very high	90.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.4	-47.5	171.6	-177.9	72.3	0	0	0	111.2	I175 H176 L181 S182 F183 W240 F241 E244 V396 Y400	I175-L179 PolarHBondContact O-N 3.17Å; H176-L179 WeakPolarHBondContact O-CB 3.4Å; H176-L179 PolarHBondContact O-N 2.92Å; L179-L181 VanDerWaalsContact C-N 3.3Å; L179-L181 PolarHBondContact O-N 2.97Å; L179-S182 PolarHBondContact O-N 3.04Å; L179-S182 VanDerWaalsContact O-N 3.16Å; L179-S182 PolarHBondContact O-OG 2.9Å; L179-F183 HydrophobicContact CD1-CD2 4.49Å; L179-F183 HydrophobicContact CD1-CE2 4.26Å; L179-F183 HydrophobicContact CG-CD2 4.29Å; L179-F183 HydrophobicContact CG-CE2 4.3Å; L179-F183 PolarHBondContact O-N 3.33Å; L179-F183 VanDerWaalsContact O-N 3.1Å; L179-W240 HydrophobicContact CD1-CB 3.85Å; L179-F241 HydrophobicContact CD1-CD1 4.06Å; L179-F241 HydrophobicContact CD1-CD2 4.45Å; L179-F241 HydrophobicContact CD1-CE1 4.19Å; L179-F241 HydrophobicContact CD1-CG 4.18Å; L179-F241 HydrophobicContact CD2-CE1 4.42Å; L179-E244 WeakPolarHBondContact CD2-OE2 3.43Å; L179-V396 HydrophobicContact CD2-CG1 3.96Å; L179-Y400 HydrophobicContact CD2-CD2 4.44Å; L179-Y400 HydrophobicContact CD2-CE2 4.11Å
180	F	94.7	Very high	91.1	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.009	15%	0.147	C	C	.	.	H	α-helix	trans	-58.9	-42.5	175	-61.2	-20.2	0	0	0	111.5	L155 A158 V162 H176 A177 S182 F183 I184 V396 Y400 C401	L155-F180 HydrophobicContact CD2-CB 3.97Å; L155-F180 HydrophobicContact CD2-CD1 3.69Å; L155-F180 HydrophobicContact CD2-CE1 4.47Å; L155-F180 HydrophobicContact CD2-CG 3.98Å; A158-F180 HydrophobicContact CB-CD2 4.4Å; A158-F180 HydrophobicContact CB-CE2 4.18Å; V162-F180 HydrophobicContact CG2-CE2 4.35Å; H176-F180 HydrophobicContact CB-CZ 4.32Å; H176-F180 WeakPolarHBondContact O-CD1 3.37Å; H176-F180 WeakPolarHBondContact O-CD2 3.04Å; H176-F180 WeakPolarHBondContact O-CG 3Å; H176-F180 PolarHBondContact O-N 3.33Å; A177-F180 PolarHBondContact O-N 2.59Å; F180-S182 VanDerWaalsContact C-N 3.34Å; F180-S182 PolarHBondContact O-N 3.41Å; F180-F183 PolarHBondContact O-N 3.27Å; F180-I184 WeakPolarHBondContact O-CG1 3.39Å; F180-I184 PolarHBondContact O-N 3.49Å; F180-V396 HydrophobicContact CD1-CG1 3.99Å; F180-V396 HydrophobicContact CE1-CG1 3.74Å; F180-Y400 HydrophobicContact CE1-CD2 4.35Å; F180-C401 HydrophobicContact CE2-CB 4.36Å; F180-C401 HydrophobicContact CZ-CB 4.25Å
181	L	95.1	Very high	91.3	Very high	64 Å²	64	26.9 Å²	26.9	34%	0.335	13%	0.132	S	C	.	.	H	α-helix	trans	-61.9	-41.3	176.2	-176.8	60.5	0	0	0	111.8	A177 N178 L179 F183 I184 L185 W271	A177-L181 WeakPolarHBondContact O-CB 3.25Å; A177-L181 PolarHBondContact O-N 3.2Å; N178-L181 WeakPolarHBondContact O-CB 3.35Å; N178-L181 PolarHBondContact O-N 3.19Å; L179-L181 VanDerWaalsContact C-N 3.3Å; L179-L181 PolarHBondContact O-N 2.97Å; L181-F183 VanDerWaalsContact C-N 3.31Å; L181-F183 PolarHBondContact O-N 2.95Å; L181-I184 PolarHBondContact O-N 3.4Å; L181-L185 HydrophobicContact CD1-CG 4.39Å; L181-L185 HydrophobicContact CG-CD1 4.34Å; L181-L185 WeakPolarHBondContact O-CG 3.43Å; L181-L185 PolarHBondContact O-N 3.23Å; L181-W271 HydrophobicContact CD2-CH2 4.49Å; L181-W271 HydrophobicContact CD2-CZ2 4.02Å; L181-W271 HydrophobicContact CG-CH2 4.3Å; L181-W271 HydrophobicContact CG-CZ2 4.23Å
182	S	95.4	Very high	91.5	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.007	13%	0.128	C	C	.	.	H	α-helix	trans	-61.4	-38.6	176.3	81	0	0	0	0	112.3	N178 L179 F180 L185 R186 N237	N178-S182 PolarHBondContact O-N 3.49Å; L179-S182 PolarHBondContact O-N 3.04Å; L179-S182 VanDerWaalsContact O-N 3.16Å; L179-S182 PolarHBondContact O-OG 2.9Å; F180-S182 VanDerWaalsContact C-N 3.34Å; F180-S182 PolarHBondContact O-N 3.41Å; S182-L185 PolarHBondContact O-N 3.28Å; S182-R186 WeakPolarHBondContact O-CB 3.46Å; S182-R186 PolarHBondContact O-N 3.48Å; S182-N237 PolarHBondContact OG-ND2 3.21Å
183	F	94.4	Very high	91.7	Very high	4 Å²	4	23.9 Å²	23.9	2%	0.018	12%	0.12	C	C	.	.	H	α-helix	trans	-68.6	-41.2	175	-90.9	-69.9	0	0	0	113	L155 L179 F180 L181 L185 R186 A187 N237 F241 Q392 V396	L155-F183 HydrophobicContact CD1-CB 3.43Å; L155-F183 VanDerWaalsContact CD1-CB 3.43Å; L155-F183 HydrophobicContact CD1-CG 4.24Å; L155-F183 HydrophobicContact CD2-CB 4.48Å; L179-F183 HydrophobicContact CD1-CD2 4.49Å; L179-F183 HydrophobicContact CD1-CE2 4.26Å; L179-F183 HydrophobicContact CG-CD2 4.29Å; L179-F183 HydrophobicContact CG-CE2 4.3Å; L179-F183 PolarHBondContact O-N 3.33Å; L179-F183 VanDerWaalsContact O-N 3.1Å; F180-F183 PolarHBondContact O-N 3.27Å; L181-F183 VanDerWaalsContact C-N 3.31Å; L181-F183 PolarHBondContact O-N 2.95Å; F183-L185 VanDerWaalsContact C-N 3.33Å; F183-R186 PolarHBondContact O-N 3.26Å; F183-A187 WeakPolarHBondContact O-CB 3.26Å; F183-A187 PolarHBondContact O-N 2.89Å; F183-N237 WeakPolarHBondContact CD2-ND2 3.4Å; F183-N237 WeakPolarHBondContact CG-ND2 3.47Å; F183-F241 HydrophobicContact CE1-CE2 4.25Å; F183-F241 HydrophobicContact CE2-CE1 4.24Å; F183-F241 AromaticContact CE2-CE2 3.56Å; F183-F241 HydrophobicContact CE2-CE2 3.56Å; F183-F241 AromaticContact CE2-CZ 3.36Å; F183-F241 HydrophobicContact CE2-CZ 3.36Å; F183-F241 HydrophobicContact CZ-CD2 4.48Å; F183-F241 HydrophobicContact CZ-CE1 4.46Å; F183-F241 AromaticContact CZ-CE2 3.24Å; F183-F241 HydrophobicContact CZ-CE2 3.24Å; F183-F241 AromaticContact CZ-CZ 3.25Å; F183-F241 HydrophobicContact CZ-CZ 3.25Å; F183-Q392 HydrophobicContact CE1-CB 4.05Å; F183-Q392 HydrophobicContact CE1-CG 4.14Å; F183-Q392 HydrophobicContact CZ-CB 4.22Å; F183-Q392 HydrophobicContact CZ-CG 3.82Å; F183-V396 HydrophobicContact CE2-CB 4.37Å; F183-V396 HydrophobicContact CE2-CG1 4.26Å; F183-V396 HydrophobicContact CE2-CG2 3.94Å; F183-V396 HydrophobicContact CZ-CG2 4.21Å
184	I	95.4	Very high	91.5	Very high	7 Å²	7	24.2 Å²	24.2	4%	0.036	12%	0.122	C	C	.	.	H	α-helix	trans	-58.7	-48.8	174.6	-71.4	164.4	0	0	0	109.4	L152 L155 I156 L159 F180 L181 R186 A187 V188	L152-I184 HydrophobicContact CD1-CB 4.23Å; L152-I184 HydrophobicContact CD1-CG1 4.25Å; L152-I184 HydrophobicContact CD1-CG2 3.78Å; L155-I184 HydrophobicContact CB-CD1 4.11Å; L155-I184 HydrophobicContact CB-CG1 3.81Å; L155-I184 HydrophobicContact CD1-CG1 4.37Å; I156-I184 HydrophobicContact CG1-CD1 3.72Å; I156-I184 HydrophobicContact CG1-CG1 4.06Å; L159-I184 HydrophobicContact CD2-CD1 3.91Å; F180-I184 WeakPolarHBondContact O-CG1 3.39Å; F180-I184 PolarHBondContact O-N 3.49Å; L181-I184 PolarHBondContact O-N 3.4Å; I184-R186 PolarHBondContact O-N 3.41Å; I184-A187 PolarHBondContact O-N 3.32Å; I184-V188 HydrophobicContact CG2-CG2 4.48Å; I184-V188 WeakPolarHBondContact O-CB 3.35Å; I184-V188 VanDerWaalsContact O-CG2 3.27Å; I184-V188 WeakPolarHBondContact O-CG2 3.15Å; I184-V188 PolarHBondContact O-N 3.44Å
185	L	94.8	Very high	91.1	Very high	63 Å²	63	19.6 Å²	19.6	33%	0.33	11%	0.107	S	C	.	.	H	α-helix	trans	-64.6	-39.1	178.8	-69	178.6	0	0	0	112.5	L181 S182 F183 A189 C233 W271	L181-L185 HydrophobicContact CD1-CG 4.39Å; L181-L185 HydrophobicContact CG-CD1 4.34Å; L181-L185 WeakPolarHBondContact O-CG 3.43Å; L181-L185 PolarHBondContact O-N 3.23Å; S182-L185 PolarHBondContact O-N 3.28Å; F183-L185 VanDerWaalsContact C-N 3.33Å; L185-A189 WeakPolarHBondContact O-CB 3.16Å; L185-A189 PolarHBondContact O-N 2.91Å; L185-C233 HydrophobicContact CB-CB 4.44Å; L185-W271 HydrophobicContact CD1-CH2 3.61Å; L185-W271 HydrophobicContact CD1-CZ3 3.75Å
186	R	94.3	Very high	90.6	Very high	16 Å²	16	21.9 Å²	21.9	6%	0.06	12%	0.119	C	C	.	.	H	α-helix	trans	-59.4	-52.6	173	-179.1	179.2	178.2	167	4.9	111	S182 F183 I184 V188 A189 V190 V234 N237 E362 S389	S182-R186 WeakPolarHBondContact O-CB 3.46Å; S182-R186 PolarHBondContact O-N 3.48Å; F183-R186 PolarHBondContact O-N 3.26Å; I184-R186 PolarHBondContact O-N 3.41Å; R186-V188 PolarHBondContact O-N 2.96Å; R186-A189 PolarHBondContact O-N 2.98Å; R186-V190 WeakPolarHBondContact O-CG2 3.37Å; R186-V190 PolarHBondContact O-N 2.84Å; R186-V234 HydrophobicContact CG-CG2 4.19Å; R186-N237 HydrophobicContact CB-CB 4.43Å; R186-N237 WeakPolarHBondContact CD-OD1 3.33Å; R186-N237 PolarHBondContact NH1-OD1 3.48Å; R186-E362 IonicContact NH1-OE1 3.91Å; R186-E362 IonicContact NH2-OE1 3.75Å; R186-E362 PolarHBondContact NH2-OE1 3.16Å; R186-S389 PolarHBondContact NH2-OG 2.98Å
187	A	93.4	Very high	89.7	Confident	1 Å²	1	23.1 Å²	23.1	1%	0.008	13%	0.125	C	C	.	.	H	α-helix	trans	-60.3	-45.9	-179.4	0	0	0	0	0	112	Y148 L152 F183 I184 A189 V190 I191	Y148-A187 HydrophobicContact CD1-CB 3.8Å; Y148-A187 HydrophobicContact CG-CB 4.24Å; L152-A187 HydrophobicContact CD1-CB 4.45Å; F183-A187 WeakPolarHBondContact O-CB 3.26Å; F183-A187 PolarHBondContact O-N 2.89Å; I184-A187 PolarHBondContact O-N 3.32Å; A187-A189 PolarHBondContact O-N 3.41Å; A187-V190 PolarHBondContact O-N 2.94Å; A187-I191 WeakPolarHBondContact O-CD1 3.23Å; A187-I191 VanDerWaalsContact O-CG1 3.31Å; A187-I191 WeakPolarHBondContact O-CG1 3.33Å; A187-I191 PolarHBondContact O-N 2.66Å; A187-I191 VanDerWaalsContact O-N 3.13Å
188	V	92.7	Very high	88.7	Confident	25 Å²	25	23.5 Å²	23.5	15%	0.152	13%	0.126	C	C	.	.	H	α-helix	trans	-62.1	-44.3	176.8	172.2	0	0	0	0	110.9	I15 L152 I184 R186 V190 I191 V192	I15-V188 HydrophobicContact CD1-CG1 4.23Å; I15-V188 HydrophobicContact CD1-CG2 4.14Å; L152-V188 HydrophobicContact CD1-CG2 3.93Å; L152-V188 HydrophobicContact CD2-CG2 4.4Å; I184-V188 HydrophobicContact CG2-CG2 4.48Å; I184-V188 WeakPolarHBondContact O-CB 3.35Å; I184-V188 VanDerWaalsContact O-CG2 3.27Å; I184-V188 WeakPolarHBondContact O-CG2 3.15Å; I184-V188 PolarHBondContact O-N 3.44Å; R186-V188 PolarHBondContact O-N 2.96Å; V188-V190 PolarHBondContact O-N 3.43Å; V188-I191 PolarHBondContact O-N 3.34Å; V188-V192 HydrophobicContact CG1-CG2 4.09Å; V188-V192 WeakPolarHBondContact O-CB 3.41Å; V188-V192 VanDerWaalsContact O-CG2 3.24Å; V188-V192 WeakPolarHBondContact O-CG2 3.43Å; V188-V192 PolarHBondContact O-N 2.73Å
189	A	92.1	Very high	87.4	Confident	6 Å²	6	27.7 Å²	27.7	5%	0.05	14%	0.139	C	C	.	.	H	α-helix	trans	-67.2	-36.1	-178.9	0	0	0	0	0	112.9	L185 R186 A187 K193 M229 M230 C233	L185-A189 WeakPolarHBondContact O-CB 3.16Å; L185-A189 PolarHBondContact O-N 2.91Å; R186-A189 PolarHBondContact O-N 2.98Å; A187-A189 PolarHBondContact O-N 3.41Å; A189-K193 VanDerWaalsContact O-CB 3.25Å; A189-K193 WeakPolarHBondContact O-CB 3.32Å; A189-K193 PolarHBondContact O-N 2.65Å; A189-M229 HydrophobicContact CB-CG 4.29Å; A189-M230 HydrophobicContact CB-CB 4.25Å; A189-M230 HydrophobicContact CB-SD 4.1Å; A189-C233 HydrophobicContact CB-CB 3.88Å
190	V	90.3	Very high	86	Confident	8 Å²	8	29.2 Å²	29.2	5%	0.048	15%	0.146	C	C	.	.	H	α-helix	trans	-58.2	-54.4	171.5	177	0	0	0	0	109.8	Y144 Y148 R186 A187 V188 V192 K193 D194 M230	Y144-V190 HydrophobicContact CD2-CG1 4.41Å; Y144-V190 HydrophobicContact CE2-CG1 4.16Å; Y148-V190 HydrophobicContact CD2-CB 4.39Å; Y148-V190 HydrophobicContact CD2-CG1 4.04Å; Y148-V190 HydrophobicContact CD2-CG2 4.43Å; Y148-V190 HydrophobicContact CE2-CB 4.27Å; Y148-V190 HydrophobicContact CE2-CG1 3.89Å; Y148-V190 HydrophobicContact CE2-CG2 3.89Å; R186-V190 WeakPolarHBondContact O-CG2 3.37Å; R186-V190 PolarHBondContact O-N 2.84Å; A187-V190 PolarHBondContact O-N 2.94Å; V188-V190 PolarHBondContact O-N 3.43Å; V190-V192 VanDerWaalsContact C-N 3.35Å; V190-V192 PolarHBondContact O-N 3.35Å; V190-K193 PolarHBondContact O-N 3.48Å; V190-D194 WeakPolarHBondContact CG1-OD2 3.34Å; V190-D194 WeakPolarHBondContact O-CB 3.42Å; V190-D194 PolarHBondContact O-N 3.34Å; V190-M230 HydrophobicContact CB-CE 4.19Å; V190-M230 HydrophobicContact CB-SD 4.2Å; V190-M230 HydrophobicContact CG2-CE 3.19Å; V190-M230 HydrophobicContact CG2-SD 3.51Å; V190-M230 VanDerWaalsContact CG2-SD 3.51Å
191	I	88.8	Confident	84.3	Confident	19 Å²	19	29.8 Å²	29.8	10%	0.097	15%	0.15	C	C	.	.	H	α-helix	trans	-63.4	-40.8	-176.4	-66.1	165.8	0	0	0	111.1	I15 A187 V188 D194 S195	I15-I191 HydrophobicContact CG2-CG2 4Å; A187-I191 WeakPolarHBondContact O-CD1 3.23Å; A187-I191 VanDerWaalsContact O-CG1 3.31Å; A187-I191 WeakPolarHBondContact O-CG1 3.33Å; A187-I191 PolarHBondContact O-N 2.66Å; A187-I191 VanDerWaalsContact O-N 3.13Å; V188-I191 PolarHBondContact O-N 3.34Å; I191-D194 PolarHBondContact O-N 2.82Å; I191-S195 WeakPolarHBondContact O-CB 3.37Å; I191-S195 PolarHBondContact O-N 2.9Å; I191-S195 PolarHBondContact O-OG 2.9Å
192	V	87.3	Confident	82.2	Confident	56 Å²	56	28.2 Å²	28.2	34%	0.339	15%	0.148	S	C	.	.	H	α-helix	trans	-65.4	-45.3	176.3	170.9	0	0	0	0	110.6	V188 V190 D194 S195 M196 A226	V188-V192 HydrophobicContact CG1-CG2 4.09Å; V188-V192 WeakPolarHBondContact O-CB 3.41Å; V188-V192 VanDerWaalsContact O-CG2 3.24Å; V188-V192 WeakPolarHBondContact O-CG2 3.43Å; V188-V192 PolarHBondContact O-N 2.73Å; V190-V192 VanDerWaalsContact C-N 3.35Å; V190-V192 PolarHBondContact O-N 3.35Å; V192-D194 VanDerWaalsContact C-N 3.33Å; V192-D194 PolarHBondContact O-N 3.49Å; V192-S195 WeakPolarHBondContact CA-OG 3.33Å; V192-S195 PolarHBondContact O-N 2.97Å; V192-S195 PolarHBondContact O-OG 2.91Å; V192-M196 HydrophobicContact CG1-CG 4.23Å; V192-M196 WeakPolarHBondContact O-CB 3.49Å; V192-M196 VanDerWaalsContact O-CG 3.23Å; V192-M196 WeakPolarHBondContact O-CG 3.35Å; V192-M196 PolarHBondContact O-N 3.26Å; V192-A226 HydrophobicContact CG1-CB 4.18Å
193	K	86.7	Confident	79.9	Confident	34 Å²	34	34.1 Å²	34.1	15%	0.148	17%	0.171	C	C	.	.	H	α-helix	trans	-59.3	-44.8	175.5	-179.3	-141.6	65.9	74.3	0	111.3	A189 V190 M196 L197 M230	A189-K193 VanDerWaalsContact O-CB 3.25Å; A189-K193 WeakPolarHBondContact O-CB 3.32Å; A189-K193 PolarHBondContact O-N 2.65Å; V190-K193 PolarHBondContact O-N 3.48Å; K193-M196 PolarHBondContact O-N 3.2Å; K193-L197 VanDerWaalsContact O-CB 3.27Å; K193-L197 WeakPolarHBondContact O-CB 3.06Å; K193-L197 PolarHBondContact O-N 3.48Å; K193-M230 HydrophobicContact CB-CB 4.3Å; K193-M230 HydrophobicContact CD-CB 4.49Å; K193-M230 HydrophobicContact CD-CG 4.19Å
194	D	83.1	Confident	77.6	Confident	14 Å²	14	35.6 Å²	35.6	8%	0.075	18%	0.177	C	C	.	.	H	α-helix	trans	-65.3	-43.6	179.6	-74.2	-28.8	0	0	0	112.5	R141 Y144 V190 I191 V192 L197 D198	R141-D194 PolarHBondContact NH2-O 3.01Å; Y144-D194 VanDerWaalsContact CE2-OD2 3.23Å; Y144-D194 WeakPolarHBondContact CE2-OD2 3.47Å; Y144-D194 PolarHBondContact OH-OD2 3.25Å; Y144-D194 VanDerWaalsContact OH-OD2 3.05Å; V190-D194 WeakPolarHBondContact CG1-OD2 3.34Å; V190-D194 WeakPolarHBondContact O-CB 3.42Å; V190-D194 PolarHBondContact O-N 3.34Å; I191-D194 PolarHBondContact O-N 2.82Å; V192-D194 VanDerWaalsContact C-N 3.33Å; V192-D194 PolarHBondContact O-N 3.49Å; D194-L197 PolarHBondContact O-N 3.45Å; D194-D198 PolarHBondContact O-N 2.93Å
195	S	80.3	Confident	75.3	Confident	23 Å²	23	39.4 Å²	39.4	16%	0.161	20%	0.197	C	C	.	.	H	α-helix	trans	-68.2	-37.8	176.3	58.3	0	0	0	0	112.5	I191 V192 D198 R199	I191-S195 WeakPolarHBondContact O-CB 3.37Å; I191-S195 PolarHBondContact O-N 2.9Å; I191-S195 PolarHBondContact O-OG 2.9Å; V192-S195 WeakPolarHBondContact CA-OG 3.33Å; V192-S195 PolarHBondContact O-N 2.97Å; V192-S195 PolarHBondContact O-OG 2.91Å; S195-D198 PolarHBondContact O-N 2.88Å; S195-R199 WeakPolarHBondContact O-CB 3.48Å; S195-R199 WeakPolarHBondContact O-CG 3.48Å; S195-R199 PolarHBondContact O-N 3.28Å
196	M	77.6	Confident	72.9	Confident	59 Å²	59	42.2 Å²	42.2	29%	0.291	22%	0.216	S	C	.	.	H	α-helix	trans	-67.1	-38.2	174.6	-69.9	-57.6	106.8	0	0	111.9	V192 K193 R199 H200 A226	V192-M196 HydrophobicContact CG1-CG 4.23Å; V192-M196 WeakPolarHBondContact O-CB 3.49Å; V192-M196 VanDerWaalsContact O-CG 3.23Å; V192-M196 WeakPolarHBondContact O-CG 3.35Å; V192-M196 PolarHBondContact O-N 3.26Å; K193-M196 PolarHBondContact O-N 3.2Å; M196-R199 PolarHBondContact O-N 2.83Å; M196-H200 WeakPolarHBondContact O-CB 3.41Å; M196-H200 PolarHBondContact O-N 3.28Å; M196-A226 HydrophobicContact CB-CB 4.28Å; M196-A226 HydrophobicContact CG-CB 4.05Å
197	L	71.9	Confident	70.5	Confident	40 Å²	40	47.5 Å²	47.5	21%	0.209	24%	0.236	C	C	.	.	H	α-helix	trans	-64.3	-45.7	175.8	-171.6	66.1	0	0	0	110.8	K193 D194 H200 L201 A295	K193-L197 VanDerWaalsContact O-CB 3.27Å; K193-L197 WeakPolarHBondContact O-CB 3.06Å; K193-L197 PolarHBondContact O-N 3.48Å; D194-L197 PolarHBondContact O-N 3.45Å; L197-H200 PolarHBondContact O-N 3.42Å; L197-L201 HydrophobicContact CG-CD1 4Å; L197-L201 WeakPolarHBondContact O-CB 3.13Å; L197-L201 WeakPolarHBondContact O-CD1 3.37Å; L197-L201 WeakPolarHBondContact O-CG 3.41Å; L197-L201 PolarHBondContact O-N 3.29Å; L197-A295 HydrophobicContact CD1-CB 4.44Å
198	D	69.4	Low	68.3	Low	16 Å²	16	50.8 Å²	50.8	9%	0.086	25%	0.251	C	S	.	.	H	α-helix	trans	-65.2	-40.4	176.2	-78.2	5.2	0	0	0	113	R141 D194 S195 H200 L201 G202	R141-D198 IonicContact CZ-OD1 3.96Å; R141-D198 VanDerWaalsContact CZ-OD1 3.29Å; R141-D198 IonicContact CZ-OD2 3.25Å; R141-D198 IonicContact NH1-OD1 3.35Å; R141-D198 PolarHBondContact NH1-OD1 3.36Å; R141-D198 IonicContact NH1-OD2 3.15Å; R141-D198 PolarHBondContact NH1-OD2 3.04Å; R141-D198 IonicContact NH2-OD1 2.71Å; R141-D198 PolarHBondContact NH2-OD1 3.17Å; R141-D198 IonicContact NH2-OD2 3.26Å; R141-D198 PolarHBondContact NH2-OD2 3.44Å; D194-D198 PolarHBondContact O-N 2.93Å; S195-D198 PolarHBondContact O-N 2.88Å; D198-H200 VanDerWaalsContact C-N 3.31Å; D198-H200 PolarHBondContact O-N 2.99Å; D198-L201 PolarHBondContact O-N 3.3Å; D198-G202 PolarHBondContact O-N 3.34Å
199	R	66	Low	66	Low	124 Å²	124	53.8 Å²	53.8	47%	0.468	28%	0.279	S	S	.	.	H	α-helix	trans	-68	-33.4	178.4	-73.3	178.6	78.9	102.4	13.3	111.9	S195 M196 R203	S195-R199 WeakPolarHBondContact O-CB 3.48Å; S195-R199 WeakPolarHBondContact O-CG 3.48Å; S195-R199 PolarHBondContact O-N 3.28Å; M196-R199 PolarHBondContact O-N 2.83Å; R199-R203 WeakPolarHBondContact O-CB 3.22Å; R199-R203 PolarHBondContact O-N 3.01Å; R199-R203 VanDerWaalsContact O-N 3.07Å
200	H	62.2	Low	63.6	Low	31 Å²	31	60.1 Å²	60.1	14%	0.144	31%	0.312	C	S	.	.	H	α-helix	trans	-62.4	-55	171.2	-177	13.4	0	0	0	109.6	M196 L197 D198 G202 R203 E204	M196-H200 WeakPolarHBondContact O-CB 3.41Å; M196-H200 PolarHBondContact O-N 3.28Å; L197-H200 PolarHBondContact O-N 3.42Å; D198-H200 VanDerWaalsContact C-N 3.31Å; D198-H200 PolarHBondContact O-N 2.99Å; H200-G202 PolarHBondContact O-N 3.32Å; H200-R203 PolarHBondContact O-N 2.89Å; H200-E204 IonicContact CE1-OE1 2.97Å; H200-E204 PolarHBondContact CE1-OE1 2.95Å; H200-E204 VanDerWaalsContact CE1-OE1 3.27Å; H200-E204 IonicContact CE1-OE2 3.49Å; H200-E204 PolarHBondContact CE1-OE2 3.45Å; H200-E204 IonicContact ND1-OE1 2.86Å; H200-E204 IonicContact ND1-OE2 2.94Å; H200-E204 PolarHBondContact ND1-OE2 3.48Å; H200-E204 PolarHBondContact O-N 3.42Å
201	L	59.5	Low	61.5	Low	15 Å²	15	64 Å²	64	8%	0.079	34%	0.336	C	S	.	.	H	α-helix	trans	-59.9	-42.2	-179.2	-68.6	165.3	0	0	0	112.9	K25 E28 L197 D198 I205	K25-L201 HydrophobicContact CB-CD2 4.16Å; K25-L201 HydrophobicContact CG-CD2 4.32Å; E28-L201 WeakPolarHBondContact OE2-CD2 3.41Å; L197-L201 HydrophobicContact CG-CD1 4Å; L197-L201 WeakPolarHBondContact O-CB 3.13Å; L197-L201 WeakPolarHBondContact O-CD1 3.37Å; L197-L201 WeakPolarHBondContact O-CG 3.41Å; L197-L201 PolarHBondContact O-N 3.29Å; D198-L201 PolarHBondContact O-N 3.3Å; L201-I205 WeakPolarHBondContact O-CG1 3.44Å; L201-I205 PolarHBondContact O-N 2.96Å
202	G	50.4	Low	59.2	Low	30 Å²	30	69.6 Å²	69.6	31%	0.309	37%	0.371	S	S	.	.	H	α-helix	trans	-76.7	-27.6	-179.5	0	0	0	0	0	114	D198 H200 I205 V206	D198-G202 PolarHBondContact O-N 3.34Å; H200-G202 PolarHBondContact O-N 3.32Å; G202-I205 PolarHBondContact O-N 3.44Å; G202-V206 WeakPolarHBondContact O-CG2 3.27Å; G202-V206 PolarHBondContact O-N 3.45Å
203	R	47.1	Very low	56.8	Low	126 Å²	126	73.5 Å²	73.5	48%	0.475	39%	0.385	S	S	.	.	H	α-helix	trans	-76.4	-31.5	177.7	-164.5	-175.9	-144.1	92.3	-0	111.8	R199 H200 R207	R199-R203 WeakPolarHBondContact O-CB 3.22Å; R199-R203 PolarHBondContact O-N 3.01Å; R199-R203 VanDerWaalsContact O-N 3.07Å; H200-R203 PolarHBondContact O-N 2.89Å; R203-R207 WeakPolarHBondContact O-CB 3.47Å; R203-R207 PolarHBondContact O-N 3.31Å; R203-R207 VanDerWaalsContact O-N 3.14Å
204	E	45.8	Very low	54.5	Low	34 Å²	34	80.2 Å²	80.2	16%	0.159	42%	0.419	C	S	.	.	H	α-helix	trans	-59.7	-51.7	167.1	-94.2	139.5	-178.5	0	0	110.3	H200 V206 R207 H208	H200-E204 IonicContact CE1-OE1 2.97Å; H200-E204 PolarHBondContact CE1-OE1 2.95Å; H200-E204 VanDerWaalsContact CE1-OE1 3.27Å; H200-E204 IonicContact CE1-OE2 3.49Å; H200-E204 PolarHBondContact CE1-OE2 3.45Å; H200-E204 IonicContact ND1-OE1 2.86Å; H200-E204 IonicContact ND1-OE2 2.94Å; H200-E204 PolarHBondContact ND1-OE2 3.48Å; H200-E204 PolarHBondContact O-N 3.42Å; E204-V206 VanDerWaalsContact C-N 3.31Å; E204-V206 PolarHBondContact O-N 2.97Å; E204-V206 VanDerWaalsContact O-N 3.17Å; E204-R207 PolarHBondContact O-N 3.37Å; E204-H208 PolarHBondContact O-CD2 3.2Å; E204-H208 PolarHBondContact O-NE2 2.93Å
205	I	47.6	Very low	52.7	Low	87 Å²	87	86 Å²	86	45%	0.446	45%	0.45	S	S	.	.	H	α-helix	trans	-55.2	-40.2	-179.6	-62.2	166.6	0	0	0	113.1	L27 L201 G202	L27-I205 HydrophobicContact CD2-CD1 4.27Å; L27-I205 HydrophobicContact CD2-CG1 4.35Å; L201-I205 WeakPolarHBondContact O-CG1 3.44Å; L201-I205 PolarHBondContact O-N 2.96Å; G202-I205 PolarHBondContact O-N 3.44Å
206	V	44.6	Very low	51.2	Low	122 Å²	122	87.1 Å²	87.1	74%	0.739	46%	0.457	S	S	*	.	H	α-helix	trans	-86.9	-26.1	-174	176.5	0	0	0	0	114.1	G202 E204 H208	G202-V206 WeakPolarHBondContact O-CG2 3.27Å; G202-V206 PolarHBondContact O-N 3.45Å; E204-V206 VanDerWaalsContact C-N 3.31Å; E204-V206 PolarHBondContact O-N 2.97Å; E204-V206 VanDerWaalsContact O-N 3.17Å; V206-H208 VanDerWaalsContact C-N 3.34Å; V206-H208 PolarHBondContact O-N 3.4Å
207	R	43.6	Very low	50.1	Low	128 Å²	128	90.7 Å²	90.7	48%	0.483	47%	0.473	S	S	.	.	H	α-helix	trans	-85.7	2.3	-179	-96.7	-171.5	156.6	-166.7	-15	114.8	R203 E204 A209 D210 E213	R203-R207 WeakPolarHBondContact O-CB 3.47Å; R203-R207 PolarHBondContact O-N 3.31Å; R203-R207 VanDerWaalsContact O-N 3.14Å; E204-R207 PolarHBondContact O-N 3.37Å; R207-A209 PolarHBondContact O-N 3.21Å; R207-A209 VanDerWaalsContact O-N 3.16Å; R207-D210 PolarHBondContact O-N 3.16Å; R207-E213 IonicContact CZ-OE2 2.67Å; R207-E213 IonicContact NH1-OE2 2.8Å; R207-E213 PolarHBondContact NH1-OE2 2.96Å; R207-E213 IonicContact NH2-OE2 3.62Å; R207-E213 PolarHBondContact NH2-OE2 2.77Å
208	H	48.3	Very low	49.3	Very low	69 Å²	69	96.3 Å²	96.3	32%	0.319	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	15.2	-178.4	-73.9	-48.1	0	0	0	115.9	Y31 E204 V206	Y31-H208 AromaticContact CD1-NE2 3.76Å; Y31-H208 HydrophobicContact CE1-CB 4.42Å; Y31-H208 AromaticContact CE1-CD2 3.67Å; Y31-H208 AromaticContact CE1-CE1 3.52Å; Y31-H208 AromaticContact CE1-CG 3.65Å; Y31-H208 AromaticContact CE1-ND1 3.53Å; Y31-H208 AromaticContact CE1-NE2 3.61Å; Y31-H208 AromaticContact CZ-CG 3.88Å; E204-H208 PolarHBondContact O-CD2 3.2Å; E204-H208 PolarHBondContact O-NE2 2.93Å; V206-H208 VanDerWaalsContact C-N 3.34Å; V206-H208 PolarHBondContact O-N 3.4Å
209	A	44.5	Very low	48.8	Very low	89 Å²	89	97.4 Å²	97.4	74%	0.736	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-17.2	164.8	0	0	0	0	0	113.8	R207	R207-A209 PolarHBondContact O-N 3.21Å; R207-A209 VanDerWaalsContact O-N 3.16Å
210	D	41.6	Very low	48.9	Very low	139 Å²	139	92.4 Å²	92.4	74%	0.743	49%	0.494	S	S	*	.			trans	-139	90.1	175.6	-83.2	-43	0	0	0	110.7	R207 T212	R207-D210 PolarHBondContact O-N 3.16Å; D210-T212 PolarHBondContact O-N 3.25Å
211	V	46.3	Very low	49.5	Very low	90 Å²	90	94.3 Å²	94.3	55%	0.545	51%	0.505	S	S	.	.			trans	-79.3	63.7	180	-172.5	0	0	0	0	109.9
212	T	38.8	Very low	50.4	Low	136 Å²	136	95 Å²	95	83%	0.834	52%	0.516	S	S	*	.			trans	-150.6	35.8	170.9	-16	0	0	0	0	113.7	D210	D210-T212 PolarHBondContact O-N 3.25Å
213	E	38.3	Very low	52	Low	137 Å²	137	93.7 Å²	93.7	64%	0.64	50%	0.502	S	S	*	.	S	Bend	trans	-139.4	96.8	164.1	-144.2	-178.4	-154.8	0	0	107.5	R207 L215	R207-E213 IonicContact CZ-OE2 2.67Å; R207-E213 IonicContact NH1-OE2 2.8Å; R207-E213 PolarHBondContact NH1-OE2 2.96Å; R207-E213 IonicContact NH2-OE2 3.62Å; R207-E213 PolarHBondContact NH2-OE2 2.77Å; E213-L215 PolarHBondContact O-N 2.72Å
214	M	37.7	Very low	53.7	Low	176 Å²	176	89.4 Å²	89.4	87%	0.867	49%	0.486	S	S	*	.			trans	-34.4	124.4	173.5	-83.4	-178.3	74.2	0	0	111.1	S216	M214-S216 PolarHBondContact O-N 2.88Å; M214-S216 VanDerWaalsContact O-N 3.12Å
215	L	45.9	Very low	55.7	Low	136 Å²	136	92 Å²	92	71%	0.712	50%	0.503	S	S	*	.			trans	16.1	91	148.2	-78.9	150.7	0	0	0	112.4	E213 H217	E213-L215 PolarHBondContact O-N 2.72Å; L215-H217 VanDerWaalsContact C-N 3.33Å; L215-H217 PolarHBondContact O-N 2.92Å
216	S	48.7	Very low	57.6	Low	45 Å²	45	88.2 Å²	88.2	32%	0.315	49%	0.485	S	S	.	.			trans	-54.6	98.9	-179	177	0	0	0	0	109.3	M214 Q218 A219 A220	M214-S216 PolarHBondContact O-N 2.88Å; M214-S216 VanDerWaalsContact O-N 3.12Å; S216-Q218 PolarHBondContact O-N 3.42Å; S216-A219 PolarHBondContact O-N 3.48Å; S216-A220 PolarHBondContact O-N 3.39Å
217	H	54.8	Low	59.7	Low	134 Å²	134	83 Å²	83	62%	0.62	45%	0.453	S	S	*	.	H	α-helix	trans	-52	-28.3	179.9	-173.5	-97.5	0	0	0	110.9	L215 I221	L215-H217 VanDerWaalsContact C-N 3.33Å; L215-H217 PolarHBondContact O-N 2.92Å; H217-I221 WeakPolarHBondContact ND1-CD1 3.42Å; H217-I221 WeakPolarHBondContact O-CD1 3.49Å; H217-I221 WeakPolarHBondContact O-CG1 3.47Å; H217-I221 PolarHBondContact O-N 3.38Å; H217-I221 VanDerWaalsContact O-N 3.11Å
218	Q	55	Low	62	Low	159 Å²	159	78.7 Å²	78.7	74%	0.743	44%	0.441	S	S	*	.	H	α-helix	trans	-67.2	-40.3	175.1	-70.6	178.1	-24.8	0	0	114.1	S216 I221 G222	S216-Q218 PolarHBondContact O-N 3.42Å; Q218-I221 PolarHBondContact O-N 3.34Å; Q218-G222 PolarHBondContact O-N 2.92Å
219	A	58.3	Low	64.1	Low	38 Å²	38	80.2 Å²	80.2	31%	0.314	45%	0.449	S	S	.	.	H	α-helix	trans	-70	-39.2	178.3	0	0	0	0	0	111.7	S216 G222 C223	S216-A219 PolarHBondContact O-N 3.48Å; A219-G222 PolarHBondContact O-N 2.96Å; A219-C223 PolarHBondContact O-N 2.94Å
220	A	67.1	Low	66.3	Low	19 Å²	19	77.2 Å²	77.2	16%	0.157	42%	0.42	C	S	.	.	H	α-helix	trans	-64.2	-39.9	175.2	0	0	0	0	0	112.2	S216 G222 C223 R224	S216-A220 PolarHBondContact O-N 3.39Å; A220-G222 VanDerWaalsContact C-N 3.34Å; A220-G222 PolarHBondContact O-N 2.9Å; A220-C223 PolarHBondContact O-N 3.48Å; A220-R224 VanDerWaalsContact O-CG 3.29Å; A220-R224 WeakPolarHBondContact O-CG 3.39Å; A220-R224 PolarHBondContact O-N 2.91Å; A220-R224 VanDerWaalsContact O-N 3.15Å
221	I	75.6	Confident	68.8	Low	72 Å²	72	72.7 Å²	72.7	37%	0.369	40%	0.395	S	S	.	.	H	α-helix	trans	-60.8	-43.8	173.8	-69.9	162.5	0	0	0	110.9	H217 Q218 C223 R224 V225	H217-I221 WeakPolarHBondContact ND1-CD1 3.42Å; H217-I221 WeakPolarHBondContact O-CD1 3.49Å; H217-I221 WeakPolarHBondContact O-CG1 3.47Å; H217-I221 PolarHBondContact O-N 3.38Å; H217-I221 VanDerWaalsContact O-N 3.11Å; Q218-I221 PolarHBondContact O-N 3.34Å; I221-C223 PolarHBondContact O-N 3.17Å; I221-R224 PolarHBondContact O-N 3.46Å; I221-V225 HydrophobicContact CG2-CG2 4.17Å; I221-V225 WeakPolarHBondContact O-CG2 3.32Å; I221-V225 PolarHBondContact O-N 3.24Å
222	G	78.7	Confident	71	Confident	30 Å²	30	70.5 Å²	70.5	31%	0.309	38%	0.377	S	S	.	.	H	α-helix	trans	-57.8	-46.6	179.4	0	0	0	0	0	113.1	Q218 A219 A220 R224 V225 A226	Q218-G222 PolarHBondContact O-N 2.92Å; A219-G222 PolarHBondContact O-N 2.96Å; A220-G222 VanDerWaalsContact C-N 3.34Å; A220-G222 PolarHBondContact O-N 2.9Å; G222-R224 PolarHBondContact O-N 3.39Å; G222-V225 PolarHBondContact O-N 2.89Å; G222-A226 WeakPolarHBondContact O-CB 3.32Å; G222-A226 PolarHBondContact O-N 2.91Å
223	C	82.8	Confident	73.7	Confident	2 Å²	2	64.1 Å²	64.1	1%	0.014	34%	0.338	C	S	.	.	H	α-helix	trans	-65	-39.1	177.7	-165.9	0	0	0	0	112.2	A219 A220 I221 A226 Q227 C293	A219-C223 PolarHBondContact O-N 2.94Å; A220-C223 PolarHBondContact O-N 3.48Å; I221-C223 PolarHBondContact O-N 3.17Å; C223-A226 PolarHBondContact O-N 2.99Å; C223-Q227 WeakPolarHBondContact O-CB 3.34Å; C223-Q227 PolarHBondContact O-N 2.93Å; C223-C293 VanDerWaalsContact C-SG 3.54Å; C223-C293 HydrophobicContact CB-CB 3.75Å; C223-C293 WeakPolarHBondContact CB-SG 3.38Å; C223-C293 WeakPolarHBondContact SG-CB 3.17Å; C223-C293 CovalentContact SG-SG 2.03Å; C223-C293 PolarHBondContact SG-SG 2.98Å
224	R	84.3	Confident	76.3	Confident	35 Å²	35	58.7 Å²	58.7	13%	0.132	31%	0.314	C	S	.	.	H	α-helix	trans	-63.8	-46.1	175.9	-68.4	169.7	-169.7	166.7	2.8	112.1	A220 I221 G222 A226 Q227 V228 N290 E292 W294	A220-R224 VanDerWaalsContact O-CG 3.29Å; A220-R224 WeakPolarHBondContact O-CG 3.39Å; A220-R224 PolarHBondContact O-N 2.91Å; A220-R224 VanDerWaalsContact O-N 3.15Å; I221-R224 PolarHBondContact O-N 3.46Å; G222-R224 PolarHBondContact O-N 3.39Å; R224-A226 VanDerWaalsContact C-N 3.35Å; R224-A226 PolarHBondContact O-N 3.23Å; R224-Q227 WeakPolarHBondContact O-CB 3.17Å; R224-Q227 PolarHBondContact O-N 3.49Å; R224-V228 WeakPolarHBondContact O-CG2 3.25Å; R224-V228 PolarHBondContact O-N 3.35Å; R224-N290 PolarHBondContact NH1-OD1 2.96Å; R224-E292 PolarHBondContact NE-O 3.43Å; R224-E292 PolarHBondContact NH2-O 3.44Å; R224-W294 HydrophobicContact CB-CD2 4.46Å; R224-W294 HydrophobicContact CB-CE3 4.42Å; R224-W294 HydrophobicContact CG-CD2 4.21Å; R224-W294 HydrophobicContact CG-CG 4.48Å; R224-W294 HydrophobicContact CG-CZ2 4.5Å
225	V	87.1	Confident	78.9	Confident	88 Å²	88	50.5 Å²	50.5	53%	0.533	27%	0.274	S	S	.	.	H	α-helix	trans	-62.6	-43.6	177	173.2	0	0	0	0	110.7	I221 G222 Q227 V228 M229	I221-V225 HydrophobicContact CG2-CG2 4.17Å; I221-V225 WeakPolarHBondContact O-CG2 3.32Å; I221-V225 PolarHBondContact O-N 3.24Å; G222-V225 PolarHBondContact O-N 2.89Å; V225-Q227 VanDerWaalsContact C-N 3.29Å; V225-Q227 PolarHBondContact O-N 3.4Å; V225-V228 PolarHBondContact O-N 3.3Å; V225-M229 WeakPolarHBondContact O-CB 3.06Å; V225-M229 PolarHBondContact O-N 3.34Å
226	A	88.2	Confident	81.2	Confident	8 Å²	8	44 Å²	44	7%	0.066	24%	0.24	C	C	.	.	H	α-helix	trans	-60.5	-39.7	176	0	0	0	0	0	111.9	V192 M196 G222 C223 R224 M229 M230	V192-A226 HydrophobicContact CG1-CB 4.18Å; M196-A226 HydrophobicContact CB-CB 4.28Å; M196-A226 HydrophobicContact CG-CB 4.05Å; G222-A226 WeakPolarHBondContact O-CB 3.32Å; G222-A226 PolarHBondContact O-N 2.91Å; C223-A226 PolarHBondContact O-N 2.99Å; R224-A226 VanDerWaalsContact C-N 3.35Å; R224-A226 PolarHBondContact O-N 3.23Å; A226-M229 PolarHBondContact O-N 2.93Å; A226-M230 WeakPolarHBondContact O-CB 3.37Å; A226-M230 PolarHBondContact O-N 2.9Å
227	Q	88.1	Confident	83.3	Confident	14 Å²	14	41.9 Å²	41.9	7%	0.065	23%	0.225	C	C	.	.	H	α-helix	trans	-65.2	-45.2	176.2	-175.4	69.2	-6.5	0	0	112.3	C223 R224 V225 M230 Q231 W281 W294	C223-Q227 WeakPolarHBondContact O-CB 3.34Å; C223-Q227 PolarHBondContact O-N 2.93Å; R224-Q227 WeakPolarHBondContact O-CB 3.17Å; R224-Q227 PolarHBondContact O-N 3.49Å; V225-Q227 VanDerWaalsContact C-N 3.29Å; V225-Q227 PolarHBondContact O-N 3.4Å; Q227-M230 PolarHBondContact O-N 3.41Å; Q227-Q231 WeakPolarHBondContact O-CG 3.49Å; Q227-Q231 PolarHBondContact O-N 2.9Å; Q227-W281 HydrophobicContact CG-CH2 4.41Å; Q227-W294 HydrophobicContact CG-CB 4Å; Q227-W294 WeakPolarHBondContact CG-O 3.27Å; Q227-W294 PolarHBondContact NE2-O 2.87Å
228	V	91.5	Very high	85	Confident	37 Å²	37	36.1 Å²	36.1	22%	0.224	20%	0.198	C	C	.	.	H	α-helix	trans	-62.7	-45.4	176	176.3	0	0	0	0	111	R224 V225 M230 Q231 Y232 V278 W281 A282 W294	R224-V228 WeakPolarHBondContact O-CG2 3.25Å; R224-V228 PolarHBondContact O-N 3.35Å; V225-V228 PolarHBondContact O-N 3.3Å; V228-M230 VanDerWaalsContact C-N 3.29Å; V228-M230 PolarHBondContact O-N 3.42Å; V228-Q231 PolarHBondContact O-N 3.5Å; V228-Y232 PolarHBondContact O-N 3.49Å; V228-V278 HydrophobicContact CG1-CG1 3.82Å; V228-W281 HydrophobicContact CG2-CZ3 4.09Å; V228-A282 HydrophobicContact CG2-CB 4.27Å; V228-W294 HydrophobicContact CG2-CE3 3.85Å; V228-W294 HydrophobicContact CG2-CZ3 3.41Å; V228-W294 VanDerWaalsContact CG2-CZ3 3.41Å
229	M	92.1	Very high	86.8	Confident	101 Å²	101	29.5 Å²	29.5	50%	0.498	17%	0.167	S	C	.	.	H	α-helix	trans	-58.5	-43.7	177	-176.6	66.5	81.5	0	0	110.9	A189 V225 A226 Y232 C233	A189-M229 HydrophobicContact CB-CG 4.29Å; V225-M229 WeakPolarHBondContact O-CB 3.06Å; V225-M229 PolarHBondContact O-N 3.34Å; A226-M229 PolarHBondContact O-N 2.93Å; M229-Y232 PolarHBondContact O-N 3.25Å; M229-Y232 HydrophobicContact SD-CD1 4.5Å; M229-C233 WeakPolarHBondContact O-CB 3.39Å; M229-C233 PolarHBondContact O-N 2.75Å; M229-C233 PolarHBondContact O-SG 2.87Å
230	M	92.4	Very high	88.5	Confident	26 Å²	26	28 Å²	28	13%	0.128	15%	0.153	C	C	.	.	H	α-helix	trans	-59.3	-48.8	175.7	174.3	54.3	-179.4	0	0	112.1	A189 V190 K193 A226 Q227 V228 Y232 C233 V234	A189-M230 HydrophobicContact CB-CB 4.25Å; A189-M230 HydrophobicContact CB-SD 4.1Å; V190-M230 HydrophobicContact CB-CE 4.19Å; V190-M230 HydrophobicContact CB-SD 4.2Å; V190-M230 HydrophobicContact CG2-CE 3.19Å; V190-M230 HydrophobicContact CG2-SD 3.51Å; V190-M230 VanDerWaalsContact CG2-SD 3.51Å; K193-M230 HydrophobicContact CB-CB 4.3Å; K193-M230 HydrophobicContact CD-CB 4.49Å; K193-M230 HydrophobicContact CD-CG 4.19Å; A226-M230 WeakPolarHBondContact O-CB 3.37Å; A226-M230 PolarHBondContact O-N 2.9Å; Q227-M230 PolarHBondContact O-N 3.41Å; V228-M230 VanDerWaalsContact C-N 3.29Å; V228-M230 PolarHBondContact O-N 3.42Å; M230-Y232 VanDerWaalsContact C-N 3.32Å; M230-Y232 PolarHBondContact O-N 3.13Å; M230-C233 PolarHBondContact O-N 3.43Å; M230-V234 HydrophobicContact CE-CG2 3.32Å; M230-V234 WeakPolarHBondContact O-CG2 3.44Å; M230-V234 PolarHBondContact O-N 2.96Å; M230-V234 HydrophobicContact SD-CG2 3.71Å
231	Q	92.2	Very high	89.5	Confident	43 Å²	43	27.4 Å²	27.4	20%	0.201	15%	0.147	C	C	.	.	H	α-helix	trans	-60.9	-41.8	177.9	-64.1	-56.1	-26.4	0	0	112	Q227 V228 L235 W281 I306	Q227-Q231 WeakPolarHBondContact O-CG 3.49Å; Q227-Q231 PolarHBondContact O-N 2.9Å; V228-Q231 PolarHBondContact O-N 3.5Å; Q231-L235 WeakPolarHBondContact O-CB 3.3Å; Q231-L235 PolarHBondContact O-N 2.97Å; Q231-W281 HydrophobicContact CB-CZ3 4.29Å; Q231-W281 HydrophobicContact CG-CH2 3.74Å; Q231-W281 HydrophobicContact CG-CZ2 4.3Å; Q231-W281 HydrophobicContact CG-CZ3 3.91Å; Q231-I306 HydrophobicContact CG-CD1 4.31Å
232	Y	94.5	Very high	90.2	Very high	44 Å²	44	25.3 Å²	25.3	17%	0.173	14%	0.135	C	C	.	.	H	α-helix	trans	-60.8	-49.1	174.9	171.1	-102.5	0	0	0	112.1	V228 M229 M230 V234 L235 A236 W271 P274 L275	V228-Y232 PolarHBondContact O-N 3.49Å; M229-Y232 PolarHBondContact O-N 3.25Å; M229-Y232 HydrophobicContact SD-CD1 4.5Å; M230-Y232 VanDerWaalsContact C-N 3.32Å; M230-Y232 PolarHBondContact O-N 3.13Å; Y232-V234 PolarHBondContact O-N 3.45Å; Y232-L235 PolarHBondContact O-N 2.94Å; Y232-A236 VanDerWaalsContact O-CB 3.29Å; Y232-A236 WeakPolarHBondContact O-CB 3.29Å; Y232-A236 PolarHBondContact O-N 3.36Å; Y232-W271 PolarHBondContact OH-O 3.26Å; Y232-P274 HydrophobicContact CD2-CB 3.86Å; Y232-P274 HydrophobicContact CE2-CB 3.83Å; Y232-L275 HydrophobicContact CD2-CD2 3.72Å; Y232-L275 HydrophobicContact CD2-CG 4.3Å; Y232-L275 HydrophobicContact CE2-CD2 3.48Å; Y232-L275 VanDerWaalsContact CE2-CD2 3.48Å; Y232-L275 HydrophobicContact CE2-CG 3.72Å
233	C	95	Very high	90.7	Very high	3 Å²	3	24 Å²	24	2%	0.02	12%	0.122	C	C	.	.	H	α-helix	trans	-64.8	-38	-178.7	-69.4	0	0	0	0	112.5	L185 A189 M229 M230 N237	L185-C233 HydrophobicContact CB-CB 4.44Å; A189-C233 HydrophobicContact CB-CB 3.88Å; M229-C233 WeakPolarHBondContact O-CB 3.39Å; M229-C233 PolarHBondContact O-N 2.75Å; M229-C233 PolarHBondContact O-SG 2.87Å; M230-C233 PolarHBondContact O-N 3.43Å; C233-N237 WeakPolarHBondContact O-CB 3.38Å; C233-N237 PolarHBondContact O-N 3.49Å
234	V	91.8	Very high	90.9	Very high	22 Å²	22	24 Å²	24	13%	0.133	12%	0.122	C	C	.	.	H	α-helix	trans	-62.4	-49.2	173.1	171.1	0	0	0	0	110.3	R186 M230 Y232 N237 H238	R186-V234 HydrophobicContact CG-CG2 4.19Å; M230-V234 HydrophobicContact CE-CG2 3.32Å; M230-V234 WeakPolarHBondContact O-CG2 3.44Å; M230-V234 PolarHBondContact O-N 2.96Å; M230-V234 HydrophobicContact SD-CG2 3.71Å; Y232-V234 PolarHBondContact O-N 3.45Å; V234-N237 WeakPolarHBondContact O-CB 3.34Å; V234-N237 PolarHBondContact O-N 3.25Å; V234-H238 PolarHBondContact O-N 3.24Å; V234-H238 VanDerWaalsContact O-N 3.16Å; V234-H238 PolarHBondContact O-ND1 3.44Å
235	L	93.1	Very high	91.1	Very high	4 Å²	4	22.4 Å²	22.4	2%	0.021	12%	0.116	C	C	.	.	H	α-helix	trans	-65.1	-44	-178.4	-169.4	59.8	0	0	0	111.6	Q231 Y232 N237 H238 Y239 P274 F277 V278 V310	Q231-L235 WeakPolarHBondContact O-CB 3.3Å; Q231-L235 PolarHBondContact O-N 2.97Å; Y232-L235 PolarHBondContact O-N 2.94Å; L235-N237 VanDerWaalsContact C-N 3.3Å; L235-N237 PolarHBondContact O-N 3Å; L235-H238 WeakPolarHBondContact O-CB 3.3Å; L235-H238 PolarHBondContact O-N 3.01Å; L235-H238 VanDerWaalsContact O-N 3.13Å; L235-Y239 HydrophobicContact CD1-CD2 3.96Å; L235-Y239 HydrophobicContact CD1-CE2 3.68Å; L235-Y239 HydrophobicContact CG-CD2 3.95Å; L235-Y239 HydrophobicContact CG-CE2 3.92Å; L235-Y239 WeakPolarHBondContact O-CD2 3.47Å; L235-Y239 PolarHBondContact O-N 3.14Å; L235-P274 HydrophobicContact CB-CB 4.05Å; L235-P274 HydrophobicContact CD2-CB 3.91Å; L235-P274 HydrophobicContact CG-CB 3.84Å; L235-P274 HydrophobicContact CG-CG 4.32Å; L235-F277 HydrophobicContact CD2-CB 3.94Å; L235-F277 HydrophobicContact CD2-CD2 4.44Å; L235-V278 HydrophobicContact CD2-CG2 3.86Å; L235-V310 HydrophobicContact CD1-CG2 3.31Å
236	A	94.6	Very high	91.1	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-58.1	-41.5	174.5	0	0	0	0	0	112.2	Y232 H238 Y239 W240 W271 P274	Y232-A236 VanDerWaalsContact O-CB 3.29Å; Y232-A236 WeakPolarHBondContact O-CB 3.29Å; Y232-A236 PolarHBondContact O-N 3.36Å; A236-H238 VanDerWaalsContact C-N 3.34Å; A236-H238 PolarHBondContact O-N 3.39Å; A236-Y239 PolarHBondContact O-N 3.18Å; A236-W240 PolarHBondContact O-N 3.02Å; A236-W271 HydrophobicContact CB-CE3 3.97Å; A236-W271 HydrophobicContact CB-CZ3 3.89Å; A236-P274 VanDerWaalsContact CA-CG 3.48Å; A236-P274 HydrophobicContact CB-CB 4.4Å; A236-P274 HydrophobicContact CB-CG 3.91Å
237	N	93.2	Very high	91	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61.1	-41.3	175.6	178.9	-118.4	0	0	0	112.4	S182 F183 R186 C233 V234 L235 W240 F241	S182-N237 PolarHBondContact OG-ND2 3.21Å; F183-N237 WeakPolarHBondContact CD2-ND2 3.4Å; F183-N237 WeakPolarHBondContact CG-ND2 3.47Å; R186-N237 HydrophobicContact CB-CB 4.43Å; R186-N237 WeakPolarHBondContact CD-OD1 3.33Å; R186-N237 PolarHBondContact NH1-OD1 3.48Å; C233-N237 WeakPolarHBondContact O-CB 3.38Å; C233-N237 PolarHBondContact O-N 3.49Å; V234-N237 WeakPolarHBondContact O-CB 3.34Å; V234-N237 PolarHBondContact O-N 3.25Å; L235-N237 VanDerWaalsContact C-N 3.3Å; L235-N237 PolarHBondContact O-N 3Å; N237-W240 PolarHBondContact O-N 3.15Å; N237-F241 WeakPolarHBondContact O-CD2 3.36Å; N237-F241 PolarHBondContact O-N 3.49Å; N237-F241 VanDerWaalsContact O-N 3.08Å
238	H	90.2	Very high	90.7	Very high	14 Å²	14	22.8 Å²	22.8	7%	0.065	11%	0.112	C	C	.	.	H	α-helix	trans	-64.8	-42.1	175	-72.6	77.6	0	0	0	112.5	V234 L235 A236 W240 F241 F242 E362	V234-H238 PolarHBondContact O-N 3.24Å; V234-H238 VanDerWaalsContact O-N 3.16Å; V234-H238 PolarHBondContact O-ND1 3.44Å; L235-H238 WeakPolarHBondContact O-CB 3.3Å; L235-H238 PolarHBondContact O-N 3.01Å; L235-H238 VanDerWaalsContact O-N 3.13Å; A236-H238 VanDerWaalsContact C-N 3.34Å; A236-H238 PolarHBondContact O-N 3.39Å; H238-W240 VanDerWaalsContact C-N 3.33Å; H238-W240 PolarHBondContact O-N 3.5Å; H238-F241 WeakPolarHBondContact O-CB 3.21Å; H238-F241 PolarHBondContact O-N 2.79Å; H238-F242 PolarHBondContact O-N 2.89Å; H238-E362 IonicContact CD2-OE2 2.84Å; H238-E362 PolarHBondContact CD2-OE2 3.15Å; H238-E362 IonicContact CE1-OE1 3.87Å; H238-E362 IonicContact CE1-OE2 3.48Å; H238-E362 IonicContact NE2-OE1 2.84Å; H238-E362 IonicContact NE2-OE2 3.5Å; H238-E362 PolarHBondContact NE2-OE2 3.18Å
239	Y	92.7	Very high	90.4	Very high	19 Å²	19	25.1 Å²	25.1	8%	0.075	12%	0.117	C	C	.	.	H	α-helix	trans	-69.8	-29.5	178.2	-86.6	-83.8	0	0	0	112.9	L235 A236 F242 G243 L269 T273 P274 F277 P309	L235-Y239 HydrophobicContact CD1-CD2 3.96Å; L235-Y239 HydrophobicContact CD1-CE2 3.68Å; L235-Y239 HydrophobicContact CG-CD2 3.95Å; L235-Y239 HydrophobicContact CG-CE2 3.92Å; L235-Y239 WeakPolarHBondContact O-CD2 3.47Å; L235-Y239 PolarHBondContact O-N 3.14Å; A236-Y239 PolarHBondContact O-N 3.18Å; Y239-F242 HydrophobicContact CD1-CD1 4.31Å; Y239-F242 WeakPolarHBondContact O-CB 3.27Å; Y239-F242 PolarHBondContact O-N 3.36Å; Y239-G243 PolarHBondContact O-N 3.05Å; Y239-L269 HydrophobicContact CD1-CD1 4.28Å; Y239-T273 HydrophobicContact CD1-CG2 4.01Å; Y239-T273 HydrophobicContact CE1-CG2 3.4Å; Y239-T273 HydrophobicContact CE2-CG2 4.22Å; Y239-P274 HydrophobicContact CD2-CG 4.01Å; Y239-P274 HydrophobicContact CG-CG 4.36Å; Y239-F277 WeakPolarHBondContact OH-CE2 3.33Å; Y239-P309 WeakPolarHBondContact OH-CB 3.25Å
240	W	93.4	Very high	89.9	Confident	6 Å²	6	21.3 Å²	21.3	2%	0.023	10%	0.1	C	C	.	.	H	α-helix	trans	-69.3	-37.8	170.6	-86.1	106.2	0	0	0	112.6	N178 L179 A236 N237 H238 F242 G243 E244 L267 W271	N178-W240 HydrophobicContact CB-CD2 3.88Å; N178-W240 HydrophobicContact CB-CE3 3.69Å; N178-W240 HydrophobicContact CB-CH2 3.32Å; N178-W240 HydrophobicContact CB-CZ2 3.51Å; N178-W240 HydrophobicContact CB-CZ3 3.41Å; N178-W240 VanDerWaalsContact CB-CZ3 3.41Å; L179-W240 HydrophobicContact CD1-CB 3.85Å; A236-W240 PolarHBondContact O-N 3.02Å; N237-W240 PolarHBondContact O-N 3.15Å; H238-W240 VanDerWaalsContact C-N 3.33Å; H238-W240 PolarHBondContact O-N 3.5Å; W240-F242 VanDerWaalsContact C-N 3.34Å; W240-G243 PolarHBondContact O-N 3.39Å; W240-E244 PolarHBondContact O-N 2.76Å; W240-L267 HydrophobicContact CH2-CD1 4.28Å; W240-L267 HydrophobicContact CZ2-CD1 4.12Å; W240-W271 AromaticContact CE2-CE2 3.76Å; W240-W271 AromaticContact CE2-NE1 3.59Å; W240-W271 AromaticContact CZ2-CD1 3.52Å; W240-W271 AromaticContact CZ2-CE2 3.9Å; W240-W271 HydrophobicContact CZ2-CG 4.29Å; W240-W271 AromaticContact CZ2-NE1 3.23Å; W240-W271 AromaticContact NE1-CD1 3.87Å; W240-W271 AromaticContact NE1-CD2 3.43Å; W240-W271 AromaticContact NE1-CE2 3.14Å; W240-W271 AromaticContact NE1-CE3 3.91Å; W240-W271 AromaticContact NE1-CG 3.88Å; W240-W271 AromaticContact NE1-CH2 3.89Å; W240-W271 AromaticContact NE1-CZ2 3.4Å; W240-W271 AromaticContact NE1-NE1 3.46Å
241	F	88.4	Confident	89.3	Confident	8 Å²	8	23.4 Å²	23.4	4%	0.035	11%	0.114	C	C	.	.	H	α-helix	trans	-60.4	-45	168.3	-89.9	-57.1	0	0	0	112.2	L179 F183 N237 H238 G243 E244 A245 L357 Q392 V396	L179-F241 HydrophobicContact CD1-CD1 4.06Å; L179-F241 HydrophobicContact CD1-CD2 4.45Å; L179-F241 HydrophobicContact CD1-CE1 4.19Å; L179-F241 HydrophobicContact CD1-CG 4.18Å; L179-F241 HydrophobicContact CD2-CE1 4.42Å; F183-F241 HydrophobicContact CE1-CE2 4.25Å; F183-F241 HydrophobicContact CE2-CE1 4.24Å; F183-F241 AromaticContact CE2-CE2 3.56Å; F183-F241 HydrophobicContact CE2-CE2 3.56Å; F183-F241 AromaticContact CE2-CZ 3.36Å; F183-F241 HydrophobicContact CE2-CZ 3.36Å; F183-F241 HydrophobicContact CZ-CD2 4.48Å; F183-F241 HydrophobicContact CZ-CE1 4.46Å; F183-F241 AromaticContact CZ-CE2 3.24Å; F183-F241 HydrophobicContact CZ-CE2 3.24Å; F183-F241 AromaticContact CZ-CZ 3.25Å; F183-F241 HydrophobicContact CZ-CZ 3.25Å; N237-F241 WeakPolarHBondContact O-CD2 3.36Å; N237-F241 PolarHBondContact O-N 3.49Å; N237-F241 VanDerWaalsContact O-N 3.08Å; H238-F241 WeakPolarHBondContact O-CB 3.21Å; H238-F241 PolarHBondContact O-N 2.79Å; F241-G243 PolarHBondContact O-N 3.43Å; F241-E244 PolarHBondContact O-N 3.09Å; F241-A245 PolarHBondContact O-N 3.21Å; F241-L357 WeakPolarHBondContact CD1-O 3.25Å; F241-L357 WeakPolarHBondContact CE1-O 3.31Å; F241-Q392 HydrophobicContact CZ-CG 4.39Å; F241-V396 HydrophobicContact CZ-CG2 4.26Å
242	F	89.3	Confident	88.5	Confident	27 Å²	27	25 Å²	25	12%	0.118	12%	0.124	C	C	.	.	H	α-helix	trans	-59.7	-44.4	175.8	-176.7	-116	0	0	0	112.6	H238 Y239 W240 E244 A245 I246 L269 A313 I316 N317	H238-F242 PolarHBondContact O-N 2.89Å; Y239-F242 HydrophobicContact CD1-CD1 4.31Å; Y239-F242 WeakPolarHBondContact O-CB 3.27Å; Y239-F242 PolarHBondContact O-N 3.36Å; W240-F242 VanDerWaalsContact C-N 3.34Å; F242-E244 PolarHBondContact O-N 2.8Å; F242-A245 PolarHBondContact O-N 3.13Å; F242-I246 HydrophobicContact CD1-CD1 3.72Å; F242-I246 HydrophobicContact CD2-CD1 4.32Å; F242-I246 HydrophobicContact CE1-CD1 3.31Å; F242-I246 HydrophobicContact CE1-CG1 4.47Å; F242-I246 HydrophobicContact CE2-CD1 3.93Å; F242-I246 HydrophobicContact CE2-CG1 4.3Å; F242-I246 HydrophobicContact CG-CD1 4.21Å; F242-I246 HydrophobicContact CZ-CD1 3.42Å; F242-I246 VanDerWaalsContact CZ-CD1 3.42Å; F242-I246 HydrophobicContact CZ-CG1 4.23Å; F242-I246 WeakPolarHBondContact O-CG1 3.3Å; F242-I246 PolarHBondContact O-N 2.91Å; F242-L269 HydrophobicContact CD1-CD1 4.25Å; F242-L269 HydrophobicContact CD1-CD2 4.07Å; F242-L269 HydrophobicContact CD1-CG 4.44Å; F242-L269 HydrophobicContact CE1-CD1 4.25Å; F242-L269 HydrophobicContact CE1-CD2 4.37Å; F242-A313 HydrophobicContact CB-CB 4.47Å; F242-A313 HydrophobicContact CD2-CB 4.33Å; F242-A313 HydrophobicContact CG-CB 4.31Å; F242-I316 HydrophobicContact CE2-CB 3.82Å; F242-I316 HydrophobicContact CE2-CD1 4.34Å; F242-I316 HydrophobicContact CE2-CG2 3.64Å; F242-I316 HydrophobicContact CZ-CD1 4.35Å; F242-I316 HydrophobicContact CZ-CG2 4.28Å; F242-N317 WeakPolarHBondContact CA-ND2 3.5Å; F242-N317 WeakPolarHBondContact CA-OD1 3.41Å; F242-N317 VanDerWaalsContact CD2-OD1 3.3Å; F242-N317 WeakPolarHBondContact CD2-OD1 3.21Å
243	G	89.5	Confident	87.6	Confident	4 Å²	4	25.7 Å²	25.7	4%	0.041	13%	0.13	C	C	.	.	H	α-helix	trans	-61.4	-41.9	175.1	0	0	0	0	0	113	Y239 W240 F241 I246 Y247	Y239-G243 PolarHBondContact O-N 3.05Å; W240-G243 PolarHBondContact O-N 3.39Å; F241-G243 PolarHBondContact O-N 3.43Å; G243-I246 PolarHBondContact O-N 2.9Å; G243-Y247 WeakPolarHBondContact O-CB 3.14Å; G243-Y247 PolarHBondContact O-N 2.93Å
244	E	88.1	Confident	86.2	Confident	2 Å²	2	28.1 Å²	28.1	1%	0.009	15%	0.147	C	C	.	.	H	α-helix	trans	-64.3	-41.5	175.1	179.6	168.8	-129.4	0	0	112.3	I175 H176 L179 W240 F241 F242 Y247 L248 Y400	I175-E244 HydrophobicContact CG2-CB 4.32Å; H176-E244 IonicContact CE1-OE1 3.67Å; H176-E244 PolarHBondContact CE1-OE1 2.98Å; H176-E244 IonicContact ND1-OE1 3.4Å; H176-E244 PolarHBondContact ND1-OE1 3.03Å; L179-E244 WeakPolarHBondContact CD2-OE2 3.43Å; W240-E244 PolarHBondContact O-N 2.76Å; F241-E244 PolarHBondContact O-N 3.09Å; F242-E244 PolarHBondContact O-N 2.8Å; E244-Y247 WeakPolarHBondContact O-CB 3.41Å; E244-Y247 PolarHBondContact O-N 3.38Å; E244-L248 HydrophobicContact CG-CD1 4.3Å; E244-L248 WeakPolarHBondContact O-CG 3.27Å; E244-L248 PolarHBondContact O-N 3.39Å; E244-Y400 VanDerWaalsContact CD-OH 3.3Å; E244-Y400 WeakPolarHBondContact OE1-CE2 3.26Å; E244-Y400 PolarHBondContact OE1-OH 3.33Å; E244-Y400 VanDerWaalsContact OE1-OH 3.06Å
245	A	87.3	Confident	84.9	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-63.8	-44.5	177.3	0	0	0	0	0	112.2	F241 F242 Y247 L248 Y249 N317 I320 F358	F241-A245 PolarHBondContact O-N 3.21Å; F242-A245 PolarHBondContact O-N 3.13Å; A245-Y247 VanDerWaalsContact C-N 3.31Å; A245-Y247 PolarHBondContact O-N 2.91Å; A245-L248 PolarHBondContact O-N 2.97Å; A245-Y249 WeakPolarHBondContact O-CB 3.2Å; A245-Y249 PolarHBondContact O-N 3.31Å; A245-N317 WeakPolarHBondContact CB-OD1 3.25Å; A245-I320 HydrophobicContact CB-CD1 4.32Å; A245-I320 HydrophobicContact CB-CG2 4.23Å; A245-F358 HydrophobicContact CB-CD1 3.92Å; A245-F358 HydrophobicContact CB-CE1 3.74Å
246	I	87.6	Confident	83.5	Confident	45 Å²	45	35 Å²	35	23%	0.231	19%	0.192	C	C	.	.	H	α-helix	trans	-61.2	-42.4	173.9	-69.6	165.1	0	0	0	110.7	F242 G243 Y249 S250 Y266 L269 I320	F242-I246 HydrophobicContact CD1-CD1 3.72Å; F242-I246 HydrophobicContact CD2-CD1 4.32Å; F242-I246 HydrophobicContact CE1-CD1 3.31Å; F242-I246 HydrophobicContact CE1-CG1 4.47Å; F242-I246 HydrophobicContact CE2-CD1 3.93Å; F242-I246 HydrophobicContact CE2-CG1 4.3Å; F242-I246 HydrophobicContact CG-CD1 4.21Å; F242-I246 HydrophobicContact CZ-CD1 3.42Å; F242-I246 VanDerWaalsContact CZ-CD1 3.42Å; F242-I246 HydrophobicContact CZ-CG1 4.23Å; F242-I246 WeakPolarHBondContact O-CG1 3.3Å; F242-I246 PolarHBondContact O-N 2.91Å; G243-I246 PolarHBondContact O-N 2.9Å; I246-Y249 PolarHBondContact O-N 2.86Å; I246-S250 WeakPolarHBondContact O-CB 3.38Å; I246-S250 PolarHBondContact O-N 3.15Å; I246-S250 PolarHBondContact O-OG 3.49Å; I246-Y266 HydrophobicContact CG2-CE1 4.22Å; I246-L269 HydrophobicContact CD1-CD2 4.03Å; I246-I320 HydrophobicContact CG1-CD1 4.23Å
247	Y	85.3	Confident	81.6	Confident	31 Å²	31	43.9 Å²	43.9	12%	0.122	23%	0.231	C	C	.	.	H	α-helix	trans	-59.9	-49.4	177.4	172.1	-98.3	0	0	0	111.4	R172 I175 G243 E244 A245 Y249 S250 V251 I258	R172-Y247 HydrophobicContact CB-CE1 4.37Å; R172-Y247 HydrophobicContact CG-CE1 4.33Å; I175-Y247 HydrophobicContact CD1-CD1 4.04Å; I175-Y247 HydrophobicContact CD1-CD2 3.3Å; I175-Y247 HydrophobicContact CD1-CE1 4.41Å; I175-Y247 HydrophobicContact CD1-CE2 3.72Å; I175-Y247 HydrophobicContact CD1-CG 3.48Å; I175-Y247 VanDerWaalsContact CD1-CG 3.48Å; G243-Y247 WeakPolarHBondContact O-CB 3.14Å; G243-Y247 PolarHBondContact O-N 2.93Å; E244-Y247 WeakPolarHBondContact O-CB 3.41Å; E244-Y247 PolarHBondContact O-N 3.38Å; A245-Y247 VanDerWaalsContact C-N 3.31Å; A245-Y247 PolarHBondContact O-N 2.91Å; Y247-Y249 PolarHBondContact O-N 2.84Å; Y247-S250 PolarHBondContact O-N 3.11Å; Y247-V251 HydrophobicContact CD2-CG2 4.4Å; Y247-V251 HydrophobicContact CE1-CG2 4.34Å; Y247-V251 HydrophobicContact CE2-CG2 3.99Å; Y247-V251 WeakPolarHBondContact O-CG2 3.44Å; Y247-V251 PolarHBondContact O-N 3.17Å; Y247-I258 HydrophobicContact CD2-CD1 3.58Å; Y247-I258 HydrophobicContact CE2-CD1 3.8Å
248	L	82.9	Confident	79.8	Confident	43 Å²	43	45.8 Å²	45.8	23%	0.225	24%	0.241	C	C	.	.	H	α-helix	trans	-62.8	-41.6	177.7	-72.7	175.1	0	0	0	112.2	E244 A245 S250 V251 L252 I324 F358	E244-L248 HydrophobicContact CG-CD1 4.3Å; E244-L248 WeakPolarHBondContact O-CG 3.27Å; E244-L248 PolarHBondContact O-N 3.39Å; A245-L248 PolarHBondContact O-N 2.97Å; L248-S250 VanDerWaalsContact C-N 3.35Å; L248-S250 PolarHBondContact O-N 3Å; L248-V251 PolarHBondContact O-N 3.5Å; L248-L252 VanDerWaalsContact O-CB 3.26Å; L248-L252 WeakPolarHBondContact O-CB 3.39Å; L248-L252 WeakPolarHBondContact O-CG 3.42Å; L248-L252 PolarHBondContact O-N 3.15Å; L248-I324 HydrophobicContact CB-CD1 4.13Å; L248-F358 HydrophobicContact CD1-CE1 4.28Å; L248-F358 HydrophobicContact CD1-CZ 3.65Å
249	Y	84.5	Confident	78.1	Confident	85 Å²	85	49.7 Å²	49.7	33%	0.333	26%	0.262	S	S	.	.	H	α-helix	trans	-59.6	-45.6	174.7	178.7	-93.9	0	0	0	112	A245 I246 Y247 V251 I253 S254 I320	A245-Y249 WeakPolarHBondContact O-CB 3.2Å; A245-Y249 PolarHBondContact O-N 3.31Å; I246-Y249 PolarHBondContact O-N 2.86Å; Y247-Y249 PolarHBondContact O-N 2.84Å; Y249-V251 PolarHBondContact O-N 3.27Å; Y249-I253 HydrophobicContact CD2-CB 4.36Å; Y249-I253 HydrophobicContact CD2-CD1 3.59Å; Y249-I253 HydrophobicContact CD2-CG1 4.49Å; Y249-I253 HydrophobicContact CE2-CB 4.21Å; Y249-I253 HydrophobicContact CE2-CD1 3.66Å; Y249-I253 HydrophobicContact CE2-CG2 4.09Å; Y249-I253 WeakPolarHBondContact O-CB 3.32Å; Y249-I253 PolarHBondContact O-N 3.01Å; Y249-S254 WeakPolarHBondContact CE1-OG 3.34Å; Y249-S254 PolarHBondContact O-N 3.46Å; Y249-I320 HydrophobicContact CD2-CG2 4.26Å; Y249-I320 HydrophobicContact CG-CG2 4.46Å
250	S	82.9	Confident	76.3	Confident	22 Å²	22	54.2 Å²	54.2	15%	0.154	30%	0.296	C	S	.	.	I	π-helix	trans	-64.1	-42.8	-178.1	-57.4	0	0	0	0	111.7	I246 Y247 L248 S254 C255 V256	I246-S250 WeakPolarHBondContact O-CB 3.38Å; I246-S250 PolarHBondContact O-N 3.15Å; I246-S250 PolarHBondContact O-OG 3.49Å; Y247-S250 PolarHBondContact O-N 3.11Å; L248-S250 VanDerWaalsContact C-N 3.35Å; L248-S250 PolarHBondContact O-N 3Å; S250-S254 CarbonylContact O-C 3.6Å; S250-S254 PolarHBondContact O-N 3.48Å; S250-C255 PolarHBondContact O-N 3.4Å; S250-C255 VanDerWaalsContact O-N 3.08Å; S250-V256 PolarHBondContact O-N 2.97Å
251	V	78.6	Confident	74.6	Confident	70 Å²	70	60.5 Å²	60.5	42%	0.424	33%	0.33	S	S	.	.	I	π-helix	trans	-73.4	-43.4	179.7	172.9	0	0	0	0	112.4	Y247 L248 Y249 I258	Y247-V251 HydrophobicContact CD2-CG2 4.4Å; Y247-V251 HydrophobicContact CE1-CG2 4.34Å; Y247-V251 HydrophobicContact CE2-CG2 3.99Å; Y247-V251 WeakPolarHBondContact O-CG2 3.44Å; Y247-V251 PolarHBondContact O-N 3.17Å; L248-V251 PolarHBondContact O-N 3.5Å; Y249-V251 PolarHBondContact O-N 3.27Å; V251-I258 HydrophobicContact CG2-CD1 4.47Å
252	L	75.6	Confident	73.6	Confident	76 Å²	76	64.1 Å²	64.1	40%	0.398	35%	0.346	S	S	.	.	I	π-helix	trans	-84.3	-31.9	-171.9	-68.6	174.3	0	0	0	114.2	L248 I324	L248-L252 VanDerWaalsContact O-CB 3.26Å; L248-L252 WeakPolarHBondContact O-CB 3.39Å; L248-L252 WeakPolarHBondContact O-CG 3.42Å; L248-L252 PolarHBondContact O-N 3.15Å; L252-I324 HydrophobicContact CD1-CG2 4.38Å
253	I	75.4	Confident	72.8	Confident	58 Å²	58	69.8 Å²	69.8	30%	0.297	37%	0.368	S	S	.	.	I	π-helix	trans	-115.4	-52	-170.7	-65.3	167.9	0	0	0	110.8	Y249 C255 K323 I324 V327	Y249-I253 HydrophobicContact CD2-CB 4.36Å; Y249-I253 HydrophobicContact CD2-CD1 3.59Å; Y249-I253 HydrophobicContact CD2-CG1 4.49Å; Y249-I253 HydrophobicContact CE2-CB 4.21Å; Y249-I253 HydrophobicContact CE2-CD1 3.66Å; Y249-I253 HydrophobicContact CE2-CG2 4.09Å; Y249-I253 WeakPolarHBondContact O-CB 3.32Å; Y249-I253 PolarHBondContact O-N 3.01Å; I253-C255 PolarHBondContact O-N 3.22Å; I253-K323 HydrophobicContact CD1-CB 4.29Å; I253-I324 HydrophobicContact CD1-CG1 4.36Å; I253-V327 HydrophobicContact CD1-CG2 4.13Å; I253-V327 HydrophobicContact CG1-CG2 4.06Å
254	S	66.4	Low	72.4	Confident	54 Å²	54	74.3 Å²	74.3	38%	0.378	39%	0.39	S	S	.	.	I	π-helix	trans	-75.4	-15.3	-175.6	-56.3	0	0	0	0	112.6	Y249 S250 V256	Y249-S254 WeakPolarHBondContact CE1-OG 3.34Å; Y249-S254 PolarHBondContact O-N 3.46Å; S250-S254 CarbonylContact O-C 3.6Å; S250-S254 PolarHBondContact O-N 3.48Å; S254-V256 WeakPolarHBondContact O-CG2 3.24Å; S254-V256 PolarHBondContact O-N 3.5Å
255	C	64.4	Low	72.3	Confident	92 Å²	92	78.1 Å²	78.1	62%	0.622	42%	0.415	S	S	*	.			trans	49.4	23	-176.8	-66.8	0	0	0	0	113.7	S250 I253 F257	S250-C255 PolarHBondContact O-N 3.4Å; S250-C255 VanDerWaalsContact O-N 3.08Å; I253-C255 PolarHBondContact O-N 3.22Å; C255-F257 PolarHBondContact O-N 3.18Å
256	V	63.8	Low	72.2	Confident	80 Å²	80	79.9 Å²	79.9	49%	0.485	42%	0.422	S	S	.	.			trans	-80.4	108.9	177.8	177	0	0	0	0	106.7	S250 S254 I258	S250-V256 PolarHBondContact O-N 2.97Å; S254-V256 WeakPolarHBondContact O-CG2 3.24Å; S254-V256 PolarHBondContact O-N 3.5Å; V256-I258 PolarHBondContact O-N 3.26Å; V256-I258 VanDerWaalsContact O-N 3.1Å
257	F	53.5	Low	72.3	Confident	186 Å²	186	80.8 Å²	80.8	82%	0.816	43%	0.427	S	S	*	.			trans	-61.3	114.4	170.2	-75.7	-85.8	0	0	0	108.5	C255 D259	C255-F257 PolarHBondContact O-N 3.18Å; F257-D259 PolarHBondContact O-N 2.94Å
258	I	55.8	Low	72.5	Confident	40 Å²	40	82.8 Å²	82.8	21%	0.205	45%	0.445	C	S	.	.			trans	-74.1	98.6	176.2	-62.5	170.6	0	0	0	106.6	Y247 V251 V256 K262 Y266	Y247-I258 HydrophobicContact CD2-CD1 3.58Å; Y247-I258 HydrophobicContact CE2-CD1 3.8Å; V251-I258 HydrophobicContact CG2-CD1 4.47Å; V256-I258 PolarHBondContact O-N 3.26Å; V256-I258 VanDerWaalsContact O-N 3.1Å; I258-K262 HydrophobicContact CG2-CB 3.67Å; I258-K262 HydrophobicContact CG2-CD 4.35Å; I258-Y266 HydrophobicContact CD1-CE2 4.36Å; I258-Y266 WeakPolarHBondContact CD1-OH 3.33Å
259	D	54.9	Low	72.9	Confident	96 Å²	96	82.7 Å²	82.7	51%	0.513	44%	0.444	S	S	.	.			trans	-51.4	149.2	172.1	-60.9	-56.2	0	0	0	111.3	F257 N261 K262	F257-D259 PolarHBondContact O-N 2.94Å; D259-N261 PolarHBondContact O-N 3.45Å; D259-K262 HydrophobicContact CB-CD 4.34Å; D259-K262 WeakPolarHBondContact O-CB 3.34Å; D259-K262 PolarHBondContact O-N 3.37Å; D259-K262 WeakPolarHBondContact OD2-CE 3.23Å; D259-K262 IonicContact OD2-NZ 2.78Å; D259-K262 PolarHBondContact OD2-NZ 3.47Å
260	S	55.1	Low	73.3	Confident	113 Å²	113	78.7 Å²	78.7	79%	0.79	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-20	-175.4	57.5	0	0	0	0	114.9
261	N	58.2	Low	73.9	Confident	138 Å²	138	79.7 Å²	79.7	74%	0.738	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	2.7	-179.1	-147.4	23.4	0	0	0	114.7	D259	D259-N261 PolarHBondContact O-N 3.45Å
262	K	66	Low	74.6	Confident	84 Å²	84	78 Å²	78	37%	0.365	43%	0.426	S	S	.	.			trans	-100.2	17.7	-173.6	-65	177	-175.4	159.7	0	114.7	I258 D259 P265 Y266	I258-K262 HydrophobicContact CG2-CB 3.67Å; I258-K262 HydrophobicContact CG2-CD 4.35Å; D259-K262 HydrophobicContact CB-CD 4.34Å; D259-K262 WeakPolarHBondContact O-CB 3.34Å; D259-K262 PolarHBondContact O-N 3.37Å; D259-K262 WeakPolarHBondContact OD2-CE 3.23Å; D259-K262 IonicContact OD2-NZ 2.78Å; D259-K262 PolarHBondContact OD2-NZ 3.47Å; K262-P265 WeakPolarHBondContact O-CD 3.17Å; K262-Y266 VanDerWaalsContact O-CD2 3.27Å; K262-Y266 WeakPolarHBondContact O-CD2 3.24Å
263	Y	73.2	Confident	75.3	Confident	147 Å²	147	75.9 Å²	75.9	58%	0.576	42%	0.417	S	S	*	.	H	α-helix	trans	-81.4	-28.8	178.9	76	-89.1	0	0	0	113.8	Y266 L267	Y263-Y266 PolarHBondContact O-N 3.42Å; Y263-L267 PolarHBondContact O-N 3.04Å
264	L	81.6	Confident	76.3	Confident	98 Å²	98	73.1 Å²	73.1	51%	0.513	40%	0.402	S	S	.	.	H	α-helix	trans	-59.7	-42.8	-178	-176.5	67.4	0	0	0	113.1	Y266 L267 C268	L264-Y266 VanDerWaalsContact C-N 3.31Å; L264-Y266 PolarHBondContact O-N 3.48Å; L264-L267 WeakPolarHBondContact O-CB 3.42Å; L264-L267 PolarHBondContact O-N 2.99Å; L264-L267 VanDerWaalsContact O-N 3.13Å; L264-C268 PolarHBondContact O-N 3.41Å; L264-C268 PolarHBondContact O-SG 3.32Å; L264-C268 VanDerWaalsContact O-SG 3.42Å
265	P	85.5	Confident	77.5	Confident	82 Å²	82	74.7 Å²	74.7	53%	0.532	41%	0.406	S	S	.	.	H	α-helix	trans	-58	-38.6	174.7	-25.8	34.9	0	0	0	113.8	K262 C268 L269	K262-P265 WeakPolarHBondContact O-CD 3.17Å; P265-C268 PolarHBondContact O-N 3.43Å; P265-L269 VanDerWaalsContact O-CB 3.27Å; P265-L269 WeakPolarHBondContact O-CB 3.32Å; P265-L269 PolarHBondContact O-N 3.48Å
266	Y	86	Confident	78.9	Confident	37 Å²	37	76 Å²	76	15%	0.145	41%	0.406	C	S	.	.	H	α-helix	trans	-68.2	-35.8	176.8	-68.6	-80.6	0	0	0	112.1	I246 I258 K262 Y263 L264 L269 G270	I246-Y266 HydrophobicContact CG2-CE1 4.22Å; I258-Y266 HydrophobicContact CD1-CE2 4.36Å; I258-Y266 WeakPolarHBondContact CD1-OH 3.33Å; K262-Y266 VanDerWaalsContact O-CD2 3.27Å; K262-Y266 WeakPolarHBondContact O-CD2 3.24Å; Y263-Y266 PolarHBondContact O-N 3.42Å; L264-Y266 VanDerWaalsContact C-N 3.31Å; L264-Y266 PolarHBondContact O-N 3.48Å; Y266-L269 PolarHBondContact O-N 3.04Å; Y266-G270 PolarHBondContact O-N 2.03Å
267	L	88.4	Confident	80.3	Confident	65 Å²	65	74.7 Å²	74.7	34%	0.34	39%	0.394	S	S	.	.	H	α-helix	trans	-67.1	-43.6	175.7	-166.4	74.2	0	0	0	111.4	W240 Y263 L264 L269 G270 W271	W240-L267 HydrophobicContact CH2-CD1 4.28Å; W240-L267 HydrophobicContact CZ2-CD1 4.12Å; Y263-L267 PolarHBondContact O-N 3.04Å; L264-L267 WeakPolarHBondContact O-CB 3.42Å; L264-L267 PolarHBondContact O-N 2.99Å; L264-L267 VanDerWaalsContact O-N 3.13Å; L267-L269 VanDerWaalsContact C-N 3.34Å; L267-G270 PolarHBondContact O-N 2.89Å; L267-W271 VanDerWaalsContact CD1-CD1 3.44Å; L267-W271 PolarHBondContact O-N 2.98Å
268	C	90.6	Very high	82.3	Confident	72 Å²	72	66 Å²	66	49%	0.486	36%	0.357	S	S	.	.	I	π-helix	trans	-63.2	-40.4	173.3	-67.1	0	0	0	0	111.6	L264 P265 G272 T273	L264-C268 PolarHBondContact O-N 3.41Å; L264-C268 PolarHBondContact O-SG 3.32Å; L264-C268 VanDerWaalsContact O-SG 3.42Å; P265-C268 PolarHBondContact O-N 3.43Å; C268-G272 CarbonylContact O-C 3.44Å; C268-G272 WeakPolarHBondContact O-CA 3.43Å; C268-G272 PolarHBondContact O-N 2.92Å; C268-T273 PolarHBondContact O-N 2.86Å; C268-T273 VanDerWaalsContact O-N 3.09Å; C268-T273 PolarHBondContact O-OG1 2.88Å
269	L	91.8	Very high	84	Confident	42 Å²	42	68.1 Å²	68.1	22%	0.22	37%	0.371	C	S	.	.	I	π-helix	trans	-60.9	-49.4	176.4	-177.7	68.2	0	0	0	111.2	Y239 F242 I246 P265 Y266 L267 T273	Y239-L269 HydrophobicContact CD1-CD1 4.28Å; F242-L269 HydrophobicContact CD1-CD1 4.25Å; F242-L269 HydrophobicContact CD1-CD2 4.07Å; F242-L269 HydrophobicContact CD1-CG 4.44Å; F242-L269 HydrophobicContact CE1-CD1 4.25Å; F242-L269 HydrophobicContact CE1-CD2 4.37Å; I246-L269 HydrophobicContact CD1-CD2 4.03Å; P265-L269 VanDerWaalsContact O-CB 3.27Å; P265-L269 WeakPolarHBondContact O-CB 3.32Å; P265-L269 PolarHBondContact O-N 3.48Å; Y266-L269 PolarHBondContact O-N 3.04Å; L267-L269 VanDerWaalsContact C-N 3.34Å; L269-T273 WeakPolarHBondContact CA-OG1 3.34Å; L269-T273 VanDerWaalsContact O-CB 3.22Å; L269-T273 WeakPolarHBondContact O-CB 3.5Å; L269-T273 PolarHBondContact O-OG1 3.22Å
270	G	91.8	Very high	85.7	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.01	37%	0.365	C	S	.	.	I	π-helix	trans	-73	-46.1	-175.2	0	0	0	0	0	114.6	Y266 L267 P274	Y266-G270 PolarHBondContact O-N 2.03Å; L267-G270 PolarHBondContact O-N 2.89Å; G270-P274 WeakPolarHBondContact O-CD 3.18Å; G270-P274 VanDerWaalsContact O-CG 3.23Å; G270-P274 WeakPolarHBondContact O-CG 3.35Å
271	W	94.6	Very high	87.5	Confident	42 Å²	42	61 Å²	61	16%	0.159	33%	0.327	C	S	.	.	I	π-helix	trans	-102.1	-31.5	-174.9	-62.4	118	0	0	0	114.1	N178 L181 L185 Y232 A236 W240 L267	N178-W271 PolarHBondContact OD1-NE1 3.39Å; L181-W271 HydrophobicContact CD2-CH2 4.49Å; L181-W271 HydrophobicContact CD2-CZ2 4.02Å; L181-W271 HydrophobicContact CG-CH2 4.3Å; L181-W271 HydrophobicContact CG-CZ2 4.23Å; L185-W271 HydrophobicContact CD1-CH2 3.61Å; L185-W271 HydrophobicContact CD1-CZ3 3.75Å; Y232-W271 PolarHBondContact OH-O 3.26Å; A236-W271 HydrophobicContact CB-CE3 3.97Å; A236-W271 HydrophobicContact CB-CZ3 3.89Å; W240-W271 AromaticContact CE2-CE2 3.76Å; W240-W271 AromaticContact CE2-NE1 3.59Å; W240-W271 AromaticContact CZ2-CD1 3.52Å; W240-W271 AromaticContact CZ2-CE2 3.9Å; W240-W271 HydrophobicContact CZ2-CG 4.29Å; W240-W271 AromaticContact CZ2-NE1 3.23Å; W240-W271 AromaticContact NE1-CD1 3.87Å; W240-W271 AromaticContact NE1-CD2 3.43Å; W240-W271 AromaticContact NE1-CE2 3.14Å; W240-W271 AromaticContact NE1-CE3 3.91Å; W240-W271 AromaticContact NE1-CG 3.88Å; W240-W271 AromaticContact NE1-CH2 3.89Å; W240-W271 AromaticContact NE1-CZ2 3.4Å; W240-W271 AromaticContact NE1-NE1 3.46Å; L267-W271 VanDerWaalsContact CD1-CD1 3.44Å; L267-W271 PolarHBondContact O-N 2.98Å
272	G	93.3	Very high	89	Confident	35 Å²	35	55.2 Å²	55.2	36%	0.361	30%	0.299	S	S	.	.	I	π-helix	trans	-79.6	-48	-177.4	0	0	0	0	0	112.8	C268 L275	C268-G272 CarbonylContact O-C 3.44Å; C268-G272 WeakPolarHBondContact O-CA 3.43Å; C268-G272 PolarHBondContact O-N 2.92Å; G272-L275 WeakPolarHBondContact O-CB 3.45Å; G272-L275 PolarHBondContact O-N 3.42Å
273	T	91.9	Very high	90	Very high	32 Å²	32	54.8 Å²	54.8	20%	0.196	30%	0.303	C	S	.	.	H	α-helix	trans	-56	-41.7	-178.1	-42.2	0	0	0	0	114	Y239 C268 L269 L275 L276 F277	Y239-T273 HydrophobicContact CD1-CG2 4.01Å; Y239-T273 HydrophobicContact CE1-CG2 3.4Å; Y239-T273 HydrophobicContact CE2-CG2 4.22Å; C268-T273 PolarHBondContact O-N 2.86Å; C268-T273 VanDerWaalsContact O-N 3.09Å; C268-T273 PolarHBondContact O-OG1 2.88Å; L269-T273 WeakPolarHBondContact CA-OG1 3.34Å; L269-T273 VanDerWaalsContact O-CB 3.22Å; L269-T273 WeakPolarHBondContact O-CB 3.5Å; L269-T273 PolarHBondContact O-OG1 3.22Å; T273-L275 VanDerWaalsContact C-N 3.27Å; T273-L275 PolarHBondContact O-N 2.89Å; T273-L276 VanDerWaalsContact O-CB 3.29Å; T273-L276 WeakPolarHBondContact O-CB 3.4Å; T273-L276 PolarHBondContact O-N 3.11Å; T273-L276 VanDerWaalsContact O-N 3.15Å; T273-F277 HydrophobicContact CG2-CD2 4.36Å; T273-F277 HydrophobicContact CG2-CE2 3.76Å; T273-F277 VanDerWaalsContact O-CD2 3.32Å; T273-F277 WeakPolarHBondContact O-CD2 3.41Å
274	P	94.8	Very high	90.6	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-57.4	-37.1	175.3	-26.1	34.1	0	0	0	114.1	Y232 L235 A236 Y239 G270 L276 F277 V278	Y232-P274 HydrophobicContact CD2-CB 3.86Å; Y232-P274 HydrophobicContact CE2-CB 3.83Å; L235-P274 HydrophobicContact CB-CB 4.05Å; L235-P274 HydrophobicContact CD2-CB 3.91Å; L235-P274 HydrophobicContact CG-CB 3.84Å; L235-P274 HydrophobicContact CG-CG 4.32Å; A236-P274 VanDerWaalsContact CA-CG 3.48Å; A236-P274 HydrophobicContact CB-CB 4.4Å; A236-P274 HydrophobicContact CB-CG 3.91Å; Y239-P274 HydrophobicContact CD2-CG 4.01Å; Y239-P274 HydrophobicContact CG-CG 4.36Å; G270-P274 WeakPolarHBondContact O-CD 3.18Å; G270-P274 VanDerWaalsContact O-CG 3.23Å; G270-P274 WeakPolarHBondContact O-CG 3.35Å; P274-L276 VanDerWaalsContact C-N 3.27Å; P274-L276 PolarHBondContact O-N 3.48Å; P274-F277 PolarHBondContact O-N 3.02Å; P274-V278 WeakPolarHBondContact O-CG2 3.35Å; P274-V278 PolarHBondContact O-N 3.05Å
275	L	93.1	Very high	90.7	Very high	87 Å²	87	45.7 Å²	45.7	46%	0.455	26%	0.264	S	S	.	.	H	α-helix	trans	-62.8	-36.2	178.9	-65.3	172.8	0	0	0	111.8	Y232 G272 T273 F277 V279	Y232-L275 HydrophobicContact CD2-CD2 3.72Å; Y232-L275 HydrophobicContact CD2-CG 4.3Å; Y232-L275 HydrophobicContact CE2-CD2 3.48Å; Y232-L275 VanDerWaalsContact CE2-CD2 3.48Å; Y232-L275 HydrophobicContact CE2-CG 3.72Å; G272-L275 WeakPolarHBondContact O-CB 3.45Å; G272-L275 PolarHBondContact O-N 3.42Å; T273-L275 VanDerWaalsContact C-N 3.27Å; T273-L275 PolarHBondContact O-N 2.89Å; L275-F277 PolarHBondContact O-N 3.42Å; L275-V279 WeakPolarHBondContact O-CB 3.08Å; L275-V279 WeakPolarHBondContact O-CG2 3.44Å; L275-V279 PolarHBondContact O-N 3.45Å; L275-V279 VanDerWaalsContact O-N 3.09Å
276	L	93.6	Very high	90.7	Very high	118 Å²	118	45.1 Å²	45.1	62%	0.618	26%	0.258	S	S	*	.	H	α-helix	trans	-58.2	-30.4	178.7	-177.3	63.5	0	0	0	112.5	T273 P274 P280	T273-L276 VanDerWaalsContact O-CB 3.29Å; T273-L276 WeakPolarHBondContact O-CB 3.4Å; T273-L276 PolarHBondContact O-N 3.11Å; T273-L276 VanDerWaalsContact O-N 3.15Å; P274-L276 VanDerWaalsContact C-N 3.27Å; P274-L276 PolarHBondContact O-N 3.48Å; L276-P280 WeakPolarHBondContact O-CD 3.23Å; L276-P280 WeakPolarHBondContact O-CG 3.38Å
277	F	93.7	Very high	90.5	Very high	53 Å²	53	49 Å²	49	23%	0.232	28%	0.281	C	S	.	.	H	α-helix	trans	-101.1	-36.8	-178.5	-60.9	-70.6	0	0	0	113.3	L235 Y239 T273 P274 L275 W281 P309	L235-F277 HydrophobicContact CD2-CB 3.94Å; L235-F277 HydrophobicContact CD2-CD2 4.44Å; Y239-F277 WeakPolarHBondContact OH-CE2 3.33Å; T273-F277 HydrophobicContact CG2-CD2 4.36Å; T273-F277 HydrophobicContact CG2-CE2 3.76Å; T273-F277 VanDerWaalsContact O-CD2 3.32Å; T273-F277 WeakPolarHBondContact O-CD2 3.41Å; P274-F277 PolarHBondContact O-N 3.02Å; L275-F277 PolarHBondContact O-N 3.42Å; F277-W281 WeakPolarHBondContact O-CB 3.36Å; F277-W281 PolarHBondContact O-N 2.7Å; F277-P309 HydrophobicContact CB-CG 4.21Å; F277-P309 HydrophobicContact CD1-CB 4.22Å; F277-P309 HydrophobicContact CD1-CG 3.31Å; F277-P309 HydrophobicContact CD2-CB 3.86Å; F277-P309 HydrophobicContact CD2-CG 3.83Å; F277-P309 HydrophobicContact CE1-CB 4.17Å; F277-P309 HydrophobicContact CE1-CG 3.45Å; F277-P309 VanDerWaalsContact CE1-CG 3.45Å; F277-P309 HydrophobicContact CE2-CB 3.8Å; F277-P309 HydrophobicContact CE2-CG 3.95Å; F277-P309 HydrophobicContact CG-CB 4.07Å; F277-P309 HydrophobicContact CG-CG 3.5Å; F277-P309 HydrophobicContact CZ-CB 3.96Å; F277-P309 HydrophobicContact CZ-CG 3.77Å
278	V	93.6	Very high	90	Very high	5 Å²	5	52.3 Å²	52.3	3%	0.03	29%	0.293	C	S	.	.	H	α-helix	trans	-69.1	-37.9	179.8	174.9	0	0	0	0	111.8	V228 L235 P274 W281 A282	V228-V278 HydrophobicContact CG1-CG1 3.82Å; L235-V278 HydrophobicContact CD2-CG2 3.86Å; P274-V278 WeakPolarHBondContact O-CG2 3.35Å; P274-V278 PolarHBondContact O-N 3.05Å; V278-W281 HydrophobicContact CG1-CE3 4.46Å; V278-W281 PolarHBondContact O-N 3.31Å; V278-A282 WeakPolarHBondContact O-CB 3.24Å; V278-A282 PolarHBondContact O-N 2.82Å
279	V	91.8	Very high	89	Confident	83 Å²	83	49.6 Å²	49.6	50%	0.503	27%	0.273	S	S	.	.	H	α-helix	trans	-64.4	-51.8	-178.2	172	0	0	0	0	111.8	L275 W281 A282 V283	L275-V279 WeakPolarHBondContact O-CB 3.08Å; L275-V279 WeakPolarHBondContact O-CG2 3.44Å; L275-V279 PolarHBondContact O-N 3.45Å; L275-V279 VanDerWaalsContact O-N 3.09Å; V279-W281 VanDerWaalsContact C-N 3.31Å; V279-W281 PolarHBondContact O-N 2.68Å; V279-A282 PolarHBondContact O-N 2.73Å; V279-V283 HydrophobicContact CG1-CG2 4.49Å; V279-V283 WeakPolarHBondContact O-CG2 3.36Å; V279-V283 PolarHBondContact O-N 3Å
280	P	92.1	Very high	88.2	Confident	60 Å²	60	51.3 Å²	51.3	39%	0.39	28%	0.282	S	S	.	.	H	α-helix	trans	-59	-40	175.4	-26	35.6	0	0	0	113.3	L276 V283 M284	L276-P280 WeakPolarHBondContact O-CD 3.23Å; L276-P280 WeakPolarHBondContact O-CG 3.38Å; P280-V283 PolarHBondContact O-N 2.98Å; P280-M284 WeakPolarHBondContact O-CG 3.02Å; P280-M284 PolarHBondContact O-N 3.44Å
281	W	91.8	Very high	86.7	Confident	1 Å²	1	60 Å²	60	0%	0.004	32%	0.32	C	S	.	.	H	α-helix	trans	-61	-46.3	175.5	170.9	80.9	0	0	0	112.2	Q227 V228 Q231 F277 V278 V279 V283 M284 K285 W294 Y302 I305 I306	Q227-W281 HydrophobicContact CG-CH2 4.41Å; V228-W281 HydrophobicContact CG2-CZ3 4.09Å; Q231-W281 HydrophobicContact CB-CZ3 4.29Å; Q231-W281 HydrophobicContact CG-CH2 3.74Å; Q231-W281 HydrophobicContact CG-CZ2 4.3Å; Q231-W281 HydrophobicContact CG-CZ3 3.91Å; F277-W281 WeakPolarHBondContact O-CB 3.36Å; F277-W281 PolarHBondContact O-N 2.7Å; V278-W281 HydrophobicContact CG1-CE3 4.46Å; V278-W281 PolarHBondContact O-N 3.31Å; V279-W281 VanDerWaalsContact C-N 3.31Å; V279-W281 PolarHBondContact O-N 2.68Å; W281-V283 VanDerWaalsContact C-N 3.35Å; W281-V283 PolarHBondContact O-N 2.99Å; W281-M284 PolarHBondContact O-N 3.04Å; W281-K285 HydrophobicContact CD2-CG 4.29Å; W281-K285 HydrophobicContact CH2-CG 4.43Å; W281-K285 HydrophobicContact CZ2-CD 4.39Å; W281-K285 HydrophobicContact CZ2-CG 3.91Å; W281-K285 WeakPolarHBondContact O-CG 3.45Å; W281-K285 PolarHBondContact O-N 3.43Å; W281-W294 HydrophobicContact CH2-CE3 4.4Å; W281-Y302 VanDerWaalsContact CD1-O 3.26Å; W281-I305 HydrophobicContact CB-CB 4.32Å; W281-I305 HydrophobicContact CB-CG2 3.99Å; W281-I306 HydrophobicContact CB-CG2 3.63Å; W281-I306 HydrophobicContact CD2-CD1 4.5Å; W281-I306 HydrophobicContact CD2-CG2 4.08Å; W281-I306 HydrophobicContact CG-CG2 3.59Å
282	A	89.6	Confident	85.5	Confident	16 Å²	16	64.1 Å²	64.1	13%	0.132	34%	0.341	C	S	.	.	H	α-helix	trans	-62.9	-41.8	177.8	0	0	0	0	0	111.4	V228 V278 V279 M284 K285 V286	V228-A282 HydrophobicContact CG2-CB 4.27Å; V278-A282 WeakPolarHBondContact O-CB 3.24Å; V278-A282 PolarHBondContact O-N 2.82Å; V279-A282 PolarHBondContact O-N 2.73Å; A282-M284 PolarHBondContact O-N 3.35Å; A282-K285 PolarHBondContact O-N 2.93Å; A282-V286 WeakPolarHBondContact O-CG2 3.39Å; A282-V286 PolarHBondContact O-N 3.38Å
283	V	87.9	Confident	84.4	Confident	74 Å²	74	63.1 Å²	63.1	45%	0.448	33%	0.328	S	S	.	.	H	α-helix	trans	-59.1	-46.8	174.8	171.3	0	0	0	0	110.9	V279 P280 W281 K285 V286 L287	V279-V283 HydrophobicContact CG1-CG2 4.49Å; V279-V283 WeakPolarHBondContact O-CG2 3.36Å; V279-V283 PolarHBondContact O-N 3Å; P280-V283 PolarHBondContact O-N 2.98Å; W281-V283 VanDerWaalsContact C-N 3.35Å; W281-V283 PolarHBondContact O-N 2.99Å; V283-K285 VanDerWaalsContact C-N 3.32Å; V283-K285 PolarHBondContact O-N 3.19Å; V283-V286 PolarHBondContact O-N 3.39Å; V283-L287 HydrophobicContact CG1-CD1 3.75Å; V283-L287 HydrophobicContact CG1-CG 4.33Å; V283-L287 VanDerWaalsContact O-CG 3.31Å; V283-L287 WeakPolarHBondContact O-CG 3.49Å; V283-L287 PolarHBondContact O-N 3.43Å
284	M	86.3	Confident	83.7	Confident	54 Å²	54	62.4 Å²	62.4	27%	0.266	32%	0.322	S	S	.	.	H	α-helix	trans	-61.9	-39.7	177.3	-70.9	-55.2	-64.2	0	0	112.4	P280 W281 A282 L287 K288 Y302 I305	P280-M284 WeakPolarHBondContact O-CG 3.02Å; P280-M284 PolarHBondContact O-N 3.44Å; W281-M284 PolarHBondContact O-N 3.04Å; A282-M284 PolarHBondContact O-N 3.35Å; M284-L287 PolarHBondContact O-N 3.02Å; M284-K288 HydrophobicContact CE-CG 4.05Å; M284-K288 WeakPolarHBondContact O-CB 3.27Å; M284-K288 PolarHBondContact O-N 3.33Å; M284-Y302 HydrophobicContact CB-CD1 4.19Å; M284-Y302 HydrophobicContact CB-CG 4.43Å; M284-Y302 HydrophobicContact CE-CD1 3.79Å; M284-Y302 HydrophobicContact CE-CE1 3.25Å; M284-Y302 HydrophobicContact CG-CD1 4.48Å; M284-I305 HydrophobicContact CG-CD1 4.08Å
285	K	83.3	Confident	82.4	Confident	1 Å²	1	64.4 Å²	64.4	0%	0.004	34%	0.338	C	S	.	.	H	α-helix	trans	-62.7	-43.1	174.8	-76.2	-70.6	-171	173.8	0	112.6	W281 A282 V283 E289 W294 V296 N297	W281-K285 HydrophobicContact CD2-CG 4.29Å; W281-K285 HydrophobicContact CH2-CG 4.43Å; W281-K285 HydrophobicContact CZ2-CD 4.39Å; W281-K285 HydrophobicContact CZ2-CG 3.91Å; W281-K285 WeakPolarHBondContact O-CG 3.45Å; W281-K285 PolarHBondContact O-N 3.43Å; A282-K285 PolarHBondContact O-N 2.93Å; V283-K285 VanDerWaalsContact C-N 3.32Å; V283-K285 PolarHBondContact O-N 3.19Å; K285-E289 HydrophobicContact CD-CB 4.25Å; K285-E289 VanDerWaalsContact CD-OE2 3.26Å; K285-E289 WeakPolarHBondContact CD-OE2 3.17Å; K285-E289 WeakPolarHBondContact CE-OE2 3.43Å; K285-E289 IonicContact NZ-OE2 3.13Å; K285-E289 PolarHBondContact NZ-OE2 3.42Å; K285-E289 CarbonylContact O-C 3.54Å; K285-E289 WeakPolarHBondContact O-CA 3.47Å; K285-E289 PolarHBondContact O-N 3.38Å; K285-W294 HydrophobicContact CB-CD2 3.82Å; K285-W294 HydrophobicContact CB-CE3 4.01Å; K285-W294 HydrophobicContact CB-CG 4.38Å; K285-W294 HydrophobicContact CB-CH2 4.16Å; K285-W294 HydrophobicContact CB-CZ2 3.93Å; K285-W294 HydrophobicContact CB-CZ3 4.15Å; K285-W294 HydrophobicContact CD-CG 4.37Å; K285-W294 HydrophobicContact CG-CD2 4.35Å; K285-W294 HydrophobicContact CG-CE3 4.47Å; K285-V296 PolarHBondContact NZ-O 2.71Å; K285-N297 WeakPolarHBondContact CE-OD1 3.45Å; K285-N297 PolarHBondContact NZ-OD1 2.97Å
286	V	84.3	Confident	81.3	Confident	69 Å²	69	64 Å²	64	42%	0.418	34%	0.339	S	S	.	.	H	α-helix	trans	-63.5	-42	175.5	176.1	0	0	0	0	111.6	A282 V283 N290 W294	A282-V286 WeakPolarHBondContact O-CG2 3.39Å; A282-V286 PolarHBondContact O-N 3.38Å; V283-V286 PolarHBondContact O-N 3.39Å; V286-N290 WeakPolarHBondContact O-CB 3.47Å; V286-W294 HydrophobicContact CB-CZ2 4.35Å; V286-W294 HydrophobicContact CG2-CH2 3.35Å; V286-W294 HydrophobicContact CG2-CZ2 3.53Å
287	L	81.8	Confident	80.3	Confident	120 Å²	120	60.1 Å²	60.1	63%	0.628	32%	0.319	S	S	*	.	H	α-helix	trans	-78.6	-28.5	-173.8	-67	176.3	0	0	0	113.5	V283 M284	V283-L287 HydrophobicContact CG1-CD1 3.75Å; V283-L287 HydrophobicContact CG1-CG 4.33Å; V283-L287 VanDerWaalsContact O-CG 3.31Å; V283-L287 WeakPolarHBondContact O-CG 3.49Å; V283-L287 PolarHBondContact O-N 3.43Å; M284-L287 PolarHBondContact O-N 3.02Å
288	K	77.8	Confident	79.2	Confident	134 Å²	134	64.2 Å²	64.2	58%	0.583	34%	0.339	S	S	*	.	H	α-helix	trans	-118.2	-25.3	-169.7	-58.8	-64.3	-177.6	-178	0	114.5	M284 Y302	M284-K288 HydrophobicContact CE-CG 4.05Å; M284-K288 WeakPolarHBondContact O-CB 3.27Å; M284-K288 PolarHBondContact O-N 3.33Å; K288-Y302 HydrophobicContact CB-CE2 3.87Å; K288-Y302 HydrophobicContact CG-CE2 4.28Å
289	E	70.5	Confident	78.4	Confident	15 Å²	15	67.4 Å²	67.4	7%	0.07	36%	0.356	C	S	.	.			trans	-138.6	54.4	-170.1	-63.9	-178.2	167.5	0	0	111.7	K285 K291 W294 N299	K285-E289 HydrophobicContact CD-CB 4.25Å; K285-E289 VanDerWaalsContact CD-OE2 3.26Å; K285-E289 WeakPolarHBondContact CD-OE2 3.17Å; K285-E289 WeakPolarHBondContact CE-OE2 3.43Å; K285-E289 IonicContact NZ-OE2 3.13Å; K285-E289 PolarHBondContact NZ-OE2 3.42Å; K285-E289 CarbonylContact O-C 3.54Å; K285-E289 WeakPolarHBondContact O-CA 3.47Å; K285-E289 PolarHBondContact O-N 3.38Å; E289-K291 PolarHBondContact O-N 3Å; E289-W294 PolarHBondContact O-NE1 3.45Å; E289-N299 WeakPolarHBondContact OE1-CB 3.23Å; E289-N299 PolarHBondContact OE1-N 3.23Å; E289-N299 PolarHBondContact OE1-ND2 3.48Å
290	N	73.8	Confident	77.8	Confident	77 Å²	77	68 Å²	68	41%	0.412	35%	0.354	S	S	.	.			trans	-100.5	42.8	-172.9	-165.7	31.8	0	0	0	114.9	R224 V286	R224-N290 PolarHBondContact NH1-OD1 2.96Å; V286-N290 WeakPolarHBondContact O-CB 3.47Å
291	K	61.9	Low	77.4	Confident	184 Å²	184	71.2 Å²	71.2	80%	0.8	37%	0.368	S	S	*	.	S	Bend	trans	-101.9	-33.3	-173.5	-66.4	-178.7	179.9	175.7	0	114.2	E289	E289-K291 PolarHBondContact O-N 3Å
292	E	68.6	Low	77	Confident	129 Å²	129	73.5 Å²	73.5	60%	0.603	38%	0.377	S	S	*	.	S	Bend	trans	-139.3	-155.8	-174.8	-62.8	-174.5	176.5	0	0	112	R224	R224-E292 PolarHBondContact NE-O 3.43Å; R224-E292 PolarHBondContact NH2-O 3.44Å
293	C	71.3	Confident	76.7	Confident	13 Å²	13	75.7 Å²	75.7	9%	0.088	38%	0.382	C	S	.	.			trans	-74	135.4	159.8	-169.5	0	0	0	0	110.2	C223 A295	C223-C293 VanDerWaalsContact C-SG 3.54Å; C223-C293 HydrophobicContact CB-CB 3.75Å; C223-C293 WeakPolarHBondContact CB-SG 3.38Å; C223-C293 WeakPolarHBondContact SG-CB 3.17Å; C223-C293 CovalentContact SG-SG 2.03Å; C223-C293 PolarHBondContact SG-SG 2.98Å; C293-A295 PolarHBondContact O-N 3.13Å
294	W	75.4	Confident	76.7	Confident	18 Å²	18	77.6 Å²	77.6	7%	0.068	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	40	-176.7	-58.7	-29.7	0	0	0	114.2	R224 Q227 V228 W281 K285 V286 E289	R224-W294 HydrophobicContact CB-CD2 4.46Å; R224-W294 HydrophobicContact CB-CE3 4.42Å; R224-W294 HydrophobicContact CG-CD2 4.21Å; R224-W294 HydrophobicContact CG-CG 4.48Å; R224-W294 HydrophobicContact CG-CZ2 4.5Å; Q227-W294 HydrophobicContact CG-CB 4Å; Q227-W294 WeakPolarHBondContact CG-O 3.27Å; Q227-W294 PolarHBondContact NE2-O 2.87Å; V228-W294 HydrophobicContact CG2-CE3 3.85Å; V228-W294 HydrophobicContact CG2-CZ3 3.41Å; V228-W294 VanDerWaalsContact CG2-CZ3 3.41Å; W281-W294 HydrophobicContact CH2-CE3 4.4Å; K285-W294 HydrophobicContact CB-CD2 3.82Å; K285-W294 HydrophobicContact CB-CE3 4.01Å; K285-W294 HydrophobicContact CB-CG 4.38Å; K285-W294 HydrophobicContact CB-CH2 4.16Å; K285-W294 HydrophobicContact CB-CZ2 3.93Å; K285-W294 HydrophobicContact CB-CZ3 4.15Å; K285-W294 HydrophobicContact CD-CG 4.37Å; K285-W294 HydrophobicContact CG-CD2 4.35Å; K285-W294 HydrophobicContact CG-CE3 4.47Å; V286-W294 HydrophobicContact CB-CZ2 4.35Å; V286-W294 HydrophobicContact CG2-CH2 3.35Å; V286-W294 HydrophobicContact CG2-CZ2 3.53Å; E289-W294 PolarHBondContact O-NE1 3.45Å
295	A	69.2	Low	76.8	Confident	42 Å²	42	77.5 Å²	77.5	35%	0.347	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-29.8	178.6	0	0	0	0	0	112.4	L197 C293	L197-A295 HydrophobicContact CD1-CB 4.44Å; C293-A295 PolarHBondContact O-N 3.13Å
296	V	68.9	Low	77	Confident	77 Å²	77	77.9 Å²	77.9	47%	0.467	38%	0.383	S	S	.	.	S	Bend	trans	-105.6	142.7	178.1	-173.5	0	0	0	0	109.7	K25 K285	K25-V296 VanDerWaalsContact NZ-CG2 3.26Å; K285-V296 PolarHBondContact NZ-O 2.71Å
297	N	73.3	Confident	77.1	Confident	38 Å²	38	77.1 Å²	77.1	20%	0.203	37%	0.373	C	S	.	.			trans	-104.3	109.5	171.3	-62.3	-53.2	0	0	0	108	K285 M300 W303	K285-N297 WeakPolarHBondContact CE-OD1 3.45Å; K285-N297 PolarHBondContact NZ-OD1 2.97Å; N297-M300 HydrophobicContact CB-CE 3.99Å; N297-M300 WeakPolarHBondContact O-CE 3.32Å; N297-W303 HydrophobicContact CB-CB 4.3Å
298	E	70.5	Confident	77.4	Confident	138 Å²	138	76.9 Å²	76.9	65%	0.645	37%	0.367	S	S	*	.	S	Bend	trans	-75.8	-51.9	175.5	-61.9	176.1	-178.3	0	0	109.5
299	N	76.5	Confident	78	Confident	73 Å²	73	70.7 Å²	70.7	39%	0.39	34%	0.34	S	S	.	.			trans	-95	113.8	176.9	-65.8	-72.3	0	0	0	112	E289 N301 Y302	E289-N299 WeakPolarHBondContact OE1-CB 3.23Å; E289-N299 PolarHBondContact OE1-N 3.23Å; E289-N299 PolarHBondContact OE1-ND2 3.48Å; N299-N301 PolarHBondContact O-N 2.89Å; N299-Y302 HydrophobicContact CB-CD2 3.56Å; N299-Y302 HydrophobicContact CB-CE2 3.6Å; N299-Y302 HydrophobicContact CB-CG 4.39Å; N299-Y302 PolarHBondContact O-N 2.97Å
300	M	79.2	Confident	78.8	Confident	94 Å²	94	71 Å²	71	46%	0.463	34%	0.343	S	S	.	.	H	α-helix	trans	-61.5	-28.6	177.5	-67.6	-60.1	121.8	0	0	113.1	N297 Y302 W303 W304	N297-M300 HydrophobicContact CB-CE 3.99Å; N297-M300 WeakPolarHBondContact O-CE 3.32Å; M300-Y302 VanDerWaalsContact C-N 3.33Å; M300-Y302 PolarHBondContact O-N 3.27Å; M300-W303 WeakPolarHBondContact O-CB 3.37Å; M300-W303 PolarHBondContact O-N 3.4Å; M300-W303 VanDerWaalsContact O-N 3.14Å; M300-W303 HydrophobicContact SD-CE3 4Å; M300-W303 HydrophobicContact SD-CZ3 4.44Å; M300-W304 VanDerWaalsContact O-CD1 3.23Å; M300-W304 PolarHBondContact O-N 3.21Å; M300-W304 VanDerWaalsContact O-N 3.09Å
301	N	83.3	Confident	79.4	Confident	129 Å²	129	69.3 Å²	69.3	69%	0.69	33%	0.334	S	S	*	.	H	α-helix	trans	-59.3	-40.6	179.1	-69.7	-6.9	0	0	0	112.7	N299 W304	N299-N301 PolarHBondContact O-N 2.89Å; N301-W304 PolarHBondContact O-N 3.48Å
302	Y	83.2	Confident	80.7	Confident	48 Å²	48	64.6 Å²	64.6	19%	0.188	32%	0.317	C	S	.	.	H	α-helix	trans	-71.1	-36.4	177.7	-53.5	-40.3	0	0	0	111.1	W281 M284 K288 N299 M300 W304 I305	W281-Y302 VanDerWaalsContact CD1-O 3.26Å; M284-Y302 HydrophobicContact CB-CD1 4.19Å; M284-Y302 HydrophobicContact CB-CG 4.43Å; M284-Y302 HydrophobicContact CE-CD1 3.79Å; M284-Y302 HydrophobicContact CE-CE1 3.25Å; M284-Y302 HydrophobicContact CG-CD1 4.48Å; K288-Y302 HydrophobicContact CB-CE2 3.87Å; K288-Y302 HydrophobicContact CG-CE2 4.28Å; N299-Y302 HydrophobicContact CB-CD2 3.56Å; N299-Y302 HydrophobicContact CB-CE2 3.6Å; N299-Y302 HydrophobicContact CB-CG 4.39Å; N299-Y302 PolarHBondContact O-N 2.97Å; M300-Y302 VanDerWaalsContact C-N 3.33Å; M300-Y302 PolarHBondContact O-N 3.27Å; Y302-W304 PolarHBondContact O-N 2.96Å; Y302-I305 VanDerWaalsContact O-CB 3.29Å; Y302-I305 WeakPolarHBondContact O-CB 3.44Å; Y302-I305 WeakPolarHBondContact O-CG1 3.29Å; Y302-I305 PolarHBondContact O-N 3.49Å; Y302-I305 VanDerWaalsContact O-N 3.14Å
303	W	83.7	Confident	81.6	Confident	63 Å²	63	58.7 Å²	58.7	24%	0.239	29%	0.29	C	S	.	.	H	α-helix	trans	-64	-30	177.1	-175	58.6	0	0	0	112.9	N297 M300 I305 I306 R307	N297-W303 HydrophobicContact CB-CB 4.3Å; M300-W303 WeakPolarHBondContact O-CB 3.37Å; M300-W303 PolarHBondContact O-N 3.4Å; M300-W303 VanDerWaalsContact O-N 3.14Å; M300-W303 HydrophobicContact SD-CE3 4Å; M300-W303 HydrophobicContact SD-CZ3 4.44Å; W303-I305 PolarHBondContact O-N 2.97Å; W303-I306 WeakPolarHBondContact O-CG1 3.42Å; W303-I306 PolarHBondContact O-N 2.9Å; W303-R307 VanDerWaalsContact CH2-CD 3.48Å; W303-R307 HydrophobicContact CZ2-CG 4.46Å; W303-R307 WeakPolarHBondContact O-CB 3.04Å; W303-R307 PolarHBondContact O-N 3.48Å; W303-R307 VanDerWaalsContact O-N 3.08Å
304	W	86.9	Confident	82.3	Confident	114 Å²	114	58.4 Å²	58.4	43%	0.432	29%	0.288	S	S	.	.	H	α-helix	trans	-62	-24.7	174.1	-86.2	104.9	0	0	0	114.4	M300 N301 Y302 I306 R307 F308 L311	M300-W304 VanDerWaalsContact O-CD1 3.23Å; M300-W304 PolarHBondContact O-N 3.21Å; M300-W304 VanDerWaalsContact O-N 3.09Å; N301-W304 PolarHBondContact O-N 3.48Å; Y302-W304 PolarHBondContact O-N 2.96Å; W304-I306 VanDerWaalsContact C-N 3.26Å; W304-I306 PolarHBondContact O-N 3.49Å; W304-R307 HydrophobicContact CE3-CB 4.35Å; W304-R307 PolarHBondContact O-N 3.37Å; W304-F308 HydrophobicContact CE3-CB 4.16Å; W304-F308 VanDerWaalsContact O-CB 3.29Å; W304-F308 WeakPolarHBondContact O-CB 3.47Å; W304-F308 PolarHBondContact O-N 3.48Å; W304-L311 HydrophobicContact CH2-CD1 4.18Å; W304-L311 HydrophobicContact CZ3-CD1 3.9Å
305	I	88.8	Confident	82.8	Confident	51 Å²	51	61 Å²	61	26%	0.262	30%	0.303	S	S	.	.	H	α-helix	trans	-57.3	-40.7	177.1	-60.9	172.5	0	0	0	111.2	W281 M284 Y302 W303 P309	W281-I305 HydrophobicContact CB-CB 4.32Å; W281-I305 HydrophobicContact CB-CG2 3.99Å; M284-I305 HydrophobicContact CG-CD1 4.08Å; Y302-I305 VanDerWaalsContact O-CB 3.29Å; Y302-I305 WeakPolarHBondContact O-CB 3.44Å; Y302-I305 WeakPolarHBondContact O-CG1 3.29Å; Y302-I305 PolarHBondContact O-N 3.49Å; Y302-I305 VanDerWaalsContact O-N 3.14Å; W303-I305 PolarHBondContact O-N 2.97Å; I305-P309 WeakPolarHBondContact O-CD 3.34Å; I305-P309 WeakPolarHBondContact O-CG 3.38Å
306	I	88.6	Confident	83.7	Confident	9 Å²	9	62 Å²	62	5%	0.046	30%	0.302	C	S	.	.	H	α-helix	trans	-92.4	-30.2	177.9	57.8	169.2	0	0	0	112.5	Q231 W281 W303 W304 P309 V310	Q231-I306 HydrophobicContact CG-CD1 4.31Å; W281-I306 HydrophobicContact CB-CG2 3.63Å; W281-I306 HydrophobicContact CD2-CD1 4.5Å; W281-I306 HydrophobicContact CD2-CG2 4.08Å; W281-I306 HydrophobicContact CG-CG2 3.59Å; W303-I306 WeakPolarHBondContact O-CG1 3.42Å; W303-I306 PolarHBondContact O-N 2.9Å; W304-I306 VanDerWaalsContact C-N 3.26Å; W304-I306 PolarHBondContact O-N 3.49Å; I306-P309 WeakPolarHBondContact O-CD 3.19Å; I306-V310 WeakPolarHBondContact O-CG2 3.42Å
307	R	86.1	Confident	84.6	Confident	53 Å²	53	58.6 Å²	58.6	20%	0.2	28%	0.281	C	S	.	.	H	α-helix	trans	-70.7	-45.2	-177.5	-167.2	178.9	-169.8	-177.8	4.8	111.5	W303 W304 V310 L311	W303-R307 VanDerWaalsContact CH2-CD 3.48Å; W303-R307 HydrophobicContact CZ2-CG 4.46Å; W303-R307 WeakPolarHBondContact O-CB 3.04Å; W303-R307 PolarHBondContact O-N 3.48Å; W303-R307 VanDerWaalsContact O-N 3.08Å; W304-R307 HydrophobicContact CE3-CB 4.35Å; W304-R307 PolarHBondContact O-N 3.37Å; R307-V310 WeakPolarHBondContact O-CB 3.45Å; R307-V310 PolarHBondContact O-N 3.44Å; R307-L311 HydrophobicContact CG-CD1 4.25Å; R307-L311 HydrophobicContact CG-CG 4.2Å; R307-L311 WeakPolarHBondContact O-CG 3.45Å; R307-L311 PolarHBondContact O-N 3.05Å
308	F	87.9	Confident	85.1	Confident	116 Å²	116	60 Å²	60	51%	0.509	29%	0.286	S	S	.	.	H	α-helix	trans	-56.7	-49	-175.7	172	-94.4	0	0	0	113.7	W304 V310 L311 L312	W304-F308 HydrophobicContact CE3-CB 4.16Å; W304-F308 VanDerWaalsContact O-CB 3.29Å; W304-F308 WeakPolarHBondContact O-CB 3.47Å; W304-F308 PolarHBondContact O-N 3.48Å; F308-V310 VanDerWaalsContact C-N 3.31Å; F308-V310 PolarHBondContact O-N 3Å; F308-L311 PolarHBondContact O-N 3.37Å; F308-L312 HydrophobicContact CE1-CD2 4.3Å; F308-L312 HydrophobicContact CZ-CD2 4.4Å; F308-L312 PolarHBondContact O-N 3.49Å
309	P	90.6	Very high	85.9	Confident	3 Å²	3	58.3 Å²	58.3	2%	0.019	28%	0.28	C	S	.	.	H	α-helix	trans	-60.5	-37.9	177.8	-22.6	32.2	0	0	0	113.6	Y239 F277 I305 I306 L312 A313	Y239-P309 WeakPolarHBondContact OH-CB 3.25Å; F277-P309 HydrophobicContact CB-CG 4.21Å; F277-P309 HydrophobicContact CD1-CB 4.22Å; F277-P309 HydrophobicContact CD1-CG 3.31Å; F277-P309 HydrophobicContact CD2-CB 3.86Å; F277-P309 HydrophobicContact CD2-CG 3.83Å; F277-P309 HydrophobicContact CE1-CB 4.17Å; F277-P309 HydrophobicContact CE1-CG 3.45Å; F277-P309 VanDerWaalsContact CE1-CG 3.45Å; F277-P309 HydrophobicContact CE2-CB 3.8Å; F277-P309 HydrophobicContact CE2-CG 3.95Å; F277-P309 HydrophobicContact CG-CB 4.07Å; F277-P309 HydrophobicContact CG-CG 3.5Å; F277-P309 HydrophobicContact CZ-CB 3.96Å; F277-P309 HydrophobicContact CZ-CG 3.77Å; I305-P309 WeakPolarHBondContact O-CD 3.34Å; I305-P309 WeakPolarHBondContact O-CG 3.38Å; I306-P309 WeakPolarHBondContact O-CD 3.19Å; P309-L312 PolarHBondContact O-N 3.35Å; P309-A313 WeakPolarHBondContact O-CB 3.36Å; P309-A313 PolarHBondContact O-N 2.97Å
310	V	88.1	Confident	86.4	Confident	23 Å²	23	55.7 Å²	55.7	14%	0.139	27%	0.266	C	S	.	.	H	α-helix	trans	-60.6	-49.6	174.4	173	0	0	0	0	110.3	L235 I306 R307 F308 L312 A313 S314	L235-V310 HydrophobicContact CD1-CG2 3.31Å; I306-V310 WeakPolarHBondContact O-CG2 3.42Å; R307-V310 WeakPolarHBondContact O-CB 3.45Å; R307-V310 PolarHBondContact O-N 3.44Å; F308-V310 VanDerWaalsContact C-N 3.31Å; F308-V310 PolarHBondContact O-N 3Å; V310-L312 VanDerWaalsContact C-N 3.34Å; V310-L312 PolarHBondContact O-N 3.03Å; V310-A313 PolarHBondContact O-N 2.64Å; V310-S314 WeakPolarHBondContact O-CB 3.42Å; V310-S314 PolarHBondContact O-N 3.47Å; V310-S314 PolarHBondContact O-OG 3.37Å; V310-S314 VanDerWaalsContact O-OG 3.05Å
311	L	85.8	Confident	86.6	Confident	41 Å²	41	51.6 Å²	51.6	22%	0.215	25%	0.246	C	C	.	.	H	α-helix	trans	-61.5	-43.6	-179.2	-62.8	-167.5	0	0	0	112.1	W304 R307 F308 S314 L315 I366	W304-L311 HydrophobicContact CH2-CD1 4.18Å; W304-L311 HydrophobicContact CZ3-CD1 3.9Å; R307-L311 HydrophobicContact CG-CD1 4.25Å; R307-L311 HydrophobicContact CG-CG 4.2Å; R307-L311 WeakPolarHBondContact O-CG 3.45Å; R307-L311 PolarHBondContact O-N 3.05Å; F308-L311 PolarHBondContact O-N 3.37Å; L311-S314 PolarHBondContact O-N 3.48Å; L311-L315 VanDerWaalsContact O-CB 3.32Å; L311-L315 WeakPolarHBondContact O-CB 3.49Å; L311-L315 PolarHBondContact O-N 2.99Å; L311-I366 HydrophobicContact CD1-CG2 4.24Å; L311-I366 HydrophobicContact CD2-CB 4.24Å; L311-I366 HydrophobicContact CD2-CD1 3.28Å; L311-I366 HydrophobicContact CD2-CG1 3.94Å; L311-I366 HydrophobicContact CD2-CG2 3.44Å; L311-I366 VanDerWaalsContact CD2-CG2 3.44Å; L311-I366 HydrophobicContact CG-CG2 4.47Å
312	L	88	Confident	86.7	Confident	85 Å²	85	50 Å²	50	45%	0.445	24%	0.235	S	C	.	.	H	α-helix	trans	-62.7	-48.3	179	-178.1	62.2	0	0	0	111.5	F308 P309 V310 L315 I316	F308-L312 HydrophobicContact CE1-CD2 4.3Å; F308-L312 HydrophobicContact CZ-CD2 4.4Å; F308-L312 PolarHBondContact O-N 3.49Å; P309-L312 PolarHBondContact O-N 3.35Å; V310-L312 VanDerWaalsContact C-N 3.34Å; V310-L312 PolarHBondContact O-N 3.03Å; L312-L315 PolarHBondContact O-N 2.69Å; L312-I316 HydrophobicContact CD1-CD1 4.25Å; L312-I316 HydrophobicContact CG-CD1 4.21Å; L312-I316 WeakPolarHBondContact O-CG1 3.17Å; L312-I316 PolarHBondContact O-N 3.03Å; L312-I316 VanDerWaalsContact O-N 3.09Å
313	A	88.8	Confident	86.8	Confident	4 Å²	4	54.5 Å²	54.5	3%	0.033	26%	0.256	C	S	.	.	H	α-helix	trans	-62.6	-43.7	178.1	0	0	0	0	0	111.8	F242 P309 V310 L315 I316 N317	F242-A313 HydrophobicContact CB-CB 4.47Å; F242-A313 HydrophobicContact CD2-CB 4.33Å; F242-A313 HydrophobicContact CG-CB 4.31Å; P309-A313 WeakPolarHBondContact O-CB 3.36Å; P309-A313 PolarHBondContact O-N 2.97Å; V310-A313 PolarHBondContact O-N 2.64Å; A313-L315 PolarHBondContact O-N 2.97Å; A313-I316 PolarHBondContact O-N 3.28Å; A313-N317 WeakPolarHBondContact O-CB 3.36Å; A313-N317 PolarHBondContact O-N 3.47Å
314	S	85.3	Confident	86.7	Confident	8 Å²	8	51.7 Å²	51.7	6%	0.056	25%	0.245	C	C	.	.	H	α-helix	trans	-65.8	-36.9	178.2	-64.2	0	0	0	0	112.6	V310 L311 N317 F318	V310-S314 WeakPolarHBondContact O-CB 3.42Å; V310-S314 PolarHBondContact O-N 3.47Å; V310-S314 PolarHBondContact O-OG 3.37Å; V310-S314 VanDerWaalsContact O-OG 3.05Å; L311-S314 PolarHBondContact O-N 3.48Å; S314-N317 PolarHBondContact O-N 3.29Å; S314-F318 PolarHBondContact O-N 3.48Å
315	L	85.6	Confident	86.4	Confident	72 Å²	72	47.9 Å²	47.9	38%	0.377	23%	0.233	S	C	.	.	H	α-helix	trans	-63.4	-47.1	174	179.4	62.9	0	0	0	111.5	L311 L312 A313 N317 F318 L319	L311-L315 VanDerWaalsContact O-CB 3.32Å; L311-L315 WeakPolarHBondContact O-CB 3.49Å; L311-L315 PolarHBondContact O-N 2.99Å; L312-L315 PolarHBondContact O-N 2.69Å; A313-L315 PolarHBondContact O-N 2.97Å; L315-N317 VanDerWaalsContact C-N 3.33Å; L315-N317 PolarHBondContact O-N 3.07Å; L315-F318 WeakPolarHBondContact O-CB 3.48Å; L315-F318 PolarHBondContact O-N 2.96Å; L315-L319 WeakPolarHBondContact O-CG 3.26Å; L315-L319 PolarHBondContact O-N 3.31Å; L315-L319 VanDerWaalsContact O-N 3.07Å
316	I	88.4	Confident	86.2	Confident	64 Å²	64	47.1 Å²	47.1	33%	0.328	24%	0.239	S	C	.	.	H	α-helix	trans	-64.5	-40.9	178.3	-60.9	164.6	0	0	0	110.4	F242 L312 A313 F318 L319 I320	F242-I316 HydrophobicContact CE2-CB 3.82Å; F242-I316 HydrophobicContact CE2-CD1 4.34Å; F242-I316 HydrophobicContact CE2-CG2 3.64Å; F242-I316 HydrophobicContact CZ-CD1 4.35Å; F242-I316 HydrophobicContact CZ-CG2 4.28Å; L312-I316 HydrophobicContact CD1-CD1 4.25Å; L312-I316 HydrophobicContact CG-CD1 4.21Å; L312-I316 WeakPolarHBondContact O-CG1 3.17Å; L312-I316 PolarHBondContact O-N 3.03Å; L312-I316 VanDerWaalsContact O-N 3.09Å; A313-I316 PolarHBondContact O-N 3.28Å; I316-F318 VanDerWaalsContact C-N 3.3Å; I316-F318 PolarHBondContact O-N 3Å; I316-L319 WeakPolarHBondContact O-CB 3.16Å; I316-L319 PolarHBondContact O-N 3.49Å; I316-L319 VanDerWaalsContact O-N 3.16Å; I316-I320 HydrophobicContact CG2-CD1 4.06Å; I316-I320 HydrophobicContact CG2-CG1 4.47Å; I316-I320 WeakPolarHBondContact O-CG1 3.36Å; I316-I320 PolarHBondContact O-N 3.16Å
317	N	87.2	Confident	85.8	Confident	5 Å²	5	49 Å²	49	3%	0.027	25%	0.25	C	S	.	.	H	α-helix	trans	-56.7	-43.4	173.3	-86.2	-21.7	0	0	0	112.5	F242 A245 A313 S314 L315 L319 I320 F321	F242-N317 WeakPolarHBondContact CA-ND2 3.5Å; F242-N317 WeakPolarHBondContact CA-OD1 3.41Å; F242-N317 VanDerWaalsContact CD2-OD1 3.3Å; F242-N317 WeakPolarHBondContact CD2-OD1 3.21Å; A245-N317 WeakPolarHBondContact CB-OD1 3.25Å; A313-N317 WeakPolarHBondContact O-CB 3.36Å; A313-N317 PolarHBondContact O-N 3.47Å; S314-N317 PolarHBondContact O-N 3.29Å; L315-N317 VanDerWaalsContact C-N 3.33Å; L315-N317 PolarHBondContact O-N 3.07Å; N317-L319 PolarHBondContact O-N 3.16Å; N317-I320 PolarHBondContact O-N 3.42Å; N317-F321 WeakPolarHBondContact O-CB 3.45Å; N317-F321 PolarHBondContact O-N 2.91Å
318	F	85.1	Confident	85.4	Confident	67 Å²	67	48.8 Å²	48.8	29%	0.294	25%	0.253	S	S	.	.	H	α-helix	trans	-61.8	-43	176.2	179.4	-107.4	0	0	0	111.9	S314 L315 I316 I320 F321 M322 V360	S314-F318 PolarHBondContact O-N 3.48Å; L315-F318 WeakPolarHBondContact O-CB 3.48Å; L315-F318 PolarHBondContact O-N 2.96Å; I316-F318 VanDerWaalsContact C-N 3.3Å; I316-F318 PolarHBondContact O-N 3Å; F318-I320 PolarHBondContact O-N 2.78Å; F318-F321 HydrophobicContact CD2-CD1 4.44Å; F318-F321 WeakPolarHBondContact O-CB 3.42Å; F318-F321 PolarHBondContact O-N 3.07Å; F318-M322 HydrophobicContact CD1-CG 4.46Å; F318-M322 HydrophobicContact CE1-CG 4.06Å; F318-M322 HydrophobicContact CE2-CG 4.19Å; F318-M322 HydrophobicContact CE2-SD 4.16Å; F318-M322 HydrophobicContact CZ-CG 3.92Å; F318-M322 HydrophobicContact CZ-SD 4.02Å; F318-M322 WeakPolarHBondContact O-CG 3.32Å; F318-M322 PolarHBondContact O-N 2.86Å; F318-V360 HydrophobicContact CD2-CB 4.46Å; F318-V360 HydrophobicContact CD2-CG1 3.57Å; F318-V360 HydrophobicContact CD2-CG2 4.11Å; F318-V360 HydrophobicContact CE2-CG1 3.82Å
319	L	87	Confident	84.9	Confident	102 Å²	102	48.1 Å²	48.1	53%	0.534	25%	0.25	S	C	.	.	H	α-helix	trans	-62	-43.4	175.7	-63.7	176	0	0	0	112	L315 I316 N317 M322 K323	L315-L319 WeakPolarHBondContact O-CG 3.26Å; L315-L319 PolarHBondContact O-N 3.31Å; L315-L319 VanDerWaalsContact O-N 3.07Å; I316-L319 WeakPolarHBondContact O-CB 3.16Å; I316-L319 PolarHBondContact O-N 3.49Å; I316-L319 VanDerWaalsContact O-N 3.16Å; N317-L319 PolarHBondContact O-N 3.16Å; L319-M322 PolarHBondContact O-N 3.08Å; L319-K323 WeakPolarHBondContact O-CG 3.32Å; L319-K323 PolarHBondContact O-N 3.33Å; L319-K323 VanDerWaalsContact O-N 3.13Å
320	I	86.4	Confident	84.4	Confident	18 Å²	18	51.7 Å²	51.7	9%	0.092	28%	0.275	C	S	.	.	H	α-helix	trans	-60.8	-46.7	174.8	-69.4	169.2	0	0	0	110.3	A245 I246 Y249 I316 N317 F318 M322 K323 I324	A245-I320 HydrophobicContact CB-CD1 4.32Å; A245-I320 HydrophobicContact CB-CG2 4.23Å; I246-I320 HydrophobicContact CG1-CD1 4.23Å; Y249-I320 HydrophobicContact CD2-CG2 4.26Å; Y249-I320 HydrophobicContact CG-CG2 4.46Å; I316-I320 HydrophobicContact CG2-CD1 4.06Å; I316-I320 HydrophobicContact CG2-CG1 4.47Å; I316-I320 WeakPolarHBondContact O-CG1 3.36Å; I316-I320 PolarHBondContact O-N 3.16Å; N317-I320 PolarHBondContact O-N 3.42Å; F318-I320 PolarHBondContact O-N 2.78Å; I320-M322 VanDerWaalsContact C-N 3.34Å; I320-M322 PolarHBondContact O-N 3.11Å; I320-K323 PolarHBondContact O-N 3.42Å; I320-K323 VanDerWaalsContact O-N 3.15Å; I320-I324 HydrophobicContact CG2-CD1 3.64Å; I320-I324 HydrophobicContact CG2-CG1 4.21Å; I320-I324 WeakPolarHBondContact O-CG1 3.45Å; I320-I324 PolarHBondContact O-N 3.16Å
321	F	84.8	Confident	83.7	Confident	8 Å²	8	56.8 Å²	56.8	4%	0.035	30%	0.295	C	S	.	.	H	α-helix	trans	-56.8	-46.8	178.1	168.8	-105.4	0	0	0	111.6	N317 F318 K323 I324 L325 T351 L354 I355 F358 V360	N317-F321 WeakPolarHBondContact O-CB 3.45Å; N317-F321 PolarHBondContact O-N 2.91Å; F318-F321 HydrophobicContact CD2-CD1 4.44Å; F318-F321 WeakPolarHBondContact O-CB 3.42Å; F318-F321 PolarHBondContact O-N 3.07Å; F321-K323 VanDerWaalsContact C-N 3.31Å; F321-K323 PolarHBondContact O-N 3.32Å; F321-I324 PolarHBondContact O-N 3.04Å; F321-L325 HydrophobicContact CE1-CD2 4.41Å; F321-L325 HydrophobicContact CZ-CD2 4.24Å; F321-L325 WeakPolarHBondContact O-CB 3.39Å; F321-L325 PolarHBondContact O-N 3.42Å; F321-T351 HydrophobicContact CZ-CG2 4.34Å; F321-L354 HydrophobicContact CD2-CB 4.18Å; F321-L354 HydrophobicContact CD2-CD2 4.09Å; F321-L354 HydrophobicContact CE2-CB 3.51Å; F321-L354 HydrophobicContact CE2-CD2 3.88Å; F321-L354 HydrophobicContact CE2-CG 4.35Å; F321-L354 HydrophobicContact CZ-CB 4.47Å; F321-I355 HydrophobicContact CZ-CG1 4.16Å; F321-F358 HydrophobicContact CB-CG 4.41Å; F321-F358 AromaticContact CD2-CD2 3.86Å; F321-F358 HydrophobicContact CD2-CD2 3.86Å; F321-F358 HydrophobicContact CD2-CE2 4.32Å; F321-F358 HydrophobicContact CD2-CG 4.21Å; F321-V360 HydrophobicContact CB-CG2 4.36Å; F321-V360 HydrophobicContact CD1-CG2 4.01Å; F321-V360 HydrophobicContact CG-CG2 4.12Å
322	M	83.8	Confident	82.9	Confident	95 Å²	95	56.9 Å²	56.9	47%	0.468	30%	0.296	S	S	.	.	H	α-helix	trans	-61.1	-38.9	177.4	-68.8	-57.6	-69.3	0	0	112.3	F318 L319 I320 G326	F318-M322 HydrophobicContact CD1-CG 4.46Å; F318-M322 HydrophobicContact CE1-CG 4.06Å; F318-M322 HydrophobicContact CE2-CG 4.19Å; F318-M322 HydrophobicContact CE2-SD 4.16Å; F318-M322 HydrophobicContact CZ-CG 3.92Å; F318-M322 HydrophobicContact CZ-SD 4.02Å; F318-M322 WeakPolarHBondContact O-CG 3.32Å; F318-M322 PolarHBondContact O-N 2.86Å; L319-M322 PolarHBondContact O-N 3.08Å; I320-M322 VanDerWaalsContact C-N 3.34Å; I320-M322 PolarHBondContact O-N 3.11Å; M322-G326 PolarHBondContact O-N 2.91Å
323	K	85.7	Confident	82.2	Confident	143 Å²	143	61.6 Å²	61.6	62%	0.622	31%	0.307	S	S	*	.	H	α-helix	trans	-67	-45.2	175.2	-67.4	-65.3	-174.5	-178.7	0	112.2	I253 L319 I320 F321 L325 G326 V327	I253-K323 HydrophobicContact CD1-CB 4.29Å; L319-K323 WeakPolarHBondContact O-CG 3.32Å; L319-K323 PolarHBondContact O-N 3.33Å; L319-K323 VanDerWaalsContact O-N 3.13Å; I320-K323 PolarHBondContact O-N 3.42Å; I320-K323 VanDerWaalsContact O-N 3.15Å; F321-K323 VanDerWaalsContact C-N 3.31Å; F321-K323 PolarHBondContact O-N 3.32Å; K323-L325 VanDerWaalsContact C-N 3.33Å; K323-L325 PolarHBondContact O-N 2.85Å; K323-G326 PolarHBondContact O-N 3.49Å; K323-V327 WeakPolarHBondContact O-CG2 3.48Å; K323-V327 PolarHBondContact O-N 3.32Å
324	I	82.3	Confident	81.3	Confident	4 Å²	4	65.5 Å²	65.5	2%	0.021	34%	0.34	C	S	.	.	H	α-helix	trans	-61.1	-44.8	176.9	-69.3	173.1	0	0	0	110.3	L248 L252 I253 I320 F321 G326 V327 I328 L354 F358	L248-I324 HydrophobicContact CB-CD1 4.13Å; L252-I324 HydrophobicContact CD1-CG2 4.38Å; I253-I324 HydrophobicContact CD1-CG1 4.36Å; I320-I324 HydrophobicContact CG2-CD1 3.64Å; I320-I324 HydrophobicContact CG2-CG1 4.21Å; I320-I324 WeakPolarHBondContact O-CG1 3.45Å; I320-I324 PolarHBondContact O-N 3.16Å; F321-I324 PolarHBondContact O-N 3.04Å; I324-G326 VanDerWaalsContact C-N 3.3Å; I324-G326 PolarHBondContact O-N 3.45Å; I324-V327 PolarHBondContact O-N 3.36Å; I324-I328 HydrophobicContact CG2-CD1 3.69Å; I324-I328 HydrophobicContact CG2-CG1 4.29Å; I324-I328 WeakPolarHBondContact O-CG1 3.31Å; I324-I328 PolarHBondContact O-N 3.42Å; I324-L354 HydrophobicContact CG2-CD2 4.36Å; I324-F358 HydrophobicContact CD1-CE1 4.37Å; I324-F358 HydrophobicContact CD1-CZ 4.17Å
325	L	80.9	Confident	80.4	Confident	34 Å²	34	72.1 Å²	72.1	18%	0.178	38%	0.375	C	S	.	.	H	α-helix	trans	-60	-42	177.4	-172.7	65.5	0	0	0	111.3	F321 K323 I328 F329 T351	F321-L325 HydrophobicContact CE1-CD2 4.41Å; F321-L325 HydrophobicContact CZ-CD2 4.24Å; F321-L325 WeakPolarHBondContact O-CB 3.39Å; F321-L325 PolarHBondContact O-N 3.42Å; K323-L325 VanDerWaalsContact C-N 3.33Å; K323-L325 PolarHBondContact O-N 2.85Å; L325-I328 PolarHBondContact O-N 3.08Å; L325-F329 VanDerWaalsContact O-CB 3.27Å; L325-F329 WeakPolarHBondContact O-CB 3.3Å; L325-F329 PolarHBondContact O-N 2.9Å; L325-T351 HydrophobicContact CD1-CG2 4.49Å; L325-T351 WeakPolarHBondContact CD1-OG1 3.46Å; L325-T351 HydrophobicContact CD2-CG2 4.46Å
326	G	83.5	Confident	79	Confident	36 Å²	36	71 Å²	71	37%	0.371	37%	0.369	S	S	.	.	H	α-helix	trans	-58.8	-45.6	173.5	0	0	0	0	0	113	M322 K323 I324 F329 S330	M322-G326 PolarHBondContact O-N 2.91Å; K323-G326 PolarHBondContact O-N 3.49Å; I324-G326 VanDerWaalsContact C-N 3.3Å; I324-G326 PolarHBondContact O-N 3.45Å; G326-F329 WeakPolarHBondContact O-CB 3.48Å; G326-F329 PolarHBondContact O-N 3.49Å; G326-S330 PolarHBondContact O-N 2.74Å; G326-S330 PolarHBondContact O-OG 3.35Å
327	V	80.9	Confident	77.5	Confident	49 Å²	49	77.5 Å²	77.5	30%	0.297	40%	0.397	S	S	.	.	H	α-helix	trans	-65.2	-44.1	177.4	172.9	0	0	0	0	111.9	I253 K323 I324 F329 S330 K331	I253-V327 HydrophobicContact CD1-CG2 4.13Å; I253-V327 HydrophobicContact CG1-CG2 4.06Å; K323-V327 WeakPolarHBondContact O-CG2 3.48Å; K323-V327 PolarHBondContact O-N 3.32Å; I324-V327 PolarHBondContact O-N 3.36Å; V327-F329 VanDerWaalsContact C-N 3.3Å; V327-F329 PolarHBondContact O-N 2.93Å; V327-S330 PolarHBondContact O-N 2.96Å; V327-K331 PolarHBondContact O-N 2.97Å
328	I	77.8	Confident	75.7	Confident	48 Å²	48	82.4 Å²	82.4	25%	0.246	43%	0.431	C	S	.	.	H	α-helix	trans	-60.9	-42.8	176.1	-70.7	172.2	0	0	0	110	I324 L325 K331 L332 L354	I324-I328 HydrophobicContact CG2-CD1 3.69Å; I324-I328 HydrophobicContact CG2-CG1 4.29Å; I324-I328 WeakPolarHBondContact O-CG1 3.31Å; I324-I328 PolarHBondContact O-N 3.42Å; L325-I328 PolarHBondContact O-N 3.08Å; I328-K331 PolarHBondContact O-N 3.41Å; I328-L332 HydrophobicContact CG2-CD1 3.61Å; I328-L332 HydrophobicContact CG2-CG 4.48Å; I328-L332 WeakPolarHBondContact O-CB 3.41Å; I328-L332 WeakPolarHBondContact O-CG 3.44Å; I328-L332 PolarHBondContact O-N 2.95Å; I328-L354 HydrophobicContact CD1-CD2 4.47Å
329	F	76.7	Confident	74.3	Confident	101 Å²	101	85.5 Å²	85.5	44%	0.443	45%	0.447	S	S	.	.	H	α-helix	trans	-61.7	-45.4	176.6	-176.8	-101	0	0	0	111.9	L325 G326 V327 K331 L332 R333 L347	L325-F329 VanDerWaalsContact O-CB 3.27Å; L325-F329 WeakPolarHBondContact O-CB 3.3Å; L325-F329 PolarHBondContact O-N 2.9Å; G326-F329 WeakPolarHBondContact O-CB 3.48Å; G326-F329 PolarHBondContact O-N 3.49Å; V327-F329 VanDerWaalsContact C-N 3.3Å; V327-F329 PolarHBondContact O-N 2.93Å; F329-K331 PolarHBondContact O-N 3.29Å; F329-L332 PolarHBondContact O-N 2.92Å; F329-R333 WeakPolarHBondContact O-CB 3.28Å; F329-R333 PolarHBondContact O-N 3.15Å; F329-L347 HydrophobicContact CD2-CD1 4.32Å; F329-L347 HydrophobicContact CD2-CD2 3.99Å; F329-L347 HydrophobicContact CE2-CD2 4.16Å
330	S	79.6	Confident	72.8	Confident	78 Å²	78	89 Å²	89	55%	0.545	45%	0.454	S	S	.	.	H	α-helix	trans	-60.9	-42.5	175	-65	0	0	0	0	112.5	G326 V327 R333 A334	G326-S330 PolarHBondContact O-N 2.74Å; G326-S330 PolarHBondContact O-OG 3.35Å; V327-S330 PolarHBondContact O-N 2.96Å; S330-R333 PolarHBondContact O-N 3.12Å; S330-A334 PolarHBondContact O-N 2.94Å
331	K	74.3	Confident	71.5	Confident	130 Å²	130	93.1 Å²	93.1	57%	0.565	48%	0.482	S	S	*	.	H	α-helix	trans	-68.2	-39.5	177.1	-74.5	-171.8	178.3	-176.6	0	112.9	V327 I328 F329 A334 N335	V327-K331 PolarHBondContact O-N 2.97Å; I328-K331 PolarHBondContact O-N 3.41Å; F329-K331 PolarHBondContact O-N 3.29Å; K331-A334 PolarHBondContact O-N 3.41Å; K331-N335 PolarHBondContact O-N 2.93Å
332	L	69.4	Low	70.5	Confident	44 Å²	44	95.6 Å²	95.6	23%	0.23	50%	0.496	C	S	.	.	H	α-helix	trans	-61.4	-47	172.6	-83.8	155.7	0	0	0	110	I328 F329 A334 N335 I336 L347	I328-L332 HydrophobicContact CG2-CD1 3.61Å; I328-L332 HydrophobicContact CG2-CG 4.48Å; I328-L332 WeakPolarHBondContact O-CB 3.41Å; I328-L332 WeakPolarHBondContact O-CG 3.44Å; I328-L332 PolarHBondContact O-N 2.95Å; F329-L332 PolarHBondContact O-N 2.92Å; L332-A334 VanDerWaalsContact C-N 3.31Å; L332-A334 PolarHBondContact O-N 3.14Å; L332-N335 PolarHBondContact O-N 2.98Å; L332-N335 VanDerWaalsContact O-N 3.08Å; L332-I336 WeakPolarHBondContact O-CD1 3.38Å; L332-I336 WeakPolarHBondContact O-CG1 3.08Å; L332-I336 PolarHBondContact O-N 3.36Å; L332-L347 HydrophobicContact CD1-CD1 4.05Å
333	R	72.3	Confident	69.6	Low	183 Å²	183	94 Å²	94	69%	0.691	49%	0.485	S	S	*	.	H	α-helix	trans	-60.3	-35.9	178	-168.7	177.9	-179.3	-173	0.5	113.5	F329 S330 N335 I336	F329-R333 WeakPolarHBondContact O-CB 3.28Å; F329-R333 PolarHBondContact O-N 3.15Å; S330-R333 PolarHBondContact O-N 3.12Å; R333-N335 VanDerWaalsContact C-N 3.32Å; R333-N335 PolarHBondContact O-N 3.19Å; R333-I336 WeakPolarHBondContact O-CB 3.39Å; R333-I336 PolarHBondContact O-N 3.23Å
334	A	69.6	Low	68.5	Low	86 Å²	86	93.6 Å²	93.6	71%	0.711	48%	0.483	S	S	*	.	H	α-helix	trans	-67.9	-29.7	175.8	0	0	0	0	0	113.3	S330 K331 L332	S330-A334 PolarHBondContact O-N 2.94Å; K331-A334 PolarHBondContact O-N 3.41Å; L332-A334 VanDerWaalsContact C-N 3.31Å; L332-A334 PolarHBondContact O-N 3.14Å
335	N	66.4	Low	67.6	Low	148 Å²	148	99 Å²	99	79%	0.791	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	4.5	178.9	-93.3	-30.5	0	0	0	114.2	K331 L332 R333 H337	K331-N335 PolarHBondContact O-N 2.93Å; L332-N335 PolarHBondContact O-N 2.98Å; L332-N335 VanDerWaalsContact O-N 3.08Å; R333-N335 VanDerWaalsContact C-N 3.32Å; R333-N335 PolarHBondContact O-N 3.19Å; N335-H337 PolarHBondContact O-N 3.27Å
336	I	57.9	Low	66.9	Low	49 Å²	49	104.7 Å²	104.7	25%	0.251	53%	0.531	S	S	.	.			trans	-88.9	12.6	-165.6	-88.5	167.8	0	0	0	115.4	L332 R333 S338 Y343	L332-I336 WeakPolarHBondContact O-CD1 3.38Å; L332-I336 WeakPolarHBondContact O-CG1 3.08Å; L332-I336 PolarHBondContact O-N 3.36Å; R333-I336 WeakPolarHBondContact O-CB 3.39Å; R333-I336 PolarHBondContact O-N 3.23Å; I336-S338 PolarHBondContact O-N 3.07Å; I336-Y343 HydrophobicContact CD1-CD2 4.39Å; I336-Y343 HydrophobicContact CD1-CG 4.1Å
337	H	55.4	Low	65.9	Low	200 Å²	200	104.9 Å²	104.9	93%	0.926	52%	0.523	S	S	*	.	S	Bend	trans	-62.5	1.1	-178.7	-156.3	89	0	0	0	115.3	N335	N335-H337 PolarHBondContact O-N 3.27Å
338	S	49.3	Very low	65	Low	107 Å²	107	105.1 Å²	105.1	75%	0.748	53%	0.53	S	S	*	.	S	Bend	trans	-139.5	-11.6	-172.1	-170.3	0	0	0	0	121	I336	I336-S338 PolarHBondContact O-N 3.07Å
339	Q	55.9	Low	64.6	Low	133 Å²	133	110.1 Å²	110.1	62%	0.621	55%	0.55	S	S	*	*			trans	-160.2	116.5	179	-133.9	158.2	-0.8	0	0	116.4
340	Y	56.6	Low	64.1	Low	176 Å²	176	106.6 Å²	106.6	69%	0.69	54%	0.539	S	S	*	.	H	α-helix	trans	-83.6	-27.6	-170.5	-113.9	-101.8	0	0	0	118.1	Y343	Y340-Y343 HydrophobicContact CD1-CD1 4.45Å; Y340-Y343 AromaticContact CD1-CE1 3.62Å; Y340-Y343 HydrophobicContact CD1-CE1 3.62Å; Y340-Y343 HydrophobicContact CE1-CE1 4.03Å; Y340-Y343 HydrophobicContact CG-CE1 4.1Å; Y340-Y343 WeakPolarHBondContact O-CD1 3.5Å; Y340-Y343 WeakPolarHBondContact O-CE1 3.47Å
341	P	59.2	Low	63.6	Low	103 Å²	103	104.4 Å²	104.4	67%	0.669	52%	0.523	S	S	*	.	H	α-helix	trans	-80.5	-27.7	176.4	25.3	-28.7	0	0	0	113
342	D	63.8	Low	63.1	Low	61 Å²	61	104.4 Å²	104.4	33%	0.326	53%	0.528	S	S	.	.	H	α-helix	trans	-77.3	-23.8	-172.5	-131.4	29.3	0	0	0	113	R346	D342-R346 WeakPolarHBondContact O-CB 3.43Å; D342-R346 VanDerWaalsContact O-CG 3.3Å; D342-R346 WeakPolarHBondContact O-CG 3.27Å; D342-R346 PolarHBondContact O-N 3.25Å; D342-R346 IonicContact OD2-CZ 3.86Å; D342-R346 IonicContact OD2-NE 2.86Å; D342-R346 PolarHBondContact OD2-NE 3.38Å; D342-R346 IonicContact OD2-NH2 3.9Å; D342-R346 PolarHBondContact OD2-NH2 3.31Å
343	Y	63.6	Low	63	Low	60 Å²	60	104.3 Å²	104.3	24%	0.235	53%	0.529	C	S	.	.	H	α-helix	trans	-73.1	-40.8	-179.2	87.3	-94.8	0	0	0	112.9	I336 Y340 L345 R346 L347	I336-Y343 HydrophobicContact CD1-CD2 4.39Å; I336-Y343 HydrophobicContact CD1-CG 4.1Å; Y340-Y343 HydrophobicContact CD1-CD1 4.45Å; Y340-Y343 AromaticContact CD1-CE1 3.62Å; Y340-Y343 HydrophobicContact CD1-CE1 3.62Å; Y340-Y343 HydrophobicContact CE1-CE1 4.03Å; Y340-Y343 HydrophobicContact CG-CE1 4.1Å; Y340-Y343 WeakPolarHBondContact O-CD1 3.5Å; Y340-Y343 WeakPolarHBondContact O-CE1 3.47Å; Y343-L345 VanDerWaalsContact C-N 3.31Å; Y343-L345 PolarHBondContact O-N 3.39Å; Y343-R346 PolarHBondContact O-N 3.44Å; Y343-L347 VanDerWaalsContact O-CB 3.23Å; Y343-L347 WeakPolarHBondContact O-CB 3.38Å; Y343-L347 PolarHBondContact O-N 3.27Å
344	K	63.3	Low	62.8	Low	136 Å²	136	96.8 Å²	96.8	59%	0.591	50%	0.503	S	S	*	.	H	α-helix	trans	-64	-40.9	179.5	-69.8	-170.1	-179.8	-179.1	0	110.5	L347 A348	K344-L347 PolarHBondContact O-N 2.92Å; K344-A348 VanDerWaalsContact O-CB 3.23Å; K344-A348 WeakPolarHBondContact O-CB 3.46Å; K344-A348 PolarHBondContact O-N 3.32Å
345	L	63.9	Low	62.8	Low	118 Å²	118	95.3 Å²	95.3	62%	0.618	48%	0.482	S	S	*	.	H	α-helix	trans	-68.6	-42.9	177.5	-174.5	64.5	0	0	0	112	Y343 L347 K349	Y343-L345 VanDerWaalsContact C-N 3.31Å; Y343-L345 PolarHBondContact O-N 3.39Å; L345-L347 VanDerWaalsContact C-N 3.34Å; L345-K349 VanDerWaalsContact O-CB 3.25Å; L345-K349 WeakPolarHBondContact O-CB 3.39Å; L345-K349 PolarHBondContact O-N 3.38Å
346	R	66.6	Low	62.6	Low	153 Å²	153	89.3 Å²	89.3	58%	0.577	45%	0.451	S	S	*	.	H	α-helix	trans	-63.8	-39.1	174.6	-76.9	178.1	-164.5	-169.6	7.6	112.4	D342 Y343 A350	D342-R346 WeakPolarHBondContact O-CB 3.43Å; D342-R346 VanDerWaalsContact O-CG 3.3Å; D342-R346 WeakPolarHBondContact O-CG 3.27Å; D342-R346 PolarHBondContact O-N 3.25Å; D342-R346 IonicContact OD2-CZ 3.86Å; D342-R346 IonicContact OD2-NE 2.86Å; D342-R346 PolarHBondContact OD2-NE 3.38Å; D342-R346 IonicContact OD2-NH2 3.9Å; D342-R346 PolarHBondContact OD2-NH2 3.31Å; Y343-R346 PolarHBondContact O-N 3.44Å; R346-A350 WeakPolarHBondContact O-CB 3.46Å; R346-A350 PolarHBondContact O-N 3.28Å
347	L	62	Low	63	Low	39 Å²	39	87.4 Å²	87.4	20%	0.204	44%	0.442	C	S	.	.	H	α-helix	trans	-68.6	-48.3	176.9	-175.8	65.1	0	0	0	111.1	F329 L332 Y343 K344 L345 K349 A350 T351	F329-L347 HydrophobicContact CD2-CD1 4.32Å; F329-L347 HydrophobicContact CD2-CD2 3.99Å; F329-L347 HydrophobicContact CE2-CD2 4.16Å; L332-L347 HydrophobicContact CD1-CD1 4.05Å; Y343-L347 VanDerWaalsContact O-CB 3.23Å; Y343-L347 WeakPolarHBondContact O-CB 3.38Å; Y343-L347 PolarHBondContact O-N 3.27Å; K344-L347 PolarHBondContact O-N 2.92Å; L345-L347 VanDerWaalsContact C-N 3.34Å; L347-K349 VanDerWaalsContact C-N 3.29Å; L347-K349 PolarHBondContact O-N 3.05Å; L347-A350 PolarHBondContact O-N 2.86Å; L347-A350 VanDerWaalsContact O-N 3.16Å; L347-T351 PolarHBondContact O-N 3.17Å; L347-T351 PolarHBondContact O-OG1 3.48Å
348	A	60.9	Low	63.6	Low	54 Å²	54	78.3 Å²	78.3	45%	0.446	40%	0.4	S	S	.	.	H	α-helix	trans	-58.5	-42.3	175.6	0	0	0	0	0	111.2	K344 T351 L352	K344-A348 VanDerWaalsContact O-CB 3.23Å; K344-A348 WeakPolarHBondContact O-CB 3.46Å; K344-A348 PolarHBondContact O-N 3.32Å; A348-T351 PolarHBondContact O-N 3.09Å; A348-L352 WeakPolarHBondContact O-CB 3.39Å; A348-L352 PolarHBondContact O-N 2.94Å
349	K	70.1	Confident	64.5	Low	154 Å²	154	73.5 Å²	73.5	67%	0.67	37%	0.367	S	S	*	.	H	α-helix	trans	-61.8	-45.7	174.8	-174	174.9	-179	173.5	0	111.8	L345 L347 T353	L345-K349 VanDerWaalsContact O-CB 3.25Å; L345-K349 WeakPolarHBondContact O-CB 3.39Å; L345-K349 PolarHBondContact O-N 3.38Å; L347-K349 VanDerWaalsContact C-N 3.29Å; L347-K349 PolarHBondContact O-N 3.05Å; K349-T353 WeakPolarHBondContact O-CB 3.07Å; K349-T353 PolarHBondContact O-N 3.43Å; K349-T353 PolarHBondContact O-OG1 3.38Å
350	A	67.2	Low	65.2	Low	26 Å²	26	67.4 Å²	67.4	22%	0.215	34%	0.339	C	S	.	.	H	α-helix	trans	-61.5	-53.2	176.4	0	0	0	0	0	110.8	R346 L347 L352 T353 L354	R346-A350 WeakPolarHBondContact O-CB 3.46Å; R346-A350 PolarHBondContact O-N 3.28Å; L347-A350 PolarHBondContact O-N 2.86Å; L347-A350 VanDerWaalsContact O-N 3.16Å; A350-L352 PolarHBondContact O-N 3.47Å; A350-T353 WeakPolarHBondContact O-CB 3.08Å; A350-T353 PolarHBondContact O-N 2.93Å; A350-L354 HydrophobicContact CB-CD1 4.48Å; A350-L354 WeakPolarHBondContact O-CD1 3.36Å; A350-L354 PolarHBondContact O-N 3.49Å
351	T	67.3	Low	66	Low	32 Å²	32	59.4 Å²	59.4	20%	0.196	31%	0.308	C	S	.	.	H	α-helix	trans	-61.4	-46.5	-178.8	-50.9	0	0	0	0	112.4	F321 L325 L347 A348 T353 L354 I355	F321-T351 HydrophobicContact CZ-CG2 4.34Å; L325-T351 HydrophobicContact CD1-CG2 4.49Å; L325-T351 WeakPolarHBondContact CD1-OG1 3.46Å; L325-T351 HydrophobicContact CD2-CG2 4.46Å; L347-T351 PolarHBondContact O-N 3.17Å; L347-T351 PolarHBondContact O-OG1 3.48Å; A348-T351 PolarHBondContact O-N 3.09Å; T351-T353 VanDerWaalsContact C-N 3.26Å; T351-T353 PolarHBondContact O-N 3.15Å; T351-L354 PolarHBondContact O-N 2.75Å; T351-I355 HydrophobicContact CG2-CD1 3.91Å; T351-I355 HydrophobicContact CG2-CG1 4.39Å; T351-I355 VanDerWaalsContact O-CG1 3.29Å; T351-I355 WeakPolarHBondContact O-CG1 3.43Å; T351-I355 PolarHBondContact O-N 3.16Å
352	L	65.7	Low	66.5	Low	130 Å²	130	55.4 Å²	55.4	68%	0.681	28%	0.28	S	S	*	.	H	α-helix	trans	-65.8	-30	179	-170.9	68.3	0	0	0	112.4	A348 A350 P356	A348-L352 WeakPolarHBondContact O-CB 3.39Å; A348-L352 PolarHBondContact O-N 2.94Å; A350-L352 PolarHBondContact O-N 3.47Å; L352-P356 WeakPolarHBondContact O-CD 3.43Å
353	T	66.8	Low	66.8	Low	42 Å²	42	53.1 Å²	53.1	26%	0.258	27%	0.268	S	S	.	.	H	α-helix	trans	-74.4	-39.3	174.1	-61.9	0	0	0	0	111.5	K349 A350 T351 L357 L399	K349-T353 WeakPolarHBondContact O-CB 3.07Å; K349-T353 PolarHBondContact O-N 3.43Å; K349-T353 PolarHBondContact O-OG1 3.38Å; A350-T353 WeakPolarHBondContact O-CB 3.08Å; A350-T353 PolarHBondContact O-N 2.93Å; T351-T353 VanDerWaalsContact C-N 3.26Å; T351-T353 PolarHBondContact O-N 3.15Å; T353-L357 WeakPolarHBondContact O-CB 3.49Å; T353-L399 HydrophobicContact CG2-CD1 3.4Å; T353-L399 HydrophobicContact CG2-CD2 3.42Å; T353-L399 VanDerWaalsContact CG2-CD2 3.42Å; T353-L399 HydrophobicContact CG2-CG 3.94Å
354	L	67.7	Low	67	Low	25 Å²	25	55.3 Å²	55.3	13%	0.131	28%	0.283	C	S	.	.	H	α-helix	trans	-77.3	-31.7	-178.2	-85.6	84.1	0	0	0	112.9	F321 I324 I328 A350 T351 L357 F358	F321-L354 HydrophobicContact CD2-CB 4.18Å; F321-L354 HydrophobicContact CD2-CD2 4.09Å; F321-L354 HydrophobicContact CE2-CB 3.51Å; F321-L354 HydrophobicContact CE2-CD2 3.88Å; F321-L354 HydrophobicContact CE2-CG 4.35Å; F321-L354 HydrophobicContact CZ-CB 4.47Å; I324-L354 HydrophobicContact CG2-CD2 4.36Å; I328-L354 HydrophobicContact CD1-CD2 4.47Å; A350-L354 HydrophobicContact CB-CD1 4.48Å; A350-L354 WeakPolarHBondContact O-CD1 3.36Å; A350-L354 PolarHBondContact O-N 3.49Å; T351-L354 PolarHBondContact O-N 2.75Å; L354-L357 CarbonylContact O-C 3.45Å; L354-L357 WeakPolarHBondContact O-CA 3.35Å; L354-L357 VanDerWaalsContact O-CB 3.3Å; L354-L357 WeakPolarHBondContact O-CB 3.39Å; L354-L357 PolarHBondContact O-N 3.12Å; L354-F358 HydrophobicContact CB-CD2 3.95Å; L354-F358 HydrophobicContact CB-CE2 4.07Å; L354-F358 HydrophobicContact CD2-CD2 4.13Å; L354-F358 HydrophobicContact CD2-CE2 3.49Å; L354-F358 VanDerWaalsContact CD2-CE2 3.49Å; L354-F358 HydrophobicContact CD2-CZ 4.35Å; L354-F358 HydrophobicContact CG-CD2 4.15Å; L354-F358 HydrophobicContact CG-CE2 3.73Å; L354-F358 VanDerWaalsContact O-CD2 3.3Å; L354-F358 WeakPolarHBondContact O-CD2 3.45Å; L354-F358 PolarHBondContact O-N 2.72Å
355	I	69.5	Low	67.2	Low	55 Å²	55	51 Å²	51	28%	0.282	26%	0.264	S	S	.	.	H	α-helix	trans	-57.6	-49.7	-177	-73.4	162	0	0	0	113.3	F321 T351 L357 V360	F321-I355 HydrophobicContact CZ-CG1 4.16Å; T351-I355 HydrophobicContact CG2-CD1 3.91Å; T351-I355 HydrophobicContact CG2-CG1 4.39Å; T351-I355 VanDerWaalsContact O-CG1 3.29Å; T351-I355 WeakPolarHBondContact O-CG1 3.43Å; T351-I355 PolarHBondContact O-N 3.16Å; I355-L357 PolarHBondContact O-N 2.98Å; I355-V360 PolarHBondContact O-N 3.4Å
356	P	61.9	Low	67.2	Low	22 Å²	22	47.3 Å²	47.3	14%	0.143	25%	0.245	C	C	.	.	H	α-helix	trans	-67.2	-27.7	173.9	-18.7	31.9	0	0	0	112.7	L352 Q392 L395	L352-P356 WeakPolarHBondContact O-CD 3.43Å; P356-Q392 WeakPolarHBondContact O-CG 3.35Å; P356-Q392 PolarHBondContact O-NE2 3.48Å; P356-L395 HydrophobicContact CB-CD1 3.78Å; P356-L395 HydrophobicContact CG-CD1 3.97Å
357	L	66.8	Low	67.1	Low	10 Å²	10	47.1 Å²	47.1	5%	0.052	25%	0.248	C	C	.	.	H	α-helix	trans	-77.8	-20.7	-175.5	-159.1	62.7	0	0	0	113.7	F241 T353 L354 I355 V396 L399 Y400	F241-L357 WeakPolarHBondContact CD1-O 3.25Å; F241-L357 WeakPolarHBondContact CE1-O 3.31Å; T353-L357 WeakPolarHBondContact O-CB 3.49Å; L354-L357 CarbonylContact O-C 3.45Å; L354-L357 WeakPolarHBondContact O-CA 3.35Å; L354-L357 VanDerWaalsContact O-CB 3.3Å; L354-L357 WeakPolarHBondContact O-CB 3.39Å; L354-L357 PolarHBondContact O-N 3.12Å; I355-L357 PolarHBondContact O-N 2.98Å; L357-V396 HydrophobicContact CD1-CB 4.48Å; L357-V396 HydrophobicContact CD1-CG2 3.84Å; L357-L399 HydrophobicContact CD1-CD1 4.43Å; L357-Y400 HydrophobicContact CD1-CD2 4.02Å; L357-Y400 HydrophobicContact CD1-CE1 4.38Å; L357-Y400 HydrophobicContact CD1-CE2 3.29Å; L357-Y400 HydrophobicContact CD2-CE1 4.04Å; L357-Y400 HydrophobicContact CD2-CE2 4.29Å; L357-Y400 WeakPolarHBondContact CD2-OH 3.12Å; L357-Y400 HydrophobicContact CG-CE2 3.97Å; L357-Y400 VanDerWaalsContact CG-OH 3.27Å; L357-Y400 WeakPolarHBondContact CG-OH 3.22Å
358	F	67.2	Low	66.9	Low	9 Å²	9	47.3 Å²	47.3	4%	0.039	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	5.6	178.6	-77.3	-86.4	0	0	0	113.1	A245 L248 F321 I324 L354 V360	A245-F358 HydrophobicContact CB-CD1 3.92Å; A245-F358 HydrophobicContact CB-CE1 3.74Å; L248-F358 HydrophobicContact CD1-CE1 4.28Å; L248-F358 HydrophobicContact CD1-CZ 3.65Å; F321-F358 HydrophobicContact CB-CG 4.41Å; F321-F358 AromaticContact CD2-CD2 3.86Å; F321-F358 HydrophobicContact CD2-CD2 3.86Å; F321-F358 HydrophobicContact CD2-CE2 4.32Å; F321-F358 HydrophobicContact CD2-CG 4.21Å; I324-F358 HydrophobicContact CD1-CE1 4.37Å; I324-F358 HydrophobicContact CD1-CZ 4.17Å; L354-F358 HydrophobicContact CB-CD2 3.95Å; L354-F358 HydrophobicContact CB-CE2 4.07Å; L354-F358 HydrophobicContact CD2-CD2 4.13Å; L354-F358 HydrophobicContact CD2-CE2 3.49Å; L354-F358 VanDerWaalsContact CD2-CE2 3.49Å; L354-F358 HydrophobicContact CD2-CZ 4.35Å; L354-F358 HydrophobicContact CG-CD2 4.15Å; L354-F358 HydrophobicContact CG-CE2 3.73Å; L354-F358 VanDerWaalsContact O-CD2 3.3Å; L354-F358 WeakPolarHBondContact O-CD2 3.45Å; L354-F358 PolarHBondContact O-N 2.72Å; F358-V360 HydrophobicContact CB-CG2 3.83Å; F358-V360 PolarHBondContact O-N 3.25Å
359	G	68.4	Low	66.5	Low	5 Å²	5	47.4 Å²	47.4	5%	0.052	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.1	15.3	-178.2	0	0	0	0	0	113.9	H361 E362	G359-H361 PolarHBondContact O-N 3.5Å; G359-H361 VanDerWaalsContact O-N 3.16Å; G359-E362 WeakPolarHBondContact O-CB 3.42Å; G359-E362 PolarHBondContact O-N 3.09Å
360	V	70.3	Confident	65.7	Low	6 Å²	6	44.3 Å²	44.3	4%	0.036	24%	0.242	C	C	.	.	H	α-helix	trans	-62	-29.1	-174.9	173.2	0	0	0	0	112.1	F318 F321 I355 F358 E362 V363 I364	F318-V360 HydrophobicContact CD2-CB 4.46Å; F318-V360 HydrophobicContact CD2-CG1 3.57Å; F318-V360 HydrophobicContact CD2-CG2 4.11Å; F318-V360 HydrophobicContact CE2-CG1 3.82Å; F321-V360 HydrophobicContact CB-CG2 4.36Å; F321-V360 HydrophobicContact CD1-CG2 4.01Å; F321-V360 HydrophobicContact CG-CG2 4.12Å; I355-V360 PolarHBondContact O-N 3.4Å; F358-V360 HydrophobicContact CB-CG2 3.83Å; F358-V360 PolarHBondContact O-N 3.25Å; V360-E362 PolarHBondContact O-N 3.32Å; V360-V363 WeakPolarHBondContact O-CB 3.49Å; V360-V363 PolarHBondContact O-N 2.89Å; V360-V363 VanDerWaalsContact O-N 3.12Å; V360-I364 HydrophobicContact CG1-CD1 4.36Å; V360-I364 PolarHBondContact O-N 3.45Å
361	H	74.4	Confident	64.8	Low	8 Å²	8	52 Å²	52	4%	0.037	27%	0.273	C	S	.	.	H	α-helix	trans	-56.3	-37.1	175.2	70.3	-79.8	0	0	0	112.1	G359 V363 I364 F365 I388	G359-H361 PolarHBondContact O-N 3.5Å; G359-H361 VanDerWaalsContact O-N 3.16Å; H361-V363 VanDerWaalsContact C-N 3.34Å; H361-V363 PolarHBondContact O-N 3.2Å; H361-I364 PolarHBondContact O-N 3.16Å; H361-F365 HydrophobicContact CB-CE2 4.41Å; H361-F365 WeakPolarHBondContact O-CD2 2.97Å; H361-F365 PolarHBondContact O-N 3.28Å; H361-F365 VanDerWaalsContact O-N 3.17Å; H361-I388 HydrophobicContact CB-CD1 4.35Å; H361-I388 HydrophobicContact CB-CG2 4.31Å; H361-I388 WeakPolarHBondContact CD2-CG2 3.38Å; H361-I388 WeakPolarHBondContact NE2-CG2 3.43Å
362	E	69.4	Low	63.8	Low	19 Å²	19	58 Å²	58	9%	0.089	30%	0.299	C	S	.	.	H	α-helix	trans	-66.3	-36.8	179	-65.9	176.9	153.6	0	0	111.4	R186 H238 G359 V360 I364 F365 I366	R186-E362 IonicContact NH1-OE1 3.91Å; R186-E362 IonicContact NH2-OE1 3.75Å; R186-E362 PolarHBondContact NH2-OE1 3.16Å; H238-E362 IonicContact CD2-OE2 2.84Å; H238-E362 PolarHBondContact CD2-OE2 3.15Å; H238-E362 IonicContact CE1-OE1 3.87Å; H238-E362 IonicContact CE1-OE2 3.48Å; H238-E362 IonicContact NE2-OE1 2.84Å; H238-E362 IonicContact NE2-OE2 3.5Å; H238-E362 PolarHBondContact NE2-OE2 3.18Å; G359-E362 WeakPolarHBondContact O-CB 3.42Å; G359-E362 PolarHBondContact O-N 3.09Å; V360-E362 PolarHBondContact O-N 3.32Å; E362-I364 PolarHBondContact O-N 3Å; E362-F365 PolarHBondContact O-N 2.9Å; E362-I366 HydrophobicContact CB-CD1 4.38Å; E362-I366 VanDerWaalsContact O-CB 3.31Å; E362-I366 WeakPolarHBondContact O-CB 3.37Å; E362-I366 VanDerWaalsContact O-CD1 3.22Å; E362-I366 WeakPolarHBondContact O-CD1 3.49Å; E362-I366 WeakPolarHBondContact O-CG1 3.37Å; E362-I366 PolarHBondContact O-N 3.45Å
363	V	68.9	Low	63.1	Low	13 Å²	13	52.9 Å²	52.9	8%	0.079	27%	0.273	C	S	.	.	H	α-helix	trans	-61.9	-45.1	175.6	179.9	0	0	0	0	111.2	V360 H361 F365 I366 F367	V360-V363 WeakPolarHBondContact O-CB 3.49Å; V360-V363 PolarHBondContact O-N 2.89Å; V360-V363 VanDerWaalsContact O-N 3.12Å; H361-V363 VanDerWaalsContact C-N 3.34Å; H361-V363 PolarHBondContact O-N 3.2Å; V363-F365 VanDerWaalsContact C-N 3.33Å; V363-F365 PolarHBondContact O-N 2.02Å; V363-I366 PolarHBondContact O-N 2.94Å; V363-F367 HydrophobicContact CG1-CD2 3.6Å; V363-F367 HydrophobicContact CG1-CE2 3.61Å; V363-F367 WeakPolarHBondContact O-CD2 3.41Å; V363-F367 PolarHBondContact O-N 3.45Å; V363-F367 VanDerWaalsContact O-N 3.08Å
364	I	68.8	Low	62.6	Low	106 Å²	106	57 Å²	57	54%	0.544	30%	0.298	S	S	.	.	H	α-helix	trans	-60.3	-44.4	179.3	-62.2	170.9	0	0	0	110.4	V360 H361 E362 A368	V360-I364 HydrophobicContact CG1-CD1 4.36Å; V360-I364 PolarHBondContact O-N 3.45Å; H361-I364 PolarHBondContact O-N 3.16Å; E362-I364 PolarHBondContact O-N 3Å; I364-A368 PolarHBondContact O-N 3.37Å
365	F	67.4	Low	62.6	Low	45 Å²	45	57.9 Å²	57.9	20%	0.197	31%	0.313	C	S	.	.	H	α-helix	trans	-77	-23.2	179.9	-67.8	-62.9	0	0	0	113.9	H361 E362 V363 A368 K381 F384 I388	H361-F365 HydrophobicContact CB-CE2 4.41Å; H361-F365 WeakPolarHBondContact O-CD2 2.97Å; H361-F365 PolarHBondContact O-N 3.28Å; H361-F365 VanDerWaalsContact O-N 3.17Å; E362-F365 PolarHBondContact O-N 2.9Å; V363-F365 VanDerWaalsContact C-N 3.33Å; V363-F365 PolarHBondContact O-N 2.02Å; F365-A368 VanDerWaalsContact O-O 3.13Å; F365-K381 HydrophobicContact CD1-CG 4.15Å; F365-K381 WeakPolarHBondContact O-CE 3.31Å; F365-K381 PolarHBondContact O-NZ 3.36Å; F365-F384 HydrophobicContact CE1-CB 4.09Å; F365-F384 HydrophobicContact CE2-CB 4.25Å; F365-F384 HydrophobicContact CZ-CB 3.62Å; F365-F384 HydrophobicContact CZ-CG 4.34Å; F365-I388 HydrophobicContact CE2-CD1 4.08Å
366	I	64.9	Low	62.7	Low	41 Å²	41	61.1 Å²	61.1	21%	0.21	33%	0.33	C	S	.	.	H	α-helix	trans	-73	-45.9	174.9	-76.7	159.5	0	0	0	111.3	L311 E362 V363 A368	L311-I366 HydrophobicContact CD1-CG2 4.24Å; L311-I366 HydrophobicContact CD2-CB 4.24Å; L311-I366 HydrophobicContact CD2-CD1 3.28Å; L311-I366 HydrophobicContact CD2-CG1 3.94Å; L311-I366 HydrophobicContact CD2-CG2 3.44Å; L311-I366 VanDerWaalsContact CD2-CG2 3.44Å; L311-I366 HydrophobicContact CG-CG2 4.47Å; E362-I366 HydrophobicContact CB-CD1 4.38Å; E362-I366 VanDerWaalsContact O-CB 3.31Å; E362-I366 WeakPolarHBondContact O-CB 3.37Å; E362-I366 VanDerWaalsContact O-CD1 3.22Å; E362-I366 WeakPolarHBondContact O-CD1 3.49Å; E362-I366 WeakPolarHBondContact O-CG1 3.37Å; E362-I366 PolarHBondContact O-N 3.45Å; V363-I366 PolarHBondContact O-N 2.94Å; I366-A368 VanDerWaalsContact C-N 3.25Å; I366-A368 PolarHBondContact O-N 3.03Å
367	F	62.7	Low	63.2	Low	148 Å²	148	64.9 Å²	64.9	65%	0.649	35%	0.349	S	S	*	.	H	α-helix	trans	-71.9	-21.5	179.5	-79.4	-70.9	0	0	0	112.5	V363 T369	V363-F367 HydrophobicContact CG1-CD2 3.6Å; V363-F367 HydrophobicContact CG1-CE2 3.61Å; V363-F367 WeakPolarHBondContact O-CD2 3.41Å; V363-F367 PolarHBondContact O-N 3.45Å; V363-F367 VanDerWaalsContact O-N 3.08Å; F367-T369 PolarHBondContact O-N 2.95Å
368	A	59.2	Low	63.6	Low	44 Å²	44	71.8 Å²	71.8	36%	0.364	37%	0.374	S	S	.	.	S	Bend	trans	-70.2	81.6	159.2	0	0	0	0	0	109.3	I364 F365 I366 K381	I364-A368 PolarHBondContact O-N 3.37Å; F365-A368 VanDerWaalsContact O-O 3.13Å; I366-A368 VanDerWaalsContact C-N 3.25Å; I366-A368 PolarHBondContact O-N 3.03Å; A368-K381 PolarHBondContact O-NZ 3.09Å
369	T	51.9	Low	64.2	Low	56 Å²	56	74.1 Å²	74.1	34%	0.344	38%	0.383	S	S	.	.			trans	-52.1	136.5	-173.4	43.5	0	0	0	0	113.7	F367 E371 Q372	F367-T369 PolarHBondContact O-N 2.95Å; T369-E371 PolarHBondContact O-N 3.16Å; T369-Q372 PolarHBondContact O-N 3.02Å
370	D	52.6	Low	64.7	Low	89 Å²	89	77.3 Å²	77.3	48%	0.476	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-22.8	172.4	-81.5	-25.2	0	0	0	113	Q372 K381	D370-Q372 VanDerWaalsContact C-N 3.32Å; D370-Q372 PolarHBondContact O-N 3.4Å; D370-K381 IonicContact OD1-NZ 3.45Å; D370-K381 PolarHBondContact OD1-NZ 3.34Å
371	E	48.8	Very low	65.2	Low	186 Å²	186	78.3 Å²	78.3	87%	0.869	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-23.2	176.8	-97	175.4	165	0	0	113.9	T369	T369-E371 PolarHBondContact O-N 3.16Å
372	Q	46.6	Very low	65.5	Low	160 Å²	160	80.1 Å²	80.1	75%	0.748	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-9.9	-179.2	-73.9	-178.4	-11.1	0	0	113.5	T369 D370	T369-Q372 PolarHBondContact O-N 3.02Å; D370-Q372 VanDerWaalsContact C-N 3.32Å; D370-Q372 PolarHBondContact O-N 3.4Å
373	T	50	Low	66.3	Low	21 Å²	21	82.9 Å²	82.9	13%	0.129	43%	0.425	C	S	.	.			trans	-110.3	77.4	-172.8	59	0	0	0	0	111.4	L377	T373-L377 HydrophobicContact CG2-CB 3.92Å; T373-L377 HydrophobicContact CG2-CD1 4.48Å
374	T	57.4	Low	67	Low	128 Å²	128	86.6 Å²	86.6	79%	0.785	44%	0.441	S	S	*	.			trans	-82.3	141.2	166.5	48.4	0	0	0	0	110.6
375	G	67.9	Low	67.7	Low	44 Å²	44	83.6 Å²	83.6	45%	0.454	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	-130.5	174	0	0	0	0	0	115.1	L377 R378 Y379	G375-L377 VanDerWaalsContact C-N 3.33Å; G375-L377 PolarHBondContact O-N 3.25Å; G375-R378 WeakPolarHBondContact O-CB 3.49Å; G375-R378 PolarHBondContact O-N 3.23Å; G375-Y379 VanDerWaalsContact O-CD2 3.32Å; G375-Y379 WeakPolarHBondContact O-CD2 3.29Å
376	L	71.9	Confident	68.6	Low	123 Å²	123	83.8 Å²	83.8	64%	0.644	43%	0.43	S	S	*	.	H	α-helix	trans	-57.1	-38.6	-169.6	-174.7	66.4	0	0	0	113.9	R378 Y379 I380	L376-R378 VanDerWaalsContact C-N 3.28Å; L376-R378 PolarHBondContact O-N 3.26Å; L376-Y379 PolarHBondContact O-N 3.3Å; L376-Y379 VanDerWaalsContact O-N 3.15Å; L376-I380 HydrophobicContact CD2-CD1 4.34Å; L376-I380 HydrophobicContact CG-CD1 3.92Å; L376-I380 HydrophobicContact CG-CG1 4.43Å; L376-I380 WeakPolarHBondContact O-CG1 3.44Å; L376-I380 PolarHBondContact O-N 3.01Å
377	L	70.9	Confident	69.8	Low	102 Å²	102	85.8 Å²	85.8	53%	0.534	44%	0.438	S	S	.	.	H	α-helix	trans	-63.1	-34.1	-178.9	-70.3	174.4	0	0	0	112.6	T373 G375 I380 K381	T373-L377 HydrophobicContact CG2-CB 3.92Å; T373-L377 HydrophobicContact CG2-CD1 4.48Å; G375-L377 VanDerWaalsContact C-N 3.33Å; G375-L377 PolarHBondContact O-N 3.25Å; L377-I380 PolarHBondContact O-N 3.22Å; L377-K381 VanDerWaalsContact O-CB 3.3Å; L377-K381 WeakPolarHBondContact O-CB 3.46Å; L377-K381 PolarHBondContact O-N 3.01Å
378	R	76.4	Confident	71	Confident	154 Å²	154	80.7 Å²	80.7	58%	0.581	42%	0.417	S	S	*	.	H	α-helix	trans	-64.2	-44.5	174.6	-176.5	176.1	174.7	175.5	-1.6	111	G375 L376 K381 V382	G375-R378 WeakPolarHBondContact O-CB 3.49Å; G375-R378 PolarHBondContact O-N 3.23Å; L376-R378 VanDerWaalsContact C-N 3.28Å; L376-R378 PolarHBondContact O-N 3.26Å; R378-K381 PolarHBondContact O-N 2.94Å; R378-V382 HydrophobicContact CG-CG2 4.47Å; R378-V382 WeakPolarHBondContact O-CB 3.42Å; R378-V382 VanDerWaalsContact O-CG2 3.23Å; R378-V382 WeakPolarHBondContact O-CG2 3.42Å; R378-V382 PolarHBondContact O-N 3.29Å
379	Y	78.9	Confident	72.3	Confident	59 Å²	59	78.9 Å²	78.9	23%	0.231	40%	0.401	C	S	.	.	H	α-helix	trans	-64.3	-42.4	178.1	-65.5	-66.7	0	0	0	112	W132 L136 F140 G375 L376 V382 F383	W132-Y379 HydrophobicContact CH2-CD2 4.03Å; W132-Y379 AromaticContact CH2-CE2 3.41Å; W132-Y379 HydrophobicContact CH2-CE2 3.41Å; W132-Y379 VanDerWaalsContact CH2-CE2 3.41Å; W132-Y379 AromaticContact CH2-CZ 3.85Å; W132-Y379 HydrophobicContact CZ2-CE2 4.5Å; W132-Y379 HydrophobicContact CZ3-CD2 4.18Å; W132-Y379 AromaticContact CZ3-CE2 3.83Å; W132-Y379 HydrophobicContact CZ3-CE2 3.83Å; L136-Y379 HydrophobicContact CD2-CD1 3.56Å; L136-Y379 HydrophobicContact CD2-CE1 4.11Å; L136-Y379 HydrophobicContact CD2-CG 3.81Å; F140-Y379 HydrophobicContact CE2-CD1 4.22Å; G375-Y379 VanDerWaalsContact O-CD2 3.32Å; G375-Y379 WeakPolarHBondContact O-CD2 3.29Å; L376-Y379 PolarHBondContact O-N 3.3Å; L376-Y379 VanDerWaalsContact O-N 3.15Å; Y379-V382 PolarHBondContact O-N 2.97Å; Y379-F383 WeakPolarHBondContact O-CB 3.23Å; Y379-F383 PolarHBondContact O-N 3.1Å
380	I	79.6	Confident	74.2	Confident	71 Å²	71	76.2 Å²	76.2	36%	0.364	39%	0.385	S	S	.	.	H	α-helix	trans	-61.1	-47.6	175.4	-67.9	170.7	0	0	0	110.7	L376 L377 V382 F383 F384	L376-I380 HydrophobicContact CD2-CD1 4.34Å; L376-I380 HydrophobicContact CG-CD1 3.92Å; L376-I380 HydrophobicContact CG-CG1 4.43Å; L376-I380 WeakPolarHBondContact O-CG1 3.44Å; L376-I380 PolarHBondContact O-N 3.01Å; L377-I380 PolarHBondContact O-N 3.22Å; I380-V382 PolarHBondContact O-N 3.5Å; I380-F383 WeakPolarHBondContact O-CB 3.38Å; I380-F383 PolarHBondContact O-N 2.78Å; I380-F384 HydrophobicContact CG2-CD2 3.62Å; I380-F384 HydrophobicContact CG2-CE2 3.62Å; I380-F384 VanDerWaalsContact O-CD2 3.3Å; I380-F384 WeakPolarHBondContact O-CD2 3.41Å; I380-F384 PolarHBondContact O-N 3.49Å
381	K	79.9	Confident	76	Confident	28 Å²	28	73.9 Å²	73.9	12%	0.122	37%	0.371	C	S	.	.	H	α-helix	trans	-58.5	-48.2	176.9	174.9	-178.7	171.1	179	0	111.5	F365 A368 D370 L377 R378 F384 T385	F365-K381 HydrophobicContact CD1-CG 4.15Å; F365-K381 WeakPolarHBondContact O-CE 3.31Å; F365-K381 PolarHBondContact O-NZ 3.36Å; A368-K381 PolarHBondContact O-NZ 3.09Å; D370-K381 IonicContact OD1-NZ 3.45Å; D370-K381 PolarHBondContact OD1-NZ 3.34Å; L377-K381 VanDerWaalsContact O-CB 3.3Å; L377-K381 WeakPolarHBondContact O-CB 3.46Å; L377-K381 PolarHBondContact O-N 3.01Å; R378-K381 PolarHBondContact O-N 2.94Å; K381-F384 PolarHBondContact O-N 3.45Å; K381-T385 VanDerWaalsContact O-CB 3.27Å; K381-T385 WeakPolarHBondContact O-CB 3.38Å; K381-T385 PolarHBondContact O-N 3.36Å; K381-T385 PolarHBondContact O-OG1 3.47Å
382	V	81.6	Confident	78	Confident	46 Å²	46	65 Å²	65	28%	0.279	33%	0.329	S	S	.	.	H	α-helix	trans	-61.1	-45.6	178.2	169.1	0	0	0	0	110.5	F140 R378 Y379 I380 T385 L386	F140-V382 HydrophobicContact CD2-CG1 3.87Å; F140-V382 HydrophobicContact CE2-CB 4.4Å; F140-V382 HydrophobicContact CE2-CG1 3.98Å; R378-V382 HydrophobicContact CG-CG2 4.47Å; R378-V382 WeakPolarHBondContact O-CB 3.42Å; R378-V382 VanDerWaalsContact O-CG2 3.23Å; R378-V382 WeakPolarHBondContact O-CG2 3.42Å; R378-V382 PolarHBondContact O-N 3.29Å; Y379-V382 PolarHBondContact O-N 2.97Å; I380-V382 PolarHBondContact O-N 3.5Å; V382-T385 PolarHBondContact O-N 3.17Å; V382-L386 HydrophobicContact CG1-CD1 3.51Å; V382-L386 HydrophobicContact CG1-CG 4.18Å; V382-L386 WeakPolarHBondContact O-CB 3.36Å; V382-L386 VanDerWaalsContact O-CG 3.24Å; V382-L386 WeakPolarHBondContact O-CG 3.32Å; V382-L386 PolarHBondContact O-N 2.02Å
383	F	85.6	Confident	80.2	Confident	76 Å²	76	57.5 Å²	57.5	33%	0.333	29%	0.294	S	S	.	.	H	α-helix	trans	-56.5	-55.1	176.9	173.9	-97	0	0	0	111.9	F140 L143 Y379 I380 T385 L386 F387	F140-F383 HydrophobicContact CD1-CB 4.46Å; F140-F383 AromaticContact CD1-CD2 3.93Å; F140-F383 HydrophobicContact CD1-CD2 3.93Å; F140-F383 HydrophobicContact CE1-CB 3.75Å; F140-F383 AromaticContact CE1-CD2 3.6Å; F140-F383 HydrophobicContact CE1-CD2 3.6Å; F140-F383 HydrophobicContact CE1-CG 4.13Å; F140-F383 HydrophobicContact CZ-CB 3.87Å; L143-F383 HydrophobicContact CD2-CD2 3.78Å; L143-F383 HydrophobicContact CD2-CE2 3.41Å; L143-F383 VanDerWaalsContact CD2-CE2 3.41Å; L143-F383 HydrophobicContact CD2-CZ 4.21Å; Y379-F383 WeakPolarHBondContact O-CB 3.23Å; Y379-F383 PolarHBondContact O-N 3.1Å; I380-F383 WeakPolarHBondContact O-CB 3.38Å; I380-F383 PolarHBondContact O-N 2.78Å; F383-T385 VanDerWaalsContact C-N 3.34Å; F383-T385 PolarHBondContact O-N 3.23Å; F383-L386 PolarHBondContact O-N 3.37Å; F383-F387 WeakPolarHBondContact O-CB 3.46Å; F383-F387 PolarHBondContact O-N 2.93Å
384	F	83.9	Confident	82.3	Confident	92 Å²	92	58.2 Å²	58.2	40%	0.404	30%	0.297	S	S	.	.	H	α-helix	trans	-64.3	-38.8	-179	-80.5	-67.1	0	0	0	112.4	F365 I380 K381 I388	F365-F384 HydrophobicContact CE1-CB 4.09Å; F365-F384 HydrophobicContact CE2-CB 4.25Å; F365-F384 HydrophobicContact CZ-CB 3.62Å; F365-F384 HydrophobicContact CZ-CG 4.34Å; I380-F384 HydrophobicContact CG2-CD2 3.62Å; I380-F384 HydrophobicContact CG2-CE2 3.62Å; I380-F384 VanDerWaalsContact O-CD2 3.3Å; I380-F384 WeakPolarHBondContact O-CD2 3.41Å; I380-F384 PolarHBondContact O-N 3.49Å; K381-F384 PolarHBondContact O-N 3.45Å; F384-I388 WeakPolarHBondContact O-CB 3.25Å; F384-I388 VanDerWaalsContact O-CG1 3.25Å; F384-I388 WeakPolarHBondContact O-CG1 2.96Å; F384-I388 PolarHBondContact O-N 2.87Å
385	T	84	Confident	83.9	Confident	42 Å²	42	55.6 Å²	55.6	26%	0.258	28%	0.278	S	S	.	.	H	α-helix	trans	-62.7	-49.6	177.8	-57.7	0	0	0	0	110.8	K381 V382 F383 S389	K381-T385 VanDerWaalsContact O-CB 3.27Å; K381-T385 WeakPolarHBondContact O-CB 3.38Å; K381-T385 PolarHBondContact O-N 3.36Å; K381-T385 PolarHBondContact O-OG1 3.47Å; V382-T385 PolarHBondContact O-N 3.17Å; F383-T385 VanDerWaalsContact C-N 3.34Å; F383-T385 PolarHBondContact O-N 3.23Å; T385-S389 WeakPolarHBondContact O-CB 3.33Å; T385-S389 PolarHBondContact O-N 2.94Å
386	L	86.8	Confident	85	Confident	50 Å²	50	53.5 Å²	53.5	26%	0.262	26%	0.257	S	S	.	.	H	α-helix	trans	-68	-40.4	-179.8	-68.6	174.2	0	0	0	112.2	F140 Y144 V382 F383 S390	F140-L386 HydrophobicContact CB-CD1 4.08Å; Y144-L386 HydrophobicContact CD1-CD1 4.08Å; Y144-L386 HydrophobicContact CD1-CD2 4.16Å; V382-L386 HydrophobicContact CG1-CD1 3.51Å; V382-L386 HydrophobicContact CG1-CG 4.18Å; V382-L386 WeakPolarHBondContact O-CB 3.36Å; V382-L386 VanDerWaalsContact O-CG 3.24Å; V382-L386 WeakPolarHBondContact O-CG 3.32Å; V382-L386 PolarHBondContact O-N 2.02Å; F383-L386 PolarHBondContact O-N 3.37Å; L386-S390 VanDerWaalsContact O-CB 3.24Å; L386-S390 WeakPolarHBondContact O-CB 3.4Å; L386-S390 PolarHBondContact O-N 2.77Å; L386-S390 PolarHBondContact O-OG 2.88Å
387	F	88.9	Confident	85.9	Confident	82 Å²	82	47.7 Å²	47.7	36%	0.36	23%	0.226	S	C	.	.	H	α-helix	trans	-61.8	-56.7	176.3	-179.6	-100.5	0	0	0	110.8	L143 F383 S389 S390 F391	L143-F387 HydrophobicContact CD1-CD2 4.02Å; L143-F387 HydrophobicContact CD1-CE2 4.43Å; L143-F387 HydrophobicContact CD2-CB 4.17Å; L143-F387 HydrophobicContact CD2-CD2 4.03Å; L143-F387 HydrophobicContact CG-CD2 4.23Å; F383-F387 WeakPolarHBondContact O-CB 3.46Å; F383-F387 PolarHBondContact O-N 2.93Å; F387-S389 VanDerWaalsContact C-N 3.32Å; F387-S389 PolarHBondContact O-N 2.91Å; F387-S390 PolarHBondContact O-N 2.98Å; F387-S390 PolarHBondContact O-OG 3.33Å; F387-F391 AromaticContact CD2-CD2 3.82Å; F387-F391 HydrophobicContact CD2-CD2 3.82Å; F387-F391 AromaticContact CD2-CE2 3.71Å; F387-F391 HydrophobicContact CD2-CE2 3.71Å; F387-F391 AromaticContact CE2-CD2 3.72Å; F387-F391 HydrophobicContact CE2-CD2 3.72Å; F387-F391 AromaticContact CE2-CE2 3.52Å; F387-F391 HydrophobicContact CE2-CE2 3.52Å; F387-F391 HydrophobicContact CE2-CZ 4.37Å; F387-F391 HydrophobicContact CG-CD2 4.39Å; F387-F391 HydrophobicContact CZ-CD2 4.19Å; F387-F391 HydrophobicContact CZ-CE2 4.35Å; F387-F391 WeakPolarHBondContact O-CD2 3.45Å; F387-F391 PolarHBondContact O-N 3.14Å
388	I	87.4	Confident	86.9	Confident	42 Å²	42	45.8 Å²	45.8	22%	0.215	22%	0.218	C	C	.	.	H	α-helix	trans	-63.5	-43.1	-176.6	-62.1	168.3	0	0	0	110.1	H361 F365 F384 S390 F391 Q392	H361-I388 HydrophobicContact CB-CD1 4.35Å; H361-I388 HydrophobicContact CB-CG2 4.31Å; H361-I388 WeakPolarHBondContact CD2-CG2 3.38Å; H361-I388 WeakPolarHBondContact NE2-CG2 3.43Å; F365-I388 HydrophobicContact CE2-CD1 4.08Å; F384-I388 WeakPolarHBondContact O-CB 3.25Å; F384-I388 VanDerWaalsContact O-CG1 3.25Å; F384-I388 WeakPolarHBondContact O-CG1 2.96Å; F384-I388 PolarHBondContact O-N 2.87Å; I388-S390 PolarHBondContact O-N 3.06Å; I388-F391 PolarHBondContact O-N 2.96Å; I388-Q392 WeakPolarHBondContact O-CB 3.41Å; I388-Q392 PolarHBondContact O-N 2.71Å
389	S	86.9	Confident	87.4	Confident	5 Å²	5	41 Å²	41	4%	0.035	20%	0.204	C	C	.	.	H	α-helix	trans	-63.5	-39.5	-179.6	-174.8	0	0	0	0	113.4	Y148 R186 T385 F387	Y148-S389 PolarHBondContact OH-OG 2.95Å; R186-S389 PolarHBondContact NH2-OG 2.98Å; T385-S389 WeakPolarHBondContact O-CB 3.33Å; T385-S389 PolarHBondContact O-N 2.94Å; F387-S389 VanDerWaalsContact C-N 3.32Å; F387-S389 PolarHBondContact O-N 2.91Å
390	S	91.5	Very high	87.7	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-71.6	-37.1	-178.9	59.7	0	0	0	0	113	G147 L386 F387 I388	G147-S390 CarbonylContact C-O 3.56Å; L386-S390 VanDerWaalsContact O-CB 3.24Å; L386-S390 WeakPolarHBondContact O-CB 3.4Å; L386-S390 PolarHBondContact O-N 2.77Å; L386-S390 PolarHBondContact O-OG 2.88Å; F387-S390 PolarHBondContact O-N 2.98Å; F387-S390 PolarHBondContact O-OG 3.33Å; I388-S390 PolarHBondContact O-N 3.06Å
391	F	91.3	Very high	88.2	Confident	41 Å²	41	36.7 Å²	36.7	18%	0.18	18%	0.183	C	C	.	.	H	α-helix	trans	-88.8	-5.2	177.7	-71.1	-84.2	0	0	0	114	L150 F387 I388 G393 L394 L395	L150-F391 HydrophobicContact CD2-CE1 4.08Å; F387-F391 AromaticContact CD2-CD2 3.82Å; F387-F391 HydrophobicContact CD2-CD2 3.82Å; F387-F391 AromaticContact CD2-CE2 3.71Å; F387-F391 HydrophobicContact CD2-CE2 3.71Å; F387-F391 AromaticContact CE2-CD2 3.72Å; F387-F391 HydrophobicContact CE2-CD2 3.72Å; F387-F391 AromaticContact CE2-CE2 3.52Å; F387-F391 HydrophobicContact CE2-CE2 3.52Å; F387-F391 HydrophobicContact CE2-CZ 4.37Å; F387-F391 HydrophobicContact CG-CD2 4.39Å; F387-F391 HydrophobicContact CZ-CD2 4.19Å; F387-F391 HydrophobicContact CZ-CE2 4.35Å; F387-F391 WeakPolarHBondContact O-CD2 3.45Å; F387-F391 PolarHBondContact O-N 3.14Å; I388-F391 PolarHBondContact O-N 2.96Å; F391-G393 VanDerWaalsContact C-N 3.35Å; F391-G393 PolarHBondContact O-N 2.79Å; F391-L394 HydrophobicContact CD1-CD2 4.02Å; F391-L394 WeakPolarHBondContact O-CB 3.48Å; F391-L394 PolarHBondContact O-N 3.35Å; F391-L395 PolarHBondContact O-N 2.91Å; F391-L395 VanDerWaalsContact O-N 3.16Å
392	Q	91.2	Very high	88.7	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-58.8	-44.4	-177.5	-165	179.7	1	0	0	112.3	F183 F241 P356 I388 L394 L395 V396	F183-Q392 HydrophobicContact CE1-CB 4.05Å; F183-Q392 HydrophobicContact CE1-CG 4.14Å; F183-Q392 HydrophobicContact CZ-CB 4.22Å; F183-Q392 HydrophobicContact CZ-CG 3.82Å; F241-Q392 HydrophobicContact CZ-CG 4.39Å; P356-Q392 WeakPolarHBondContact O-CG 3.35Å; P356-Q392 PolarHBondContact O-NE2 3.48Å; I388-Q392 WeakPolarHBondContact O-CB 3.41Å; I388-Q392 PolarHBondContact O-N 2.71Å; Q392-L394 VanDerWaalsContact C-N 3.31Å; Q392-L394 PolarHBondContact O-N 3.26Å; Q392-L395 PolarHBondContact O-N 2.67Å; Q392-V396 WeakPolarHBondContact O-CG2 3.44Å; Q392-V396 PolarHBondContact O-N 2.8Å
393	G	92.6	Very high	89	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-66.4	-32.2	-179.9	0	0	0	0	0	113.2	S151 L155 F391 V396 A397	S151-G393 WeakPolarHBondContact OG-CA 3.42Å; L155-G393 WeakPolarHBondContact CD2-O 3.43Å; F391-G393 VanDerWaalsContact C-N 3.35Å; F391-G393 PolarHBondContact O-N 2.79Å; G393-V396 PolarHBondContact O-N 2.87Å; G393-A397 WeakPolarHBondContact O-CB 3.37Å; G393-A397 PolarHBondContact O-N 2.93Å
394	L	93.3	Very high	89	Confident	36 Å²	36	37 Å²	37	19%	0.188	19%	0.191	C	C	.	.	H	α-helix	trans	-61.4	-49.5	171	171.4	68.3	0	0	0	110.7	L150 S151 T154 F391 Q392 V396 A397 V398	L150-L394 HydrophobicContact CD2-CD2 3.74Å; L150-L394 HydrophobicContact CG-CD1 4.4Å; L150-L394 HydrophobicContact CG-CD2 4.18Å; S151-L394 PolarHBondContact OG-N 2.86Å; S151-L394 VanDerWaalsContact OG-N 3.13Å; T154-L394 HydrophobicContact CG2-CD1 3.54Å; T154-L394 WeakPolarHBondContact OG1-CD1 3.46Å; F391-L394 HydrophobicContact CD1-CD2 4.02Å; F391-L394 WeakPolarHBondContact O-CB 3.48Å; F391-L394 PolarHBondContact O-N 3.35Å; Q392-L394 VanDerWaalsContact C-N 3.31Å; Q392-L394 PolarHBondContact O-N 3.26Å; L394-V396 VanDerWaalsContact C-N 3.33Å; L394-V396 PolarHBondContact O-N 2.89Å; L394-A397 PolarHBondContact O-N 2.92Å; L394-V398 HydrophobicContact CD1-CG2 4.3Å; L394-V398 WeakPolarHBondContact O-CG2 3.18Å; L394-V398 PolarHBondContact O-N 3.02Å
395	L	91	Very high	89.2	Confident	74 Å²	74	40.7 Å²	40.7	39%	0.387	21%	0.206	S	C	.	.	H	α-helix	trans	-59.3	-46.2	178.3	-67.7	173.6	0	0	0	110.9	P356 F391 Q392 A397 V398 L399	P356-L395 HydrophobicContact CB-CD1 3.78Å; P356-L395 HydrophobicContact CG-CD1 3.97Å; F391-L395 PolarHBondContact O-N 2.91Å; F391-L395 VanDerWaalsContact O-N 3.16Å; Q392-L395 PolarHBondContact O-N 2.67Å; L395-A397 PolarHBondContact O-N 3.31Å; L395-V398 PolarHBondContact O-N 2.89Å; L395-L399 WeakPolarHBondContact O-CB 3.35Å; L395-L399 WeakPolarHBondContact O-CD1 3.17Å; L395-L399 WeakPolarHBondContact O-CG 3.45Å; L395-L399 PolarHBondContact O-N 2.89Å
396	V	90.6	Very high	89.3	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.3	-44.4	177.9	170.7	0	0	0	0	111.4	L179 F180 F183 F241 L357 Q392 G393 L394 L399 Y400	L179-V396 HydrophobicContact CD2-CG1 3.96Å; F180-V396 HydrophobicContact CD1-CG1 3.99Å; F180-V396 HydrophobicContact CE1-CG1 3.74Å; F183-V396 HydrophobicContact CE2-CB 4.37Å; F183-V396 HydrophobicContact CE2-CG1 4.26Å; F183-V396 HydrophobicContact CE2-CG2 3.94Å; F183-V396 HydrophobicContact CZ-CG2 4.21Å; F241-V396 HydrophobicContact CZ-CG2 4.26Å; L357-V396 HydrophobicContact CD1-CB 4.48Å; L357-V396 HydrophobicContact CD1-CG2 3.84Å; Q392-V396 WeakPolarHBondContact O-CG2 3.44Å; Q392-V396 PolarHBondContact O-N 2.8Å; G393-V396 PolarHBondContact O-N 2.87Å; L394-V396 VanDerWaalsContact C-N 3.33Å; L394-V396 PolarHBondContact O-N 2.89Å; V396-L399 PolarHBondContact O-N 3.49Å; V396-Y400 HydrophobicContact CG1-CD2 3.89Å; V396-Y400 HydrophobicContact CG1-CE2 4.34Å; V396-Y400 PolarHBondContact O-N 2.8Å
397	A	92.1	Very high	89.4	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.6	-43.2	176.4	0	0	0	0	0	112.4	L155 A158 G393 L394 L395 C401 Y402	L155-A397 HydrophobicContact CD2-CB 3.89Å; L155-A397 HydrophobicContact CG-CB 4.24Å; A158-A397 HydrophobicContact CB-CB 4.22Å; G393-A397 WeakPolarHBondContact O-CB 3.37Å; G393-A397 PolarHBondContact O-N 2.93Å; L394-A397 PolarHBondContact O-N 2.92Å; L395-A397 PolarHBondContact O-N 3.31Å; A397-C401 WeakPolarHBondContact O-CA 3.46Å; A397-C401 VanDerWaalsContact O-CB 3.27Å; A397-C401 WeakPolarHBondContact O-CB 3.22Å; A397-C401 PolarHBondContact O-N 2.91Å; A397-Y402 HydrophobicContact CB-CD2 4.46Å; A397-Y402 HydrophobicContact CB-CE2 4.09Å; A397-Y402 WeakPolarHBondContact O-CD2 3.5Å; A397-Y402 PolarHBondContact O-N 3.33Å; A397-Y402 VanDerWaalsContact O-N 3.17Å
398	V	91	Very high	89.4	Confident	62 Å²	62	40.3 Å²	40.3	38%	0.376	20%	0.202	S	C	.	.	I	π-helix	trans	-61.2	-46.3	176.9	171.6	0	0	0	0	111	L394 L395 Y402 A403	L394-V398 HydrophobicContact CD1-CG2 4.3Å; L394-V398 WeakPolarHBondContact O-CG2 3.18Å; L394-V398 PolarHBondContact O-N 3.02Å; L395-V398 PolarHBondContact O-N 2.89Å; V398-Y402 HydrophobicContact CG2-CD2 4.26Å; V398-Y402 PolarHBondContact O-N 2.69Å; V398-A403 WeakPolarHBondContact O-CB 3.06Å; V398-A403 PolarHBondContact O-N 2.9Å
399	L	86.9	Confident	89.5	Confident	53 Å²	53	41.4 Å²	41.4	28%	0.277	21%	0.21	S	C	.	.	I	π-helix	trans	-74.2	-48.2	-174	-65.9	167.6	0	0	0	113	T353 L357 L395 V396	T353-L399 HydrophobicContact CG2-CD1 3.4Å; T353-L399 HydrophobicContact CG2-CD2 3.42Å; T353-L399 VanDerWaalsContact CG2-CD2 3.42Å; T353-L399 HydrophobicContact CG2-CG 3.94Å; L357-L399 HydrophobicContact CD1-CD1 4.43Å; L395-L399 WeakPolarHBondContact O-CB 3.35Å; L395-L399 WeakPolarHBondContact O-CD1 3.17Å; L395-L399 WeakPolarHBondContact O-CG 3.45Å; L395-L399 PolarHBondContact O-N 2.89Å; V396-L399 PolarHBondContact O-N 3.49Å
400	Y	85.7	Confident	89.7	Confident	40 Å²	40	42.4 Å²	42.4	16%	0.157	22%	0.215	C	C	.	.	I	π-helix	trans	-85.3	-25.2	-174.6	-71.3	-39.7	0	0	0	114.3	H176 L179 F180 E244 L357 V396 N404	H176-Y400 AromaticContact CE1-CD1 3.8Å; H176-Y400 AromaticContact CE1-CE1 3.71Å; H176-Y400 AromaticContact CE1-CZ 3.81Å; H176-Y400 AromaticContact ND1-CD2 3.77Å; H176-Y400 AromaticContact ND1-CE2 3.85Å; H176-Y400 AromaticContact ND1-CG 3.97Å; L179-Y400 HydrophobicContact CD2-CD2 4.44Å; L179-Y400 HydrophobicContact CD2-CE2 4.11Å; F180-Y400 HydrophobicContact CE1-CD2 4.35Å; E244-Y400 VanDerWaalsContact CD-OH 3.3Å; E244-Y400 WeakPolarHBondContact OE1-CE2 3.26Å; E244-Y400 PolarHBondContact OE1-OH 3.33Å; E244-Y400 VanDerWaalsContact OE1-OH 3.06Å; L357-Y400 HydrophobicContact CD1-CD2 4.02Å; L357-Y400 HydrophobicContact CD1-CE1 4.38Å; L357-Y400 HydrophobicContact CD1-CE2 3.29Å; L357-Y400 HydrophobicContact CD2-CE1 4.04Å; L357-Y400 HydrophobicContact CD2-CE2 4.29Å; L357-Y400 WeakPolarHBondContact CD2-OH 3.12Å; L357-Y400 HydrophobicContact CG-CE2 3.97Å; L357-Y400 VanDerWaalsContact CG-OH 3.27Å; L357-Y400 WeakPolarHBondContact CG-OH 3.22Å; V396-Y400 HydrophobicContact CG1-CD2 3.89Å; V396-Y400 HydrophobicContact CG1-CE2 4.34Å; V396-Y400 PolarHBondContact O-N 2.8Å; Y400-N404 WeakPolarHBondContact O-CB 3.39Å; Y400-N404 PolarHBondContact O-ND2 3.14Å
401	C	90.1	Very high	89.5	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.232	C	C	.	.	I	π-helix	trans	-110.9	-65	-179.4	-172.2	0	0	0	0	112.6	A158 F180 A397 N404 V407	A158-C401 HydrophobicContact CB-CB 3.72Å; F180-C401 HydrophobicContact CE2-CB 4.36Å; F180-C401 HydrophobicContact CZ-CB 4.25Å; A397-C401 WeakPolarHBondContact O-CA 3.46Å; A397-C401 VanDerWaalsContact O-CB 3.27Å; A397-C401 WeakPolarHBondContact O-CB 3.22Å; A397-C401 PolarHBondContact O-N 2.91Å; C401-N404 WeakPolarHBondContact O-CB 3.31Å; C401-N404 PolarHBondContact O-N 2.92Å; C401-V407 WeakPolarHBondContact O-CB 3.26Å
402	Y	89.9	Confident	89.4	Confident	74 Å²	74	50.3 Å²	50.3	29%	0.29	25%	0.248	S	C	.	.	I	π-helix	trans	-72.4	-34.6	-167.6	-60.1	-62.4	0	0	0	114.3	T154 M157 A158 I161 A397 V398 N404 Q408	T154-Y402 PolarHBondContact O-OH 3.12Å; M157-Y402 WeakPolarHBondContact CB-OH 3.14Å; A158-Y402 HydrophobicContact CB-CE2 4.3Å; A158-Y402 PolarHBondContact N-OH 3.13Å; I161-Y402 HydrophobicContact CD1-CD1 4.46Å; I161-Y402 HydrophobicContact CD1-CE1 3.76Å; A397-Y402 HydrophobicContact CB-CD2 4.46Å; A397-Y402 HydrophobicContact CB-CE2 4.09Å; A397-Y402 WeakPolarHBondContact O-CD2 3.5Å; A397-Y402 PolarHBondContact O-N 3.33Å; A397-Y402 VanDerWaalsContact O-N 3.17Å; V398-Y402 HydrophobicContact CG2-CD2 4.26Å; V398-Y402 PolarHBondContact O-N 2.69Å; Y402-N404 VanDerWaalsContact C-N 3.34Å; Y402-Q408 WeakPolarHBondContact O-CG 3.01Å; Y402-Q408 PolarHBondContact O-NE2 2.93Å
403	A	87.6	Confident	89.3	Confident	54 Å²	54	55.4 Å²	55.4	45%	0.446	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-5.9	176.7	0	0	0	0	0	113.2	V398 K405	V398-A403 WeakPolarHBondContact O-CB 3.06Å; V398-A403 PolarHBondContact O-N 2.9Å; A403-K405 PolarHBondContact O-N 3.43Å
404	N	87.3	Confident	89.1	Confident	30 Å²	30	59.7 Å²	59.7	16%	0.16	29%	0.286	C	S	.	.			trans	-75.1	119.8	-177.5	-172.9	-23.5	0	0	0	110.8	Y400 C401 Y402 E406 V407 Q408	Y400-N404 WeakPolarHBondContact O-CB 3.39Å; Y400-N404 PolarHBondContact O-ND2 3.14Å; C401-N404 WeakPolarHBondContact O-CB 3.31Å; C401-N404 PolarHBondContact O-N 2.92Å; Y402-N404 VanDerWaalsContact C-N 3.34Å; N404-E406 VanDerWaalsContact C-N 3.27Å; N404-E406 PolarHBondContact O-N 2.98Å; N404-E406 PolarHBondContact OD1-N 3.31Å; N404-V407 HydrophobicContact CB-CB 4.21Å; N404-V407 HydrophobicContact CB-CG2 3.83Å; N404-V407 PolarHBondContact O-N 3.49Å; N404-V407 VanDerWaalsContact O-N 3.14Å; N404-Q408 WeakPolarHBondContact O-CG 3.44Å; N404-Q408 PolarHBondContact O-N 2.63Å
405	K	86.2	Confident	89	Confident	168 Å²	168	63.7 Å²	63.7	73%	0.73	31%	0.307	S	S	*	.	H	α-helix	trans	-59.5	-34.8	-177.6	-68.3	-175.4	179	-179.7	0	113.1	A403 T409	A403-K405 PolarHBondContact O-N 3.43Å; K405-T409 WeakPolarHBondContact O-CB 3.44Å; K405-T409 PolarHBondContact O-N 2.78Å; K405-T409 PolarHBondContact O-OG1 3.24Å
406	E	87.4	Confident	88.9	Confident	91 Å²	91	68.7 Å²	68.7	43%	0.425	32%	0.32	S	S	.	.	H	α-helix	trans	-63.7	-47.2	177.1	-67.9	172.9	-154.4	0	0	110.3	L168 R172 N404 T409 E410	L168-E406 HydrophobicContact CD2-CB 4.44Å; R172-E406 IonicContact CZ-OE1 2.98Å; R172-E406 IonicContact NH1-OE1 2.78Å; R172-E406 IonicContact NH2-OE1 2.69Å; R172-E406 PolarHBondContact NH2-OE1 3.38Å; R172-E406 IonicContact NH2-OE2 3.21Å; R172-E406 PolarHBondContact NH2-OE2 3.12Å; N404-E406 VanDerWaalsContact C-N 3.27Å; N404-E406 PolarHBondContact O-N 2.98Å; N404-E406 PolarHBondContact OD1-N 3.31Å; E406-T409 PolarHBondContact O-N 3.14Å; E406-E410 PolarHBondContact O-N 3.06Å
407	V	87.9	Confident	88.8	Confident	3 Å²	3	72.6 Å²	72.6	2%	0.018	35%	0.347	C	S	.	.	H	α-helix	trans	-64.3	-46.3	179.2	-177.1	0	0	0	0	110.9	I161 L168 C401 N404 T409 E410 L411	I161-V407 HydrophobicContact CG2-CG1 3.61Å; L168-V407 HydrophobicContact CD1-CG1 4.4Å; L168-V407 HydrophobicContact CD1-CG2 4.01Å; L168-V407 HydrophobicContact CD2-CG2 4.35Å; C401-V407 WeakPolarHBondContact O-CB 3.26Å; N404-V407 HydrophobicContact CB-CB 4.21Å; N404-V407 HydrophobicContact CB-CG2 3.83Å; N404-V407 PolarHBondContact O-N 3.49Å; N404-V407 VanDerWaalsContact O-N 3.14Å; V407-T409 VanDerWaalsContact C-N 3.27Å; V407-T409 PolarHBondContact O-N 3.02Å; V407-E410 PolarHBondContact O-N 2.8Å; V407-L411 HydrophobicContact CG1-CD1 3.91Å; V407-L411 WeakPolarHBondContact O-CB 3.03Å; V407-L411 WeakPolarHBondContact O-CG 3.42Å; V407-L411 PolarHBondContact O-N 3.46Å
408	Q	89.5	Confident	88.3	Confident	72 Å²	72	82.7 Å²	82.7	34%	0.336	39%	0.386	S	S	.	.	H	α-helix	trans	-60.6	-36.2	176.6	-70.6	-178.2	-4.4	0	0	112.7	Y402 N404 R412	Y402-Q408 WeakPolarHBondContact O-CG 3.01Å; Y402-Q408 PolarHBondContact O-NE2 2.93Å; N404-Q408 WeakPolarHBondContact O-CG 3.44Å; N404-Q408 PolarHBondContact O-N 2.63Å; Q408-R412 WeakPolarHBondContact O-CB 3.49Å; Q408-R412 WeakPolarHBondContact O-CG 3.26Å; Q408-R412 PolarHBondContact O-N 3Å; Q408-R412 PolarHBondContact O-NE 3.34Å
409	T	89.9	Confident	87.6	Confident	65 Å²	65	92.1 Å²	92.1	40%	0.399	42%	0.415	S	S	.	.	H	α-helix	trans	-70.3	-43.4	179.1	-58.9	0	0	0	0	111	K405 E406 V407 R412 R413	K405-T409 WeakPolarHBondContact O-CB 3.44Å; K405-T409 PolarHBondContact O-N 2.78Å; K405-T409 PolarHBondContact O-OG1 3.24Å; E406-T409 PolarHBondContact O-N 3.14Å; V407-T409 VanDerWaalsContact C-N 3.27Å; V407-T409 PolarHBondContact O-N 3.02Å; T409-R412 PolarHBondContact O-N 2.79Å; T409-R413 WeakPolarHBondContact O-CB 3.22Å; T409-R413 PolarHBondContact O-N 3.42Å
410	E	89.9	Confident	87.6	Confident	27 Å²	27	94.1 Å²	94.1	13%	0.126	42%	0.421	C	S	.	.	H	α-helix	trans	-67.4	-39.3	175.8	-75.3	-61.7	141.4	0	0	112.7	K167 L168 E406 V407 R413 K414	K167-E410 WeakPolarHBondContact CD-OE1 3.3Å; K167-E410 IonicContact NZ-OE1 2.88Å; L168-E410 HydrophobicContact CD2-CG 4.44Å; E406-E410 PolarHBondContact O-N 3.06Å; V407-E410 PolarHBondContact O-N 2.8Å; E410-R413 WeakPolarHBondContact O-CB 3.14Å; E410-R413 PolarHBondContact O-N 3.3Å; E410-R413 IonicContact OE1-NE 3.03Å; E410-R413 PolarHBondContact OE1-NE 2.79Å; E410-R413 IonicContact OE2-CZ 2.87Å; E410-R413 VanDerWaalsContact OE2-CZ 3.23Å; E410-R413 IonicContact OE2-NE 3.29Å; E410-R413 PolarHBondContact OE2-NE 3.3Å; E410-R413 IonicContact OE2-NH2 3.68Å; E410-R413 PolarHBondContact OE2-NH2 2.78Å; E410-K414 PolarHBondContact O-N 3.14Å
411	L	88.3	Confident	87.7	Confident	68 Å²	68	96.9 Å²	96.9	36%	0.356	44%	0.435	S	S	.	.	H	α-helix	trans	-59.4	-49.9	172.6	-83.3	163.2	0	0	0	111.4	F165 V407 R413 K414 L415	F165-L411 HydrophobicContact CE2-CD2 4.08Å; F165-L411 HydrophobicContact CE2-CG 4.38Å; F165-L411 HydrophobicContact CZ-CD2 4.09Å; V407-L411 HydrophobicContact CG1-CD1 3.91Å; V407-L411 WeakPolarHBondContact O-CB 3.03Å; V407-L411 WeakPolarHBondContact O-CG 3.42Å; V407-L411 PolarHBondContact O-N 3.46Å; L411-R413 VanDerWaalsContact C-N 3.3Å; L411-R413 PolarHBondContact O-N 2.03Å; L411-K414 PolarHBondContact O-N 3.19Å; L411-L415 WeakPolarHBondContact O-CB 3.4Å; L411-L415 PolarHBondContact O-N 3.09Å
412	R	89.6	Confident	87.6	Confident	138 Å²	138	102.3 Å²	102.3	52%	0.521	46%	0.459	S	S	.	.	H	α-helix	trans	-61.8	-37.2	176.2	-76.7	-176.1	-70.9	-159.8	0.7	112.4	Q408 T409 R416	Q408-R412 WeakPolarHBondContact O-CB 3.49Å; Q408-R412 WeakPolarHBondContact O-CG 3.26Å; Q408-R412 PolarHBondContact O-N 3Å; Q408-R412 PolarHBondContact O-NE 3.34Å; T409-R412 PolarHBondContact O-N 2.79Å; R412-R416 WeakPolarHBondContact O-CB 3.29Å; R412-R416 WeakPolarHBondContact O-CG 3.41Å; R412-R416 PolarHBondContact O-N 2.77Å; R412-R416 PolarHBondContact O-NE 2.96Å
413	R	89.3	Confident	87.5	Confident	107 Å²	107	103.9 Å²	103.9	40%	0.404	47%	0.469	S	S	.	.	H	α-helix	trans	-64	-43.6	175.4	-170.9	-176.9	69.9	80.4	3.1	111.2	T409 E410 L411 S417	T409-R413 WeakPolarHBondContact O-CB 3.22Å; T409-R413 PolarHBondContact O-N 3.42Å; E410-R413 WeakPolarHBondContact O-CB 3.14Å; E410-R413 PolarHBondContact O-N 3.3Å; E410-R413 IonicContact OE1-NE 3.03Å; E410-R413 PolarHBondContact OE1-NE 2.79Å; E410-R413 IonicContact OE2-CZ 2.87Å; E410-R413 VanDerWaalsContact OE2-CZ 3.23Å; E410-R413 IonicContact OE2-NE 3.29Å; E410-R413 PolarHBondContact OE2-NE 3.3Å; E410-R413 IonicContact OE2-NH2 3.68Å; E410-R413 PolarHBondContact OE2-NH2 2.78Å; L411-R413 VanDerWaalsContact C-N 3.3Å; L411-R413 PolarHBondContact O-N 2.03Å; R413-S417 PolarHBondContact O-N 2.86Å
414	K	88.1	Confident	87.5	Confident	92 Å²	92	107.1 Å²	107.1	40%	0.4	47%	0.471	S	S	.	.	H	α-helix	trans	-69.8	-39.8	179	-167.5	65.4	179.7	171.4	0	112	F165 E410 L411 S417 W418	F165-K414 HydrophobicContact CE1-CB 3.93Å; F165-K414 HydrophobicContact CE1-CG 4.06Å; F165-K414 HydrophobicContact CZ-CB 4.37Å; E410-K414 PolarHBondContact O-N 3.14Å; L411-K414 PolarHBondContact O-N 3.19Å; K414-S417 PolarHBondContact O-N 3.14Å; K414-S417 VanDerWaalsContact O-N 3.14Å; K414-W418 PolarHBondContact O-N 2.88Å; K414-W418 VanDerWaalsContact O-N 3.15Å
415	L	89.9	Confident	87.5	Confident	120 Å²	120	112.2 Å²	112.2	63%	0.628	49%	0.492	S	S	*	.	H	α-helix	trans	-60.3	-44.3	175.3	-164.7	82.6	0	0	0	111.4	L411 S417 W418 R419	L411-L415 WeakPolarHBondContact O-CB 3.4Å; L411-L415 PolarHBondContact O-N 3.09Å; L415-S417 VanDerWaalsContact C-N 3.25Å; L415-S417 PolarHBondContact O-N 3.46Å; L415-W418 PolarHBondContact O-N 3.05Å; L415-R419 PolarHBondContact O-N 3.12Å
416	R	89.1	Confident	87.6	Confident	178 Å²	178	108.2 Å²	108.2	67%	0.672	47%	0.474	S	S	*	.	H	α-helix	trans	-69.2	-16.4	175.2	-76.1	-173.2	-70.2	-168.5	0.7	115.1	R412	R412-R416 WeakPolarHBondContact O-CB 3.29Å; R412-R416 WeakPolarHBondContact O-CG 3.41Å; R412-R416 PolarHBondContact O-N 2.77Å; R412-R416 PolarHBondContact O-NE 2.96Å
417	S	88.6	Confident	87.6	Confident	82 Å²	82	109.5 Å²	109.5	57%	0.573	48%	0.478	S	S	*	.	H	α-helix	trans	-91.2	-14.2	174.1	165.1	0	0	0	0	111.9	R413 K414 L415	R413-S417 PolarHBondContact O-N 2.86Å; K414-S417 PolarHBondContact O-N 3.14Å; K414-S417 VanDerWaalsContact O-N 3.14Å; L415-S417 VanDerWaalsContact C-N 3.25Å; L415-S417 PolarHBondContact O-N 3.46Å
418	W	83	Confident	87.5	Confident	212 Å²	212	118.4 Å²	118.4	80%	0.803	52%	0.517	S	S	*	.	H	α-helix	trans	-94.6	-38.5	178.3	-102.6	61.8	0	0	0	112	K414 L415	K414-W418 PolarHBondContact O-N 2.88Å; K414-W418 VanDerWaalsContact O-N 3.15Å; L415-W418 PolarHBondContact O-N 3.05Å
419	R	75.5	Confident	87.4	Confident	260 Å²	260	122.6 Å²	122.6	98%	0.981	53%	0.533	S	S	*	.			trans	-73.4	0	162	-174.3	-174.4	-71.9	178.1	-5.3	108.7	L415	L415-R419 PolarHBondContact O-N 3.12Å

Retrieved 419 of 419 residues in 332 ms (Link to these results)

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