A0A077ZIR9_TRITR Loading...

Pkinase domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZIR9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 251 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.6	Very low	40.9	Very low	240 Å²	240	180.5 Å²	180.5	100%	1.182	89%	0.889	S	S	*	*				0	44.9	0	-142.4	-172	-45	0	0	109.3
2	E	38.1	Very low	41.6	Very low	191 Å²	191	172.8 Å²	172.8	89%	0.893	86%	0.863	S	S	*	*			trans	-135.3	78.7	-170.2	-77.2	179.7	143.7	0	0	109.3
3	Q	37.2	Very low	42.4	Very low	185 Å²	185	169 Å²	169	86%	0.864	85%	0.845	S	S	*	*			trans	-146.7	138.6	158.2	-73.1	-170.7	-5.1	0	0	106.6
4	S	42	Very low	42.9	Very low	117 Å²	117	169 Å²	169	82%	0.818	84%	0.838	S	S	*	*			trans	104.3	57.5	170.5	-38.6	0	0	0	0	117
5	L	42	Very low	43.1	Very low	166 Å²	166	164.5 Å²	164.5	87%	0.869	83%	0.829	S	S	*	*			trans	-135.9	136	147.4	-89.2	110.6	0	0	0	108.5
6	E	37.3	Very low	43.5	Very low	196 Å²	196	162.8 Å²	162.8	92%	0.916	82%	0.822	S	S	*	*	S	Bend	trans	111.9	23.8	167.5	-59.8	-179.2	159.5	0	0	119.8
7	R	40.3	Very low	44.1	Very low	252 Å²	252	161.3 Å²	161.3	95%	0.951	82%	0.816	S	S	*	*	S	Bend	trans	-115.9	18.4	168.2	-141.8	174.3	-173.4	-176.7	0.5	118
8	S	42.2	Very low	44.5	Very low	113 Å²	113	159.6 Å²	159.6	79%	0.79	81%	0.809	S	S	*	*	S	Bend	trans	-142.7	48.9	-169.7	48.1	0	0	0	0	117
9	R	43.2	Very low	45	Very low	235 Å²	235	156.9 Å²	156.9	89%	0.887	80%	0.801	S	S	*	*			trans	-139.4	17.5	171.1	-90.4	-162.8	-76.8	-127.9	0.7	118.8
10	C	42.3	Very low	46	Very low	122 Å²	122	153.5 Å²	153.5	82%	0.824	79%	0.788	S	S	*	*	S	Bend	trans	-106.5	20.1	179.3	-71.2	0	0	0	0	116.2
11	E	48.2	Very low	47.3	Very low	169 Å²	169	151.3 Å²	151.3	79%	0.79	77%	0.773	S	S	*	*	S	Bend	trans	-133.8	78.4	176.2	-72	-77.8	161.7	0	0	108.9
12	P	49	Very low	49.3	Very low	88 Å²	88	145.2 Å²	145.2	57%	0.571	74%	0.74	S	S	*	*	S	Bend		-143.8	9.4	123.8	31.6	-13.3	0	0	0	115.2
13	I	51.5	Low	51.2	Low	123 Å²	123	140 Å²	140	63%	0.631	73%	0.725	S	S	*	*	H	α-helix	trans	-73.1	-32.9	-177.9	-61	173.4	0	0	0	111.9	S15 L16	I13-S15 VanDerWaalsContact C-N 3.33Å; I13-S15 PolarHBondContact O-N 2.67Å; I13-L16 PolarHBondContact O-N 3.02Å
14	F	49.8	Very low	53.2	Low	169 Å²	169	136.3 Å²	136.3	74%	0.741	71%	0.711	S	S	*	*	H	α-helix	trans	-68.6	-30.1	-177.7	-111.2	-87.5	0	0	0	113.4
15	S	45.3	Very low	55.1	Low	102 Å²	102	135.1 Å²	135.1	71%	0.713	70%	0.695	S	S	*	*	H	α-helix	trans	-74.3	-26.3	178	-170	0	0	0	0	112.8	I13	I13-S15 VanDerWaalsContact C-N 3.33Å; I13-S15 PolarHBondContact O-N 2.67Å
16	L	50.8	Low	57	Low	136 Å²	136	132 Å²	132	71%	0.712	69%	0.686	S	S	*	*	H	α-helix	trans	-82.1	-19.9	-178.3	-127.3	109.6	0	0	0	113	I13 L18 V19	I13-L16 PolarHBondContact O-N 3.02Å; L16-L18 VanDerWaalsContact C-N 3.26Å; L16-L18 PolarHBondContact O-N 2.96Å; L16-V19 WeakPolarHBondContact O-CG2 3.28Å; L16-V19 PolarHBondContact O-N 3.42Å
17	L	53.2	Low	59.2	Low	138 Å²	138	125.7 Å²	125.7	72%	0.723	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-7.7	178.6	-101.7	155.7	0	0	0	113.8	V19	L17-V19 VanDerWaalsContact C-N 3.3Å
18	L	51.6	Low	61.6	Low	131 Å²	131	118 Å²	118	69%	0.686	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	31.1	170.2	-92.7	170.7	0	0	0	112.3	L16 T20	L16-L18 VanDerWaalsContact C-N 3.26Å; L16-L18 PolarHBondContact O-N 2.96Å; L18-T20 HydrophobicContact CD2-CG2 3.49Å; L18-T20 VanDerWaalsContact CD2-CG2 3.49Å; L18-T20 PolarHBondContact O-N 3.47Å
19	V	54.2	Low	63.9	Low	109 Å²	109	115 Å²	115	66%	0.661	63%	0.632	S	S	*	*			trans	-71.2	86.8	156.8	178.7	0	0	0	0	106.3	L16 L17 K21	L16-V19 WeakPolarHBondContact O-CG2 3.28Å; L16-V19 PolarHBondContact O-N 3.42Å; L17-V19 VanDerWaalsContact C-N 3.3Å; V19-K21 PolarHBondContact O-N 2.69Å
20	T	64.6	Low	66.2	Low	87 Å²	87	104.5 Å²	104.5	53%	0.534	60%	0.597	S	S	.	*			trans	-77	7.3	-170.8	50.7	0	0	0	0	114.4	L18	L18-T20 HydrophobicContact CD2-CG2 3.49Å; L18-T20 VanDerWaalsContact CD2-CG2 3.49Å; L18-T20 PolarHBondContact O-N 3.47Å
21	K	72.5	Confident	68.7	Low	108 Å²	108	103.5 Å²	103.5	47%	0.47	58%	0.577	S	S	.	*			trans	-115.9	122.3	-174.7	-73.6	-169.6	156.9	-151.2	0	110.7	V19 S46 G47 Y48	V19-K21 PolarHBondContact O-N 2.69Å; K21-S46 PolarHBondContact NZ-O 2.86Å; K21-G47 WeakPolarHBondContact CD-O 3.4Å; K21-G47 WeakPolarHBondContact CE-O 3.24Å; K21-G47 WeakPolarHBondContact CG-O 3.44Å; K21-G47 PolarHBondContact NZ-O 2.8Å; K21-G47 VanDerWaalsContact NZ-O 3.12Å; K21-Y48 WeakPolarHBondContact CA-O 3.43Å
22	F	79.7	Confident	70.9	Confident	112 Å²	112	96.5 Å²	96.5	49%	0.491	54%	0.544	S	S	.	.	B	Isolated β-bridge	trans	-93.7	144.2	177.6	-65.5	-85.1	0	0	0	110	G47 Y48	F22-G47 CarbonylContact O-C 3.38Å; F22-G47 VanDerWaalsContact O-CA 3.26Å; F22-G47 WeakPolarHBondContact O-CA 3.47Å; F22-Y48 HydrophobicContact CB-CD2 4.21Å; F22-Y48 HydrophobicContact CB-CE1 3.94Å; F22-Y48 HydrophobicContact CB-CE2 3.63Å; F22-Y48 VanDerWaalsContact CB-CZ 3.46Å; F22-Y48 HydrophobicContact CD2-CE2 4.44Å; F22-Y48 HydrophobicContact CG-CE2 4.36Å; F22-Y48 PolarHBondContact N-O 3.16Å; F22-Y48 WeakPolarHBondContact O-CD1 3.25Å; F22-Y48 WeakPolarHBondContact O-CE1 3.46Å; F22-Y48 PolarHBondContact O-N 2.82Å
23	S	78.9	Confident	73.2	Confident	82 Å²	82	92.4 Å²	92.4	57%	0.573	52%	0.518	S	S	*	.			trans	-112	-16.5	178	50.3	0	0	0	0	113.5
24	D	79.8	Confident	75.2	Confident	107 Å²	107	86.6 Å²	86.6	57%	0.572	49%	0.488	S	S	*	.			trans	-75.5	133.5	-170.1	-61.6	-22.8	0	0	0	111.6	C26 Y48	D24-C26 PolarHBondContact O-N 3.32Å; D24-Y48 PolarHBondContact O-OH 2.71Å
25	L	79.9	Confident	77.3	Confident	93 Å²	93	79.1 Å²	79.1	49%	0.487	46%	0.456	S	S	.	.			trans	-87.4	102.8	171.6	-177.8	67.3	0	0	0	109.6	L32 V36	L25-L32 HydrophobicContact CD1-CD1 3.81Å; L25-V36 HydrophobicContact CD1-CG1 3.82Å
26	C	82.4	Confident	79.6	Confident	101 Å²	101	74.6 Å²	74.6	68%	0.682	42%	0.424	S	S	*	.			trans	-137.2	134.2	173	-72.4	0	0	0	0	110.1	D24	D24-C26 PolarHBondContact O-N 3.32Å
27	G	84.6	Confident	81.5	Confident	62 Å²	62	68.4 Å²	68.4	64%	0.639	39%	0.391	S	S	*	.	S	Bend	trans	140.4	176.1	172	0	0	0	0	0	114.3
28	T	89.9	Confident	83.2	Confident	92 Å²	92	66.7 Å²	66.7	56%	0.564	38%	0.375	S	S	*	.			trans	-82.9	123.1	176.2	-61.7	0	0	0	0	109.3	G30 Y31	T28-G30 VanDerWaalsContact C-N 3.26Å; T28-G30 PolarHBondContact O-N 3.4Å; T28-Y31 HydrophobicContact CG2-CD2 3.79Å; T28-Y31 HydrophobicContact CG2-CE2 3.87Å; T28-Y31 PolarHBondContact O-N 2.63Å
29	P	89.6	Confident	84.9	Confident	48 Å²	48	61.4 Å²	61.4	31%	0.312	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-50.4	-36.5	-168.9	-32.2	35.5	0	0	0	116.3	Y31 L32 L80 I83	P29-Y31 PolarHBondContact O-N 3.31Å; P29-L32 PolarHBondContact O-N 3.34Å; P29-L80 HydrophobicContact CB-CD2 4.24Å; P29-I83 WeakPolarHBondContact O-CD1 3.32Å
30	G	92.2	Very high	86.4	Confident	15 Å²	15	58.7 Å²	58.7	16%	0.155	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-67.6	-14.5	-179.2	0	0	0	0	0	115.5	T28	T28-G30 VanDerWaalsContact C-N 3.26Å; T28-G30 PolarHBondContact O-N 3.4Å
31	Y	95.5	Very high	87.3	Confident	102 Å²	102	59.5 Å²	59.5	40%	0.4	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-107.7	-7	179.2	-56.3	-89.8	0	0	0	112.7	T28 P29 V59 I60	T28-Y31 HydrophobicContact CG2-CD2 3.79Å; T28-Y31 HydrophobicContact CG2-CE2 3.87Å; T28-Y31 PolarHBondContact O-N 2.63Å; P29-Y31 PolarHBondContact O-N 3.31Å; Y31-V59 HydrophobicContact CD1-CB 4.12Å; Y31-V59 HydrophobicContact CD1-CG1 3.59Å; Y31-V59 HydrophobicContact CE1-CG1 3.83Å; Y31-V59 HydrophobicContact CG-CG1 4.36Å; Y31-I60 HydrophobicContact CD1-CG1 4.14Å; Y31-I60 HydrophobicContact CE1-CG1 3.96Å
32	L	94.8	Very high	87.9	Confident	21 Å²	21	60.7 Å²	60.7	11%	0.11	34%	0.336	C	S	.	.			trans	-72	136.6	-178.5	-65	-179.7	0	0	0	110.6	L25 P29 V36 L37 W55 I83	L25-L32 HydrophobicContact CD1-CD1 3.81Å; P29-L32 PolarHBondContact O-N 3.34Å; L32-V36 HydrophobicContact CD2-CG1 4.2Å; L32-L37 HydrophobicContact CB-CD2 4.17Å; L32-L37 HydrophobicContact CD1-CD2 3.94Å; L32-W55 PolarHBondContact O-NE1 3.04Å; L32-W55 VanDerWaalsContact O-NE1 3.09Å; L32-I83 WeakPolarHBondContact O-CG2 3.35Å
33	A	95.4	Very high	87.8	Confident	2 Å²	2	63.9 Å²	63.9	2%	0.017	36%	0.358	C	S	.	.			trans	-75.7	154.4	175.9	0	0	0	0	0	111.7	E35 V36 L37 V52 W55	A33-E35 VanDerWaalsContact C-N 3.25Å; A33-E35 HydrophobicContact CB-CG 4.41Å; A33-E35 WeakPolarHBondContact CB-OE1 3.37Å; A33-E35 WeakPolarHBondContact CB-OE2 3.39Å; A33-E35 PolarHBondContact O-N 3.4Å; A33-V36 HydrophobicContact CB-CG2 4.19Å; A33-V36 WeakPolarHBondContact O-CB 3.32Å; A33-V36 PolarHBondContact O-N 3.41Å; A33-L37 PolarHBondContact O-N 3.24Å; A33-V52 HydrophobicContact CB-CB 4.02Å; A33-V52 HydrophobicContact CB-CG1 3.97Å; A33-W55 HydrophobicContact CB-CB 3.75Å; A33-W55 HydrophobicContact CB-CD2 4.28Å; A33-W55 HydrophobicContact CB-CG 3.71Å
34	P	94.9	Very high	87.9	Confident	1 Å²	1	66.5 Å²	66.5	1%	0.006	37%	0.365	C	S	.	.	H	α-helix	trans	-55.9	-36.1	-178.7	-27.7	36.5	0	0	0	114.2	L37 R38 W55 I83 V112	P34-L37 PolarHBondContact O-N 3.16Å; P34-R38 WeakPolarHBondContact O-CG 3.32Å; P34-R38 PolarHBondContact O-N 2.86Å; P34-W55 HydrophobicContact CG-CE3 4.21Å; P34-W55 HydrophobicContact CG-CH2 3.63Å; P34-W55 HydrophobicContact CG-CZ2 4.01Å; P34-W55 HydrophobicContact CG-CZ3 3.74Å; P34-I83 HydrophobicContact CG-CG2 4.22Å; P34-I83 WeakPolarHBondContact CG-O 3.47Å; P34-V112 HydrophobicContact CB-CG1 4.13Å; P34-V112 HydrophobicContact CG-CG1 4.19Å
35	E	93.4	Very high	87.8	Confident	13 Å²	13	63.8 Å²	63.8	6%	0.061	35%	0.352	C	S	.	.	H	α-helix	trans	-71.1	-28.2	177.6	63.9	-86.2	-155.2	0	0	113.6	A33 R38 T39 V52 P114 R117	A33-E35 VanDerWaalsContact C-N 3.25Å; A33-E35 HydrophobicContact CB-CG 4.41Å; A33-E35 WeakPolarHBondContact CB-OE1 3.37Å; A33-E35 WeakPolarHBondContact CB-OE2 3.39Å; A33-E35 PolarHBondContact O-N 3.4Å; E35-R38 PolarHBondContact O-N 2.98Å; E35-T39 WeakPolarHBondContact O-CB 3.46Å; E35-T39 PolarHBondContact O-N 3.29Å; E35-T39 PolarHBondContact O-OG1 3.04Å; E35-V52 HydrophobicContact CG-CG1 3.92Å; E35-V52 WeakPolarHBondContact OE1-CG1 3.08Å; E35-P114 HydrophobicContact CB-CG 4.19Å; E35-P114 HydrophobicContact CG-CG 4.01Å; E35-R117 IonicContact OE1-CZ 2.91Å; E35-R117 VanDerWaalsContact OE1-CZ 3.3Å; E35-R117 IonicContact OE1-NH1 2.92Å; E35-R117 PolarHBondContact OE1-NH1 3.48Å; E35-R117 IonicContact OE1-NH2 3.87Å; E35-R117 PolarHBondContact OE1-NH2 3.06Å; E35-R117 VanDerWaalsContact OE1-NH2 3.1Å; E35-R117 IonicContact OE2-CZ 2.85Å; E35-R117 IonicContact OE2-NH1 3.75Å; E35-R117 IonicContact OE2-NH2 3.81Å; E35-R117 PolarHBondContact OE2-NH2 3.48Å
36	V	92.8	Very high	87.6	Confident	7 Å²	7	63.7 Å²	63.7	4%	0.042	36%	0.359	C	S	.	.	H	α-helix	trans	-68	-44.2	173.1	-177.1	0	0	0	0	109	L25 L32 A33 T39 S40 Y48 V52	L25-V36 HydrophobicContact CD1-CG1 3.82Å; L32-V36 HydrophobicContact CD2-CG1 4.2Å; A33-V36 HydrophobicContact CB-CG2 4.19Å; A33-V36 WeakPolarHBondContact O-CB 3.32Å; A33-V36 PolarHBondContact O-N 3.41Å; V36-T39 PolarHBondContact O-N 3.44Å; V36-S40 PolarHBondContact O-N 3.43Å; V36-S40 VanDerWaalsContact O-N 3.09Å; V36-Y48 HydrophobicContact CB-CD1 4.29Å; V36-Y48 HydrophobicContact CB-CE1 4.47Å; V36-Y48 HydrophobicContact CG1-CD1 4.28Å; V36-Y48 HydrophobicContact CG1-CE1 3.99Å; V36-Y48 HydrophobicContact CG2-CD1 3.87Å; V36-Y48 HydrophobicContact CG2-CD2 4.09Å; V36-Y48 HydrophobicContact CG2-CE1 4.14Å; V36-Y48 HydrophobicContact CG2-CE2 4.33Å; V36-Y48 HydrophobicContact CG2-CG 3.84Å; V36-V52 HydrophobicContact CG2-CB 4.15Å; V36-V52 HydrophobicContact CG2-CG1 3.56Å
37	L	90.9	Very high	87.7	Confident	6 Å²	6	59.6 Å²	59.6	3%	0.031	33%	0.334	C	S	.	.	H	α-helix	trans	-61.2	-46.7	174.9	-58.7	-178.3	0	0	0	111.2	L32 A33 P34 T39 S40 M41 L80 I83	L32-L37 HydrophobicContact CB-CD2 4.17Å; L32-L37 HydrophobicContact CD1-CD2 3.94Å; A33-L37 PolarHBondContact O-N 3.24Å; P34-L37 PolarHBondContact O-N 3.16Å; L37-T39 PolarHBondContact O-N 2.85Å; L37-S40 PolarHBondContact O-N 2.87Å; L37-S40 VanDerWaalsContact O-N 3.15Å; L37-S40 PolarHBondContact O-OG 3.04Å; L37-M41 HydrophobicContact CB-CE 4.32Å; L37-M41 VanDerWaalsContact O-CG 3.28Å; L37-M41 WeakPolarHBondContact O-CG 3.34Å; L37-M41 PolarHBondContact O-N 3.48Å; L37-L80 HydrophobicContact CD1-CB 4.41Å; L37-L80 HydrophobicContact CD1-CD2 3.84Å; L37-L80 HydrophobicContact CD2-CD2 3.86Å; L37-I83 HydrophobicContact CD1-CB 4.16Å; L37-I83 HydrophobicContact CD1-CG2 3.65Å
38	R	89.3	Confident	88	Confident	102 Å²	102	58.3 Å²	58.3	39%	0.385	31%	0.31	S	S	.	.	H	α-helix	trans	-60	-43.9	176.8	-75.7	-176.1	-74.4	170.1	-5	112.7	P34 E35 S40 M41 Y42	P34-R38 WeakPolarHBondContact O-CG 3.32Å; P34-R38 PolarHBondContact O-N 2.86Å; E35-R38 PolarHBondContact O-N 2.98Å; R38-S40 PolarHBondContact O-N 3.44Å; R38-M41 PolarHBondContact O-N 3.2Å; R38-Y42 HydrophobicContact CB-CD2 4.48Å; R38-Y42 WeakPolarHBondContact O-CD2 3.22Å; R38-Y42 PolarHBondContact O-N 3.09Å; R38-Y42 VanDerWaalsContact O-N 3.07Å
39	T	87.8	Confident	88	Confident	19 Å²	19	54.5 Å²	54.5	12%	0.117	29%	0.29	C	S	.	.	H	α-helix	trans	-61.3	-33.9	177.1	-53.7	0	0	0	0	111.7	E35 V36 L37	E35-T39 WeakPolarHBondContact O-CB 3.46Å; E35-T39 PolarHBondContact O-N 3.29Å; E35-T39 PolarHBondContact O-OG1 3.04Å; V36-T39 PolarHBondContact O-N 3.44Å; L37-T39 PolarHBondContact O-N 2.85Å
40	S	85.1	Confident	88.1	Confident	52 Å²	52	58.5 Å²	58.5	36%	0.364	31%	0.308	S	S	.	.	H	α-helix	trans	-79.8	-20.9	177.4	71.6	0	0	0	0	115	V36 L37 R38	V36-S40 PolarHBondContact O-N 3.43Å; V36-S40 VanDerWaalsContact O-N 3.09Å; L37-S40 PolarHBondContact O-N 2.87Å; L37-S40 VanDerWaalsContact O-N 3.15Å; L37-S40 PolarHBondContact O-OG 3.04Å; R38-S40 PolarHBondContact O-N 3.44Å
41	M	84.2	Confident	88.2	Confident	105 Å²	105	62 Å²	62	52%	0.517	32%	0.32	S	S	.	.	H	α-helix	trans	-96.2	-25.5	-175.4	-71.7	177.8	-172	0	0	113.2	L37 R38	L37-M41 HydrophobicContact CB-CE 4.32Å; L37-M41 VanDerWaalsContact O-CG 3.28Å; L37-M41 WeakPolarHBondContact O-CG 3.34Å; L37-M41 PolarHBondContact O-N 3.48Å; R38-M41 PolarHBondContact O-N 3.2Å
42	Y	84.2	Confident	88.1	Confident	133 Å²	133	58 Å²	58	52%	0.522	31%	0.307	S	S	.	.			trans	-132.3	125.1	-171.5	-57.9	-73.5	0	0	0	110.5	R38 D44 V45	R38-Y42 HydrophobicContact CB-CD2 4.48Å; R38-Y42 WeakPolarHBondContact O-CD2 3.22Å; R38-Y42 PolarHBondContact O-N 3.09Å; R38-Y42 VanDerWaalsContact O-N 3.07Å; Y42-D44 WeakPolarHBondContact CB-OD1 3.24Å; Y42-D44 PolarHBondContact O-N 3.01Å; Y42-V45 PolarHBondContact O-N 3.34Å
43	D	78.3	Confident	88.2	Confident	179 Å²	179	61.8 Å²	61.8	96%	0.957	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-16.9	-176.7	-63.8	-33.6	0	0	0	113.5
44	D	80.8	Confident	88.3	Confident	136 Å²	136	62.7 Å²	62.7	73%	0.727	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-1	-176.4	68.8	-40.6	0	0	0	114	Y42 S46	Y42-D44 WeakPolarHBondContact CB-OD1 3.24Å; Y42-D44 PolarHBondContact O-N 3.01Å; D44-S46 PolarHBondContact O-N 3.47Å
45	V	77.1	Confident	88.4	Confident	50 Å²	50	62.6 Å²	62.6	30%	0.303	33%	0.33	S	S	.	.			trans	-87.6	117.6	-175.5	179.9	0	0	0	0	110.6	Y42 G47	Y42-V45 PolarHBondContact O-N 3.34Å; V45-G47 PolarHBondContact O-N 3.24Å; V45-G47 VanDerWaalsContact O-N 3.13Å
46	S	77	Confident	88.6	Confident	91 Å²	91	63.1 Å²	63.1	64%	0.636	34%	0.337	S	S	*	.			trans	-60.7	115.8	168.7	-62.8	0	0	0	0	109.4	K21 D44	K21-S46 PolarHBondContact NZ-O 2.86Å; D44-S46 PolarHBondContact O-N 3.47Å
47	G	84.9	Confident	88.8	Confident	15 Å²	15	65.4 Å²	65.4	16%	0.155	35%	0.353	C	S	.	.			trans	-46.2	175.9	-170.8	0	0	0	0	0	117.9	K21 F22 V45	K21-G47 WeakPolarHBondContact CD-O 3.4Å; K21-G47 WeakPolarHBondContact CE-O 3.24Å; K21-G47 WeakPolarHBondContact CG-O 3.44Å; K21-G47 PolarHBondContact NZ-O 2.8Å; K21-G47 VanDerWaalsContact NZ-O 3.12Å; F22-G47 CarbonylContact O-C 3.38Å; F22-G47 VanDerWaalsContact O-CA 3.26Å; F22-G47 WeakPolarHBondContact O-CA 3.47Å; V45-G47 PolarHBondContact O-N 3.24Å; V45-G47 VanDerWaalsContact O-N 3.13Å
48	Y	89.5	Confident	89.2	Confident	35 Å²	35	65.1 Å²	65.1	14%	0.137	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-91.6	153.4	-169.7	61.9	-93.4	0	0	0	112.8	K21 F22 D24 V36 V52	K21-Y48 WeakPolarHBondContact CA-O 3.43Å; F22-Y48 HydrophobicContact CB-CD2 4.21Å; F22-Y48 HydrophobicContact CB-CE1 3.94Å; F22-Y48 HydrophobicContact CB-CE2 3.63Å; F22-Y48 VanDerWaalsContact CB-CZ 3.46Å; F22-Y48 HydrophobicContact CD2-CE2 4.44Å; F22-Y48 HydrophobicContact CG-CE2 4.36Å; F22-Y48 PolarHBondContact N-O 3.16Å; F22-Y48 WeakPolarHBondContact O-CD1 3.25Å; F22-Y48 WeakPolarHBondContact O-CE1 3.46Å; F22-Y48 PolarHBondContact O-N 2.82Å; D24-Y48 PolarHBondContact O-OH 2.71Å; V36-Y48 HydrophobicContact CB-CD1 4.29Å; V36-Y48 HydrophobicContact CB-CE1 4.47Å; V36-Y48 HydrophobicContact CG1-CD1 4.28Å; V36-Y48 HydrophobicContact CG1-CE1 3.99Å; V36-Y48 HydrophobicContact CG2-CD1 3.87Å; V36-Y48 HydrophobicContact CG2-CD2 4.09Å; V36-Y48 HydrophobicContact CG2-CE1 4.14Å; V36-Y48 HydrophobicContact CG2-CE2 4.33Å; V36-Y48 HydrophobicContact CG2-CG 3.84Å; Y48-V52 HydrophobicContact CD2-CB 4.29Å; Y48-V52 HydrophobicContact CD2-CG1 3.5Å; Y48-V52 HydrophobicContact CD2-CG2 3.85Å; Y48-V52 HydrophobicContact CE2-CG1 4.38Å; Y48-V52 HydrophobicContact CE2-CG2 4.09Å; Y48-V52 HydrophobicContact CG-CG1 3.86Å
49	G	90.4	Very high	89.6	Confident	13 Å²	13	60.4 Å²	60.4	13%	0.134	33%	0.333	C	S	.	.			trans	-102.9	-162.6	178.6	0	0	0	0	0	112.9	E51 V52	G49-E51 WeakPolarHBondContact CA-OE2 3.32Å; G49-E51 PolarHBondContact O-N 3.3Å; G49-V52 WeakPolarHBondContact O-CG2 3.39Å
50	L	91.5	Very high	90.1	Very high	131 Å²	131	63.1 Å²	63.1	69%	0.686	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-12.9	-178.7	-60.6	173.6	0	0	0	113.1	V52 D53	L50-V52 PolarHBondContact O-N 3.29Å; L50-D53 WeakPolarHBondContact O-CB 3.44Å; L50-D53 PolarHBondContact O-N 2.85Å
51	E	93.8	Very high	90.7	Very high	89 Å²	89	61.7 Å²	61.7	42%	0.416	33%	0.334	S	S	.	.	H	α-helix	trans	-63.7	-23.2	-178.5	-58.8	77.3	-169.6	0	0	112.2	G49 D53 M54 W55 P114 R117	G49-E51 WeakPolarHBondContact CA-OE2 3.32Å; G49-E51 PolarHBondContact O-N 3.3Å; E51-D53 PolarHBondContact O-N 3.22Å; E51-M54 WeakPolarHBondContact O-CB 3.04Å; E51-M54 PolarHBondContact O-N 3.22Å; E51-W55 PolarHBondContact O-N 3.44Å; E51-P114 HydrophobicContact CB-CB 4.13Å; E51-P114 HydrophobicContact CG-CB 4.38Å; E51-R117 WeakPolarHBondContact O-CD 3.14Å; E51-R117 PolarHBondContact O-NH1 2.66Å
52	V	94.9	Very high	91.3	Very high	19 Å²	19	56.9 Å²	56.9	12%	0.115	31%	0.31	C	S	.	.	H	α-helix	trans	-59.5	-32.4	176.3	-58.3	0	0	0	0	112.2	A33 E35 V36 Y48 G49 L50 M54 W55 A56	A33-V52 HydrophobicContact CB-CB 4.02Å; A33-V52 HydrophobicContact CB-CG1 3.97Å; E35-V52 HydrophobicContact CG-CG1 3.92Å; E35-V52 WeakPolarHBondContact OE1-CG1 3.08Å; V36-V52 HydrophobicContact CG2-CB 4.15Å; V36-V52 HydrophobicContact CG2-CG1 3.56Å; Y48-V52 HydrophobicContact CD2-CB 4.29Å; Y48-V52 HydrophobicContact CD2-CG1 3.5Å; Y48-V52 HydrophobicContact CD2-CG2 3.85Å; Y48-V52 HydrophobicContact CE2-CG1 4.38Å; Y48-V52 HydrophobicContact CE2-CG2 4.09Å; Y48-V52 HydrophobicContact CG-CG1 3.86Å; G49-V52 WeakPolarHBondContact O-CG2 3.39Å; L50-V52 PolarHBondContact O-N 3.29Å; V52-M54 PolarHBondContact O-N 3.31Å; V52-W55 WeakPolarHBondContact O-CB 3.47Å; V52-W55 PolarHBondContact O-N 3.15Å; V52-A56 PolarHBondContact O-N 3.12Å; V52-A56 VanDerWaalsContact O-N 3.12Å
53	D	95.5	Very high	91.9	Very high	99 Å²	99	52.3 Å²	52.3	53%	0.529	30%	0.296	S	S	.	.	H	α-helix	trans	-64.3	-34.6	177.1	-68.1	-22.2	0	0	0	110.5	L50 E51 A56 C57	L50-D53 WeakPolarHBondContact O-CB 3.44Å; L50-D53 PolarHBondContact O-N 2.85Å; E51-D53 PolarHBondContact O-N 3.22Å; D53-A56 PolarHBondContact O-N 3.5Å; D53-C57 WeakPolarHBondContact O-CB 3.28Å; D53-C57 PolarHBondContact O-N 3.06Å; D53-C57 PolarHBondContact O-SG 2.96Å; D53-C57 VanDerWaalsContact O-SG 3.34Å
54	M	97.7	Very high	92.8	Very high	21 Å²	21	50.4 Å²	50.4	10%	0.103	29%	0.286	C	S	.	.	H	α-helix	trans	-71.1	-32.7	179.3	-154.4	82.4	-81.1	0	0	112.8	E51 V52 C57 G58 M109 R117 I118 A120 A123	E51-M54 WeakPolarHBondContact O-CB 3.04Å; E51-M54 PolarHBondContact O-N 3.22Å; V52-M54 PolarHBondContact O-N 3.31Å; M54-C57 HydrophobicContact CE-CB 3.31Å; M54-G58 PolarHBondContact O-N 3.18Å; M54-M109 HydrophobicContact CE-CE 3.89Å; M54-M109 HydrophobicContact CE-SD 4.36Å; M54-M109 HydrophobicContact CG-CG 4.06Å; M54-M109 HydrophobicContact SD-CE 4.4Å; M54-R117 HydrophobicContact CB-CG 4.39Å; M54-I118 HydrophobicContact CG-CG2 4Å; M54-I118 VanDerWaalsContact CG-O 3.29Å; M54-I118 WeakPolarHBondContact CG-O 3.18Å; M54-A120 HydrophobicContact SD-CB 4.18Å; M54-A123 HydrophobicContact SD-CB 4.22Å
55	W	97.9	Very high	93.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.7	-49.3	169.8	177	-84.7	0	0	0	111	L32 A33 P34 E51 V52 C57 G58 V59 F71 I83 L110 V112	L32-W55 PolarHBondContact O-NE1 3.04Å; L32-W55 VanDerWaalsContact O-NE1 3.09Å; A33-W55 HydrophobicContact CB-CB 3.75Å; A33-W55 HydrophobicContact CB-CD2 4.28Å; A33-W55 HydrophobicContact CB-CG 3.71Å; P34-W55 HydrophobicContact CG-CE3 4.21Å; P34-W55 HydrophobicContact CG-CH2 3.63Å; P34-W55 HydrophobicContact CG-CZ2 4.01Å; P34-W55 HydrophobicContact CG-CZ3 3.74Å; E51-W55 PolarHBondContact O-N 3.44Å; V52-W55 WeakPolarHBondContact O-CB 3.47Å; V52-W55 PolarHBondContact O-N 3.15Å; W55-C57 VanDerWaalsContact C-N 3.31Å; W55-C57 PolarHBondContact O-N 3.26Å; W55-G58 WeakPolarHBondContact O-CA 3.38Å; W55-G58 PolarHBondContact O-N 3.13Å; W55-V59 PolarHBondContact O-N 2.99Å; W55-F71 AromaticContact CE2-CE2 3.99Å; W55-F71 HydrophobicContact CH2-CE2 4.02Å; W55-F71 AromaticContact CH2-CZ 3.7Å; W55-F71 HydrophobicContact CH2-CZ 3.7Å; W55-F71 HydrophobicContact CZ2-CD2 4.22Å; W55-F71 HydrophobicContact CZ2-CE1 4.46Å; W55-F71 AromaticContact CZ2-CE2 3.32Å; W55-F71 HydrophobicContact CZ2-CE2 3.32Å; W55-F71 AromaticContact CZ2-CZ 3.48Å; W55-F71 HydrophobicContact CZ2-CZ 3.48Å; W55-F71 VanDerWaalsContact CZ2-CZ 3.48Å; W55-I83 HydrophobicContact CZ2-CG2 3.85Å; W55-L110 HydrophobicContact CD2-CD2 3.98Å; W55-L110 HydrophobicContact CE3-CD2 4.16Å; W55-L110 HydrophobicContact CG-CD2 4.41Å; W55-L110 HydrophobicContact CZ2-CD2 4.46Å; W55-L110 HydrophobicContact CZ3-CB 4.3Å; W55-L110 HydrophobicContact CZ3-CD2 4.49Å; W55-L110 WeakPolarHBondContact CZ3-O 3.21Å; W55-V112 HydrophobicContact CZ3-CG2 4.5Å
56	A	97.2	Very high	94.4	Very high	24 Å²	24	45.7 Å²	45.7	20%	0.198	26%	0.259	C	S	.	.	H	α-helix	trans	-59.6	-42.2	178.9	0	0	0	0	0	111.7	V52 D53 G58 V59 I60	V52-A56 PolarHBondContact O-N 3.12Å; V52-A56 VanDerWaalsContact O-N 3.12Å; D53-A56 PolarHBondContact O-N 3.5Å; A56-G58 VanDerWaalsContact C-N 3.32Å; A56-G58 PolarHBondContact O-N 3.23Å; A56-V59 PolarHBondContact O-N 3.07Å; A56-I60 VanDerWaalsContact O-CG1 3.29Å; A56-I60 WeakPolarHBondContact O-CG1 3.42Å; A56-I60 PolarHBondContact O-N 3.4Å
57	C	97.6	Very high	95.2	Very high	55 Å²	55	44.5 Å²	44.5	37%	0.372	26%	0.261	S	S	.	.	H	α-helix	trans	-59.7	-39.6	171.7	-74.9	0	0	0	0	112.7	D53 M54 W55 I60 M61 M109	D53-C57 WeakPolarHBondContact O-CB 3.28Å; D53-C57 PolarHBondContact O-N 3.06Å; D53-C57 PolarHBondContact O-SG 2.96Å; D53-C57 VanDerWaalsContact O-SG 3.34Å; M54-C57 HydrophobicContact CE-CB 3.31Å; W55-C57 VanDerWaalsContact C-N 3.31Å; W55-C57 PolarHBondContact O-N 3.26Å; C57-I60 PolarHBondContact O-N 3.44Å; C57-M61 VanDerWaalsContact O-CB 3.28Å; C57-M61 WeakPolarHBondContact O-CB 3.48Å; C57-M61 PolarHBondContact O-N 3.35Å; C57-M109 HydrophobicContact CB-SD 4.44Å
58	G	98	Very high	95.7	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.4	-43.3	174.1	0	0	0	0	0	112.5	M54 W55 A56 M61 Y62	M54-G58 PolarHBondContact O-N 3.18Å; W55-G58 WeakPolarHBondContact O-CA 3.38Å; W55-G58 PolarHBondContact O-N 3.13Å; A56-G58 VanDerWaalsContact C-N 3.32Å; A56-G58 PolarHBondContact O-N 3.23Å; G58-M61 PolarHBondContact O-N 3.18Å; G58-Y62 WeakPolarHBondContact O-CB 3.44Å; G58-Y62 PolarHBondContact O-N 3.36Å
59	V	98.1	Very high	96	Very high	2 Å²	2	47 Å²	47	1%	0.012	28%	0.275	C	S	.	.	H	α-helix	trans	-62.5	-44.4	175.1	175.6	0	0	0	0	111.1	Y31 W55 A56 T63 P70 F71 L110	Y31-V59 HydrophobicContact CD1-CB 4.12Å; Y31-V59 HydrophobicContact CD1-CG1 3.59Å; Y31-V59 HydrophobicContact CE1-CG1 3.83Å; Y31-V59 HydrophobicContact CG-CG1 4.36Å; W55-V59 PolarHBondContact O-N 2.99Å; A56-V59 PolarHBondContact O-N 3.07Å; V59-T63 WeakPolarHBondContact O-CB 3.45Å; V59-T63 PolarHBondContact O-N 2.9Å; V59-T63 PolarHBondContact O-OG1 3.41Å; V59-P70 HydrophobicContact CB-CG 4.36Å; V59-P70 HydrophobicContact CG1-CG 4.11Å; V59-P70 HydrophobicContact CG2-CG 4.2Å; V59-F71 HydrophobicContact CG2-CD2 4.28Å; V59-F71 HydrophobicContact CG2-CE2 4.14Å; V59-L110 HydrophobicContact CG2-CD2 3.89Å
60	I	97.9	Very high	96.3	Very high	76 Å²	76	47.1 Å²	47.1	39%	0.39	27%	0.273	S	S	.	.	H	α-helix	trans	-63.6	-48.9	177.6	-68.4	164.7	0	0	0	110.3	Y31 A56 C57 Y62 T63 L64	Y31-I60 HydrophobicContact CD1-CG1 4.14Å; Y31-I60 HydrophobicContact CE1-CG1 3.96Å; A56-I60 VanDerWaalsContact O-CG1 3.29Å; A56-I60 WeakPolarHBondContact O-CG1 3.42Å; A56-I60 PolarHBondContact O-N 3.4Å; C57-I60 PolarHBondContact O-N 3.44Å; I60-Y62 PolarHBondContact O-N 3.01Å; I60-T63 PolarHBondContact O-N 2.89Å; I60-T63 VanDerWaalsContact O-N 3.11Å; I60-L64 HydrophobicContact CG2-CD1 3.7Å; I60-L64 HydrophobicContact CG2-CG 4.08Å; I60-L64 VanDerWaalsContact O-CG 3.29Å; I60-L64 WeakPolarHBondContact O-CG 3.35Å; I60-L64 PolarHBondContact O-N 2.91Å
61	M	97.4	Very high	96.6	Very high	23 Å²	23	41.1 Å²	41.1	11%	0.113	24%	0.242	C	C	.	.	H	α-helix	trans	-60.4	-44.8	-179.7	-178.8	177.8	162.3	0	0	111.6	C57 G58 T63 L64 L65 A102 L105 I106 M109 F128	C57-M61 VanDerWaalsContact O-CB 3.28Å; C57-M61 WeakPolarHBondContact O-CB 3.48Å; C57-M61 PolarHBondContact O-N 3.35Å; G58-M61 PolarHBondContact O-N 3.18Å; M61-T63 VanDerWaalsContact C-N 3.31Å; M61-T63 PolarHBondContact O-N 2.97Å; M61-L64 PolarHBondContact O-N 3.48Å; M61-L65 HydrophobicContact CE-CD1 3.94Å; M61-L65 HydrophobicContact CG-CD1 4.12Å; M61-L65 WeakPolarHBondContact O-CG 3.5Å; M61-L65 PolarHBondContact O-N 3.49Å; M61-A102 HydrophobicContact CE-CB 4.01Å; M61-L105 HydrophobicContact CE-CB 4.17Å; M61-L105 HydrophobicContact CE-CD2 3.94Å; M61-L105 HydrophobicContact CE-CG 4.28Å; M61-L105 HydrophobicContact SD-CD2 3.88Å; M61-L105 HydrophobicContact SD-CG 4.17Å; M61-I106 HydrophobicContact CB-CG1 4.49Å; M61-I106 HydrophobicContact CE-CD1 4.15Å; M61-I106 HydrophobicContact CE-CG1 3.84Å; M61-I106 HydrophobicContact CG-CD1 4.2Å; M61-I106 HydrophobicContact CG-CG1 4.05Å; M61-I106 HydrophobicContact SD-CG1 3.9Å; M61-M109 HydrophobicContact SD-SD 4.28Å; M61-F128 HydrophobicContact CE-CD1 4.3Å; M61-F128 HydrophobicContact CE-CD2 4.28Å; M61-F128 HydrophobicContact CE-CE1 4.08Å; M61-F128 HydrophobicContact CE-CE2 4.06Å; M61-F128 HydrophobicContact CE-CG 4.4Å; M61-F128 HydrophobicContact CE-CZ 3.95Å
62	Y	98.1	Very high	96.6	Very high	3 Å²	3	45.3 Å²	45.3	1%	0.012	26%	0.255	C	S	.	.	H	α-helix	trans	-54.9	-49.9	173.1	-173.5	-72.4	0	0	0	110.7	G58 I60 L64 L65 C66 Y68 P70 Y88 E89 F90 W95 I106	G58-Y62 WeakPolarHBondContact O-CB 3.44Å; G58-Y62 PolarHBondContact O-N 3.36Å; I60-Y62 PolarHBondContact O-N 3.01Å; Y62-L64 PolarHBondContact O-N 2.84Å; Y62-L65 PolarHBondContact O-N 3.13Å; Y62-C66 WeakPolarHBondContact CE1-SG 3.37Å; Y62-C66 PolarHBondContact O-N 2.97Å; Y62-C66 PolarHBondContact O-SG 2.93Å; Y62-Y68 VanDerWaalsContact CD1-O 3.23Å; Y62-Y68 WeakPolarHBondContact CD1-O 3.47Å; Y62-Y68 AromaticContact CE1-CD2 3.82Å; Y62-Y68 HydrophobicContact CE1-CD2 3.82Å; Y62-Y68 AromaticContact CE1-CE2 3.53Å; Y62-Y68 HydrophobicContact CE1-CE2 3.53Å; Y62-Y68 WeakPolarHBondContact CE1-O 3.46Å; Y62-Y68 AromaticContact CZ-CE2 3.82Å; Y62-Y68 WeakPolarHBondContact OH-CE2 3.19Å; Y62-Y68 PolarHBondContact OH-OH 3.14Å; Y62-P70 HydrophobicContact CD1-CB 3.8Å; Y62-P70 VanDerWaalsContact CD1-CD 3.49Å; Y62-P70 HydrophobicContact CD1-CG 4.04Å; Y62-P70 HydrophobicContact CD2-CB 3.85Å; Y62-P70 HydrophobicContact CD2-CG 4.45Å; Y62-P70 HydrophobicContact CE1-CB 4Å; Y62-P70 HydrophobicContact CE2-CB 4.05Å; Y62-P70 HydrophobicContact CG-CB 3.75Å; Y62-P70 HydrophobicContact CG-CG 3.94Å; Y62-Y88 HydrophobicContact CD2-CD2 4.38Å; Y62-Y88 HydrophobicContact CE2-CD2 4.03Å; Y62-E89 PolarHBondContact OH-O 2.99Å; Y62-F90 HydrophobicContact CD2-CD1 4.31Å; Y62-F90 AromaticContact CD2-CE1 3.98Å; Y62-F90 HydrophobicContact CD2-CE1 3.98Å; Y62-F90 AromaticContact CE2-CD1 3.72Å; Y62-F90 HydrophobicContact CE2-CD1 3.72Å; Y62-F90 AromaticContact CE2-CE1 3.83Å; Y62-F90 HydrophobicContact CE2-CE1 3.83Å; Y62-W95 HydrophobicContact CD1-CZ2 4.01Å; Y62-W95 HydrophobicContact CD2-CH2 4.01Å; Y62-W95 AromaticContact CD2-CZ2 3.48Å; Y62-W95 HydrophobicContact CD2-CZ2 3.48Å; Y62-W95 VanDerWaalsContact CD2-CZ2 3.48Å; Y62-W95 AromaticContact CE1-CZ2 3.96Å; Y62-W95 HydrophobicContact CE1-CZ2 3.96Å; Y62-W95 AromaticContact CE2-CE2 3.8Å; Y62-W95 HydrophobicContact CE2-CH2 4.27Å; Y62-W95 AromaticContact CE2-CZ2 3.42Å; Y62-W95 HydrophobicContact CE2-CZ2 3.42Å; Y62-W95 VanDerWaalsContact CE2-CZ2 3.42Å; Y62-W95 AromaticContact CE2-NE1 3.93Å; Y62-W95 HydrophobicContact CG-CH2 4.34Å; Y62-W95 AromaticContact CG-CZ2 3.76Å; Y62-W95 HydrophobicContact CG-CZ2 3.76Å; Y62-W95 AromaticContact CZ-CE2 3.77Å; Y62-W95 AromaticContact CZ-CZ2 3.64Å; Y62-W95 AromaticContact CZ-NE1 3.47Å; Y62-W95 PolarHBondContact OH-NE1 3.22Å; Y62-W95 VanDerWaalsContact OH-NE1 3.15Å; Y62-I106 HydrophobicContact CD2-CD1 4.45Å; Y62-I106 HydrophobicContact CD2-CG2 4.15Å
63	T	96.9	Very high	96.6	Very high	37 Å²	37	48.4 Å²	48.4	23%	0.227	27%	0.268	C	S	.	.	H	α-helix	trans	-64.6	-38.4	-177.8	-52.2	0	0	0	0	112.5	V59 I60 M61 L65 G67 Y68	V59-T63 WeakPolarHBondContact O-CB 3.45Å; V59-T63 PolarHBondContact O-N 2.9Å; V59-T63 PolarHBondContact O-OG1 3.41Å; I60-T63 PolarHBondContact O-N 2.89Å; I60-T63 VanDerWaalsContact O-N 3.11Å; M61-T63 VanDerWaalsContact C-N 3.31Å; M61-T63 PolarHBondContact O-N 2.97Å; T63-L65 VanDerWaalsContact C-N 3.32Å; T63-L65 PolarHBondContact O-N 3.17Å; T63-G67 WeakPolarHBondContact O-CA 3.29Å; T63-G67 PolarHBondContact O-N 2.95Å; T63-Y68 WeakPolarHBondContact CA-O 3.5Å
64	L	96.8	Very high	96.5	Very high	140 Å²	140	52.9 Å²	52.9	73%	0.733	28%	0.283	S	S	*	.	H	α-helix	trans	-67.3	-32.7	179.2	-72.4	173.9	0	0	0	112.6	I60 M61 Y62	I60-L64 HydrophobicContact CG2-CD1 3.7Å; I60-L64 HydrophobicContact CG2-CG 4.08Å; I60-L64 VanDerWaalsContact O-CG 3.29Å; I60-L64 WeakPolarHBondContact O-CG 3.35Å; I60-L64 PolarHBondContact O-N 2.91Å; M61-L64 PolarHBondContact O-N 3.48Å; Y62-L64 PolarHBondContact O-N 2.84Å
65	L	96.1	Very high	96.4	Very high	68 Å²	68	59.9 Å²	59.9	36%	0.356	31%	0.308	S	S	.	.	H	α-helix	trans	-83.2	-38.1	-176.1	-68.5	173.8	0	0	0	113.1	M61 Y62 T63 W95 I98 A102 I106	M61-L65 HydrophobicContact CE-CD1 3.94Å; M61-L65 HydrophobicContact CG-CD1 4.12Å; M61-L65 WeakPolarHBondContact O-CG 3.5Å; M61-L65 PolarHBondContact O-N 3.49Å; Y62-L65 PolarHBondContact O-N 3.13Å; T63-L65 VanDerWaalsContact C-N 3.32Å; T63-L65 PolarHBondContact O-N 3.17Å; L65-W95 HydrophobicContact CB-CH2 4.13Å; L65-W95 HydrophobicContact CD1-CH2 4.17Å; L65-W95 HydrophobicContact CD1-CZ3 4.32Å; L65-I98 HydrophobicContact CB-CD1 3.89Å; L65-I98 HydrophobicContact CD1-CG2 4.36Å; L65-A102 HydrophobicContact CD1-CB 4Å; L65-I106 HydrophobicContact CD1-CD1 4.07Å
66	C	95	Very high	96.1	Very high	18 Å²	18	66.2 Å²	66.2	12%	0.122	34%	0.337	C	S	.	.	H	α-helix	trans	-114.5	-6.6	-175.9	73.6	0	0	0	0	114.8	Y62 Y68 E94 W95 I98	Y62-C66 WeakPolarHBondContact CE1-SG 3.37Å; Y62-C66 PolarHBondContact O-N 2.97Å; Y62-C66 PolarHBondContact O-SG 2.93Å; C66-Y68 HydrophobicContact CB-CD1 4.09Å; C66-Y68 HydrophobicContact CB-CE1 3.69Å; C66-Y68 WeakPolarHBondContact O-CD1 3.23Å; C66-Y68 WeakPolarHBondContact SG-CD1 3.26Å; C66-Y68 WeakPolarHBondContact SG-CE1 3.4Å; C66-Y68 VanDerWaalsContact SG-CZ 3.59Å; C66-Y68 PolarHBondContact SG-O 3.14Å; C66-E94 HydrophobicContact CB-CB 4.01Å; C66-W95 HydrophobicContact CB-CZ2 3.89Å; C66-I98 HydrophobicContact CB-CD1 4.45Å
67	G	95	Very high	95.9	Very high	66 Å²	66	71.6 Å²	71.6	68%	0.68	36%	0.362	S	S	*	.	S	Bend	trans	82	6.6	177.1	0	0	0	0	0	116	T63	T63-G67 WeakPolarHBondContact O-CA 3.29Å; T63-G67 PolarHBondContact O-N 2.95Å
68	Y	95.2	Very high	95.9	Very high	64 Å²	64	74.5 Å²	74.5	25%	0.251	37%	0.366	S	S	.	.	S	Bend	trans	-141.8	156.1	177.3	63.2	-93.4	0	0	0	112.4	Y62 T63 C66 E94 W95	Y62-Y68 VanDerWaalsContact CD1-O 3.23Å; Y62-Y68 WeakPolarHBondContact CD1-O 3.47Å; Y62-Y68 AromaticContact CE1-CD2 3.82Å; Y62-Y68 HydrophobicContact CE1-CD2 3.82Å; Y62-Y68 AromaticContact CE1-CE2 3.53Å; Y62-Y68 HydrophobicContact CE1-CE2 3.53Å; Y62-Y68 WeakPolarHBondContact CE1-O 3.46Å; Y62-Y68 AromaticContact CZ-CE2 3.82Å; Y62-Y68 WeakPolarHBondContact OH-CE2 3.19Å; Y62-Y68 PolarHBondContact OH-OH 3.14Å; T63-Y68 WeakPolarHBondContact CA-O 3.5Å; C66-Y68 HydrophobicContact CB-CD1 4.09Å; C66-Y68 HydrophobicContact CB-CE1 3.69Å; C66-Y68 WeakPolarHBondContact O-CD1 3.23Å; C66-Y68 WeakPolarHBondContact SG-CD1 3.26Å; C66-Y68 WeakPolarHBondContact SG-CE1 3.4Å; C66-Y68 VanDerWaalsContact SG-CZ 3.59Å; C66-Y68 PolarHBondContact SG-O 3.14Å; Y68-E94 HydrophobicContact CE1-CB 4.26Å; Y68-E94 HydrophobicContact CE1-CG 4.13Å; Y68-W95 AromaticContact CZ-NE1 3.9Å; Y68-W95 VanDerWaalsContact OH-CD1 3.3Å; Y68-W95 PolarHBondContact OH-NE1 3.29Å
69	A	95.9	Very high	95.8	Very high	39 Å²	39	75.7 Å²	75.7	32%	0.322	37%	0.372	S	S	.	.			trans	-75.7	143.1	-178.1	0	0	0	0	0	112.2	F71	A69-F71 VanDerWaalsContact C-N 3.3Å; A69-F71 PolarHBondContact O-N 3.17Å
70	P	96.5	Very high	95.6	Very high	16 Å²	16	77.4 Å²	77.4	10%	0.104	38%	0.38	C	S	.	.	S	Bend	trans	-65.7	-33.1	178.5	24.2	-31.3	0	0	0	112.7	V59 Y62 Y88 L110	V59-P70 HydrophobicContact CB-CG 4.36Å; V59-P70 HydrophobicContact CG1-CG 4.11Å; V59-P70 HydrophobicContact CG2-CG 4.2Å; Y62-P70 HydrophobicContact CD1-CB 3.8Å; Y62-P70 VanDerWaalsContact CD1-CD 3.49Å; Y62-P70 HydrophobicContact CD1-CG 4.04Å; Y62-P70 HydrophobicContact CD2-CB 3.85Å; Y62-P70 HydrophobicContact CD2-CG 4.45Å; Y62-P70 HydrophobicContact CE1-CB 4Å; Y62-P70 HydrophobicContact CE2-CB 4.05Å; Y62-P70 HydrophobicContact CG-CB 3.75Å; Y62-P70 HydrophobicContact CG-CG 3.94Å; P70-Y88 HydrophobicContact CB-CG 4.42Å; P70-L110 HydrophobicContact CB-CD1 4.42Å; P70-L110 HydrophobicContact CG-CD1 4.4Å
71	F	96.2	Very high	95.5	Very high	5 Å²	5	80.3 Å²	80.3	2%	0.022	39%	0.386	C	S	.	.	S	Bend	trans	-114.8	94.2	179.8	-49.2	-72.7	0	0	0	109.8	W55 V59 A69 M79 A82 I83 R87 Y88 L110	W55-F71 AromaticContact CE2-CE2 3.99Å; W55-F71 HydrophobicContact CH2-CE2 4.02Å; W55-F71 AromaticContact CH2-CZ 3.7Å; W55-F71 HydrophobicContact CH2-CZ 3.7Å; W55-F71 HydrophobicContact CZ2-CD2 4.22Å; W55-F71 HydrophobicContact CZ2-CE1 4.46Å; W55-F71 AromaticContact CZ2-CE2 3.32Å; W55-F71 HydrophobicContact CZ2-CE2 3.32Å; W55-F71 AromaticContact CZ2-CZ 3.48Å; W55-F71 HydrophobicContact CZ2-CZ 3.48Å; W55-F71 VanDerWaalsContact CZ2-CZ 3.48Å; V59-F71 HydrophobicContact CG2-CD2 4.28Å; V59-F71 HydrophobicContact CG2-CE2 4.14Å; A69-F71 VanDerWaalsContact C-N 3.3Å; A69-F71 PolarHBondContact O-N 3.17Å; F71-M79 HydrophobicContact CB-CG 4.29Å; F71-A82 HydrophobicContact CD1-CB 4.21Å; F71-I83 HydrophobicContact CB-CD1 4.19Å; F71-I83 HydrophobicContact CB-CG1 3.66Å; F71-I83 HydrophobicContact CD1-CG1 4.02Å; F71-I83 HydrophobicContact CD2-CG1 3.82Å; F71-I83 HydrophobicContact CG-CG1 3.55Å; F71-R87 WeakPolarHBondContact CE1-O 3.39Å; F71-Y88 HydrophobicContact CE1-CD1 4.12Å; F71-Y88 HydrophobicContact CE1-CG 4.41Å; F71-Y88 AromaticContact CZ-CD1 3.95Å; F71-Y88 HydrophobicContact CZ-CD1 3.95Å; F71-Y88 HydrophobicContact CZ-CG 4.41Å; F71-L110 HydrophobicContact CE2-CD1 4.39Å; F71-L110 HydrophobicContact CE2-CD2 4.29Å; F71-L110 HydrophobicContact CZ-CD1 4.42Å
72	Y	94	Very high	95.4	Very high	177 Å²	177	80.3 Å²	80.3	69%	0.694	39%	0.39	S	S	*	.			trans	-133	130.2	175.4	-179.8	-96.7	0	0	0	111.3	M79	Y72-M79 HydrophobicContact CD2-CE 4.48Å
73	H	94.6	Very high	95.4	Very high	83 Å²	83	80.2 Å²	80.2	38%	0.384	39%	0.39	S	S	.	.			trans	-151.9	144.2	171.2	-165.3	-88.2	0	0	0	110.4	R75 Y78 M79	H73-R75 PolarHBondContact ND1-N 3.02Å; H73-R75 VanDerWaalsContact ND1-N 3.11Å; H73-R75 PolarHBondContact ND1-O 3.13Å; H73-R75 PolarHBondContact O-N 2.95Å; H73-Y78 AromaticContact CE1-CD2 3.39Å; H73-Y78 WeakPolarHBondContact CE1-CD2 3.39Å; H73-Y78 AromaticContact ND1-CD2 3.67Å; H73-M79 HydrophobicContact CB-CB 4.08Å
74	K	94	Very high	95.3	Very high	193 Å²	193	80.6 Å²	80.6	84%	0.839	39%	0.394	S	S	*	.	S	Bend	trans	-57.2	-38	-179.5	-68.4	-175.5	178.4	-178.8	0	112.8
75	R	94.9	Very high	95.2	Very high	169 Å²	169	77.1 Å²	77.1	64%	0.638	37%	0.374	S	S	*	.	S	Bend	trans	-97	122.4	172.9	-62.6	-179.1	177.6	-172.1	1.6	109.7	H73 I77 Y78 M79	H73-R75 PolarHBondContact ND1-N 3.02Å; H73-R75 VanDerWaalsContact ND1-N 3.11Å; H73-R75 PolarHBondContact ND1-O 3.13Å; H73-R75 PolarHBondContact O-N 2.95Å; R75-I77 VanDerWaalsContact C-N 3.28Å; R75-I77 PolarHBondContact O-N 3.11Å; R75-Y78 HydrophobicContact CB-CD2 3.9Å; R75-Y78 HydrophobicContact CB-CE2 4.47Å; R75-Y78 PolarHBondContact O-N 2.98Å; R75-M79 PolarHBondContact O-N 2.86Å
76	Q	92.6	Very high	95.2	Very high	132 Å²	132	74.7 Å²	74.7	62%	0.617	37%	0.366	S	S	*	.	H	α-helix	trans	-56.4	-37.8	-177.6	-69.4	-176.9	-7.5	0	0	113.2	Y78 M79 L80	Q76-Y78 VanDerWaalsContact C-N 3.3Å; Q76-Y78 PolarHBondContact O-N 3.15Å; Q76-M79 WeakPolarHBondContact O-CB 3.27Å; Q76-M79 PolarHBondContact O-N 2.93Å; Q76-L80 WeakPolarHBondContact O-CG 3.29Å; Q76-L80 PolarHBondContact O-N 3.37Å
77	I	93.9	Very high	95.2	Very high	138 Å²	138	81.2 Å²	81.2	71%	0.708	39%	0.388	S	S	*	.	H	α-helix	trans	-56.7	-42.1	-179.2	-62.2	170.1	0	0	0	112.1	R75 R81	R75-I77 VanDerWaalsContact C-N 3.28Å; R75-I77 PolarHBondContact O-N 3.11Å; I77-R81 WeakPolarHBondContact O-CB 3.28Å; I77-R81 PolarHBondContact O-N 2.83Å
78	Y	95.7	Very high	95.3	Very high	116 Å²	116	80.3 Å²	80.3	46%	0.455	36%	0.364	S	S	.	.	H	α-helix	trans	-73.3	-32.3	178.4	-66.3	-60.3	0	0	0	112.5	H73 R75 Q76 R81 A82	H73-Y78 AromaticContact CE1-CD2 3.39Å; H73-Y78 WeakPolarHBondContact CE1-CD2 3.39Å; H73-Y78 AromaticContact ND1-CD2 3.67Å; R75-Y78 HydrophobicContact CB-CD2 3.9Å; R75-Y78 HydrophobicContact CB-CE2 4.47Å; R75-Y78 PolarHBondContact O-N 2.98Å; Q76-Y78 VanDerWaalsContact C-N 3.3Å; Q76-Y78 PolarHBondContact O-N 3.15Å; Y78-R81 PolarHBondContact O-N 3.13Å; Y78-A82 WeakPolarHBondContact O-CB 3.36Å; Y78-A82 PolarHBondContact O-N 2.94Å
79	M	96	Very high	95.3	Very high	25 Å²	25	83.2 Å²	83.2	12%	0.123	38%	0.38	C	S	.	.	H	α-helix	trans	-63.6	-49.4	171.9	179.8	-158.7	-67.3	0	0	110.6	F71 Y72 H73 R75 Q76 R81 A82 I83	F71-M79 HydrophobicContact CB-CG 4.29Å; Y72-M79 HydrophobicContact CD2-CE 4.48Å; H73-M79 HydrophobicContact CB-CB 4.08Å; R75-M79 PolarHBondContact O-N 2.86Å; Q76-M79 WeakPolarHBondContact O-CB 3.27Å; Q76-M79 PolarHBondContact O-N 2.93Å; M79-R81 VanDerWaalsContact C-N 3.26Å; M79-R81 PolarHBondContact O-N 3.09Å; M79-A82 WeakPolarHBondContact O-CB 3.36Å; M79-A82 PolarHBondContact O-N 3.43Å; M79-A82 VanDerWaalsContact O-N 3.14Å; M79-I83 HydrophobicContact CG-CD1 4.13Å; M79-I83 WeakPolarHBondContact O-CG1 3.41Å; M79-I83 PolarHBondContact O-N 3.23Å
80	L	94.6	Very high	95.4	Very high	38 Å²	38	83.7 Å²	83.7	20%	0.199	38%	0.375	C	S	.	.	H	α-helix	trans	-61.6	-35.7	177.9	-66	178	0	0	0	112	P29 L37 Q76 I83 S84	P29-L80 HydrophobicContact CB-CD2 4.24Å; L37-L80 HydrophobicContact CD1-CB 4.41Å; L37-L80 HydrophobicContact CD1-CD2 3.84Å; L37-L80 HydrophobicContact CD2-CD2 3.86Å; Q76-L80 WeakPolarHBondContact O-CG 3.29Å; Q76-L80 PolarHBondContact O-N 3.37Å; L80-I83 HydrophobicContact CD2-CD1 4.44Å; L80-S84 WeakPolarHBondContact O-CB 3.17Å; L80-S84 PolarHBondContact O-N 3.24Å; L80-S84 PolarHBondContact O-OG 3.34Å
81	R	95.8	Very high	95.2	Very high	137 Å²	137	90.2 Å²	90.2	52%	0.517	40%	0.397	S	S	.	.	H	α-helix	trans	-65	-46.7	172.5	-176.8	176.9	179.1	172.7	4.2	111.9	I77 Y78 M79 I83 S84 E85	I77-R81 WeakPolarHBondContact O-CB 3.28Å; I77-R81 PolarHBondContact O-N 2.83Å; Y78-R81 PolarHBondContact O-N 3.13Å; M79-R81 VanDerWaalsContact C-N 3.26Å; M79-R81 PolarHBondContact O-N 3.09Å; R81-I83 VanDerWaalsContact C-N 3.29Å; R81-I83 PolarHBondContact O-N 3.29Å; R81-S84 PolarHBondContact O-N 3.44Å; R81-E85 HydrophobicContact CG-CG 4.35Å; R81-E85 IonicContact CZ-OE1 3.58Å; R81-E85 IonicContact NE-OE1 3.85Å; R81-E85 PolarHBondContact NE-OE1 3.46Å; R81-E85 IonicContact NE-OE2 3.3Å; R81-E85 IonicContact NH2-OE1 2.69Å; R81-E85 PolarHBondContact NH2-OE1 3.44Å; R81-E85 WeakPolarHBondContact O-CB 3.38Å; R81-E85 WeakPolarHBondContact O-CG 3.48Å; R81-E85 PolarHBondContact O-N 3.43Å
82	A	96.5	Very high	95.1	Very high	23 Å²	23	93.8 Å²	93.8	19%	0.19	42%	0.423	C	S	.	.	H	α-helix	trans	-60.6	-39.9	176.9	0	0	0	0	0	111.8	F71 Y78 M79 G86 R87	F71-A82 HydrophobicContact CD1-CB 4.21Å; Y78-A82 WeakPolarHBondContact O-CB 3.36Å; Y78-A82 PolarHBondContact O-N 2.94Å; M79-A82 WeakPolarHBondContact O-CB 3.36Å; M79-A82 PolarHBondContact O-N 3.43Å; M79-A82 VanDerWaalsContact O-N 3.14Å; A82-G86 CarbonylContact O-C 3.6Å; A82-G86 WeakPolarHBondContact O-CA 3.37Å; A82-G86 PolarHBondContact O-N 3.35Å; A82-R87 PolarHBondContact O-N 2.97Å
83	I	96.5	Very high	95.1	Very high	0 Å²	0	89.6 Å²	89.6	0%	0	42%	0.417	C	S	.	.	H	α-helix	trans	-60.3	-53.3	171.8	-68.5	166.5	0	0	0	109.9	P29 L32 P34 L37 W55 F71 M79 L80 R81 E85 G86	P29-I83 WeakPolarHBondContact O-CD1 3.32Å; L32-I83 WeakPolarHBondContact O-CG2 3.35Å; P34-I83 HydrophobicContact CG-CG2 4.22Å; P34-I83 WeakPolarHBondContact CG-O 3.47Å; L37-I83 HydrophobicContact CD1-CB 4.16Å; L37-I83 HydrophobicContact CD1-CG2 3.65Å; W55-I83 HydrophobicContact CZ2-CG2 3.85Å; F71-I83 HydrophobicContact CB-CD1 4.19Å; F71-I83 HydrophobicContact CB-CG1 3.66Å; F71-I83 HydrophobicContact CD1-CG1 4.02Å; F71-I83 HydrophobicContact CD2-CG1 3.82Å; F71-I83 HydrophobicContact CG-CG1 3.55Å; M79-I83 HydrophobicContact CG-CD1 4.13Å; M79-I83 WeakPolarHBondContact O-CG1 3.41Å; M79-I83 PolarHBondContact O-N 3.23Å; L80-I83 HydrophobicContact CD2-CD1 4.44Å; R81-I83 VanDerWaalsContact C-N 3.29Å; R81-I83 PolarHBondContact O-N 3.29Å; I83-E85 PolarHBondContact O-N 3.17Å; I83-G86 PolarHBondContact O-N 3.47Å
84	S	94.8	Very high	95.1	Very high	45 Å²	45	90 Å²	90	32%	0.315	42%	0.419	S	S	.	.	H	α-helix	trans	-59.2	-34	-177.5	-58.8	0	0	0	0	113.1	L80 R81	L80-S84 WeakPolarHBondContact O-CB 3.17Å; L80-S84 PolarHBondContact O-N 3.24Å; L80-S84 PolarHBondContact O-OG 3.34Å; R81-S84 PolarHBondContact O-N 3.44Å
85	E	96	Very high	95.1	Very high	67 Å²	67	80.9 Å²	80.9	31%	0.313	38%	0.379	S	S	.	.	H	α-helix	trans	-89.9	-7.5	177.7	-64.7	170.2	163.3	0	0	113	R81 I83 R87	R81-E85 HydrophobicContact CG-CG 4.35Å; R81-E85 IonicContact CZ-OE1 3.58Å; R81-E85 IonicContact NE-OE1 3.85Å; R81-E85 PolarHBondContact NE-OE1 3.46Å; R81-E85 IonicContact NE-OE2 3.3Å; R81-E85 IonicContact NH2-OE1 2.69Å; R81-E85 PolarHBondContact NH2-OE1 3.44Å; R81-E85 WeakPolarHBondContact O-CB 3.38Å; R81-E85 WeakPolarHBondContact O-CG 3.48Å; R81-E85 PolarHBondContact O-N 3.43Å; I83-E85 PolarHBondContact O-N 3.17Å; E85-R87 VanDerWaalsContact C-N 3.29Å; E85-R87 HydrophobicContact CB-CG 3.82Å; E85-R87 PolarHBondContact O-N 2.88Å; E85-R87 IonicContact OE1-CZ 3.85Å; E85-R87 IonicContact OE1-NH1 3.44Å; E85-R87 IonicContact OE1-NH2 2.84Å; E85-R87 VanDerWaalsContact OE2-CD 3.24Å; E85-R87 WeakPolarHBondContact OE2-CD 3.39Å; E85-R87 IonicContact OE2-CZ 2.8Å; E85-R87 IonicContact OE2-NE 3.1Å; E85-R87 PolarHBondContact OE2-NE 3.19Å; E85-R87 IonicContact OE2-NH1 3.74Å; E85-R87 PolarHBondContact OE2-NH1 2.81Å; E85-R87 IonicContact OE2-NH2 3.29Å; E85-R87 PolarHBondContact OE2-NH2 2.75Å
86	G	95.6	Very high	95.1	Very high	18 Å²	18	77.6 Å²	77.6	19%	0.186	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.6	29.8	-175	0	0	0	0	0	114.3	A82 I83 Y88 V112	A82-G86 CarbonylContact O-C 3.6Å; A82-G86 WeakPolarHBondContact O-CA 3.37Å; A82-G86 PolarHBondContact O-N 3.35Å; I83-G86 PolarHBondContact O-N 3.47Å; G86-Y88 WeakPolarHBondContact O-CD1 3.36Å; G86-Y88 PolarHBondContact O-N 3.08Å; G86-V112 VanDerWaalsContact CA-CG2 3.42Å
87	R	95.7	Very high	95.1	Very high	155 Å²	155	80.5 Å²	80.5	59%	0.585	39%	0.388	S	S	*	.			trans	-89.7	107.4	-175.4	-68.9	-176.6	-173.7	166.3	6.3	111.4	F71 A82 E85	F71-R87 WeakPolarHBondContact CE1-O 3.39Å; A82-R87 PolarHBondContact O-N 2.97Å; E85-R87 VanDerWaalsContact C-N 3.29Å; E85-R87 HydrophobicContact CB-CG 3.82Å; E85-R87 PolarHBondContact O-N 2.88Å; E85-R87 IonicContact OE1-CZ 3.85Å; E85-R87 IonicContact OE1-NH1 3.44Å; E85-R87 IonicContact OE1-NH2 2.84Å; E85-R87 VanDerWaalsContact OE2-CD 3.24Å; E85-R87 WeakPolarHBondContact OE2-CD 3.39Å; E85-R87 IonicContact OE2-CZ 2.8Å; E85-R87 IonicContact OE2-NE 3.1Å; E85-R87 PolarHBondContact OE2-NE 3.19Å; E85-R87 IonicContact OE2-NH1 3.74Å; E85-R87 PolarHBondContact OE2-NH1 2.81Å; E85-R87 IonicContact OE2-NH2 3.29Å; E85-R87 PolarHBondContact OE2-NH2 2.75Å
88	Y	96.3	Very high	95.1	Very high	46 Å²	46	75.2 Å²	75.2	18%	0.18	36%	0.361	C	S	.	.			trans	-145.8	163	171	69.4	-82.5	0	0	0	109.3	Y62 P70 F71 G86 F90 I106 R107 L110	Y62-Y88 HydrophobicContact CD2-CD2 4.38Å; Y62-Y88 HydrophobicContact CE2-CD2 4.03Å; P70-Y88 HydrophobicContact CB-CG 4.42Å; F71-Y88 HydrophobicContact CE1-CD1 4.12Å; F71-Y88 HydrophobicContact CE1-CG 4.41Å; F71-Y88 AromaticContact CZ-CD1 3.95Å; F71-Y88 HydrophobicContact CZ-CD1 3.95Å; F71-Y88 HydrophobicContact CZ-CG 4.41Å; G86-Y88 WeakPolarHBondContact O-CD1 3.36Å; G86-Y88 PolarHBondContact O-N 3.08Å; Y88-F90 AromaticContact CE2-CE1 3.99Å; Y88-F90 HydrophobicContact CE2-CE1 3.99Å; Y88-F90 HydrophobicContact CE2-CE2 4.02Å; Y88-F90 AromaticContact CE2-CZ 3.66Å; Y88-F90 HydrophobicContact CE2-CZ 3.66Å; Y88-I106 HydrophobicContact CE2-CG2 4.18Å; Y88-R107 VanDerWaalsContact OH-CA 3.24Å; Y88-R107 WeakPolarHBondContact OH-CA 3.41Å; Y88-R107 WeakPolarHBondContact OH-CG 3.47Å; Y88-L110 HydrophobicContact CD1-CB 4.47Å; Y88-L110 HydrophobicContact CD1-CD1 4.04Å; Y88-L110 HydrophobicContact CD2-CD1 4.29Å; Y88-L110 HydrophobicContact CE1-CB 3.71Å; Y88-L110 HydrophobicContact CE1-CD1 3.81Å; Y88-L110 HydrophobicContact CE1-CG 4.43Å; Y88-L110 HydrophobicContact CE2-CD1 4.07Å; Y88-L110 HydrophobicContact CG-CD1 4.28Å
89	E	95.8	Very high	95.1	Very high	126 Å²	126	72.4 Å²	72.4	59%	0.589	36%	0.358	S	S	*	.			trans	-137.9	142.4	-175.4	-67.2	169.3	174.2	0	0	109.8	Y62 R91	Y62-E89 PolarHBondContact OH-O 2.99Å; E89-R91 HydrophobicContact CB-CG 4.26Å; E89-R91 PolarHBondContact O-N 3.35Å; E89-R91 IonicContact OE2-NE 2.66Å
90	F	96.6	Very high	95	Very high	48 Å²	48	76.2 Å²	76.2	21%	0.211	38%	0.376	C	S	.	.			trans	-85.1	94	170.5	-59.9	-64.8	0	0	0	108.8	Y62 Y88 W95 K103 I106 R107	Y62-F90 HydrophobicContact CD2-CD1 4.31Å; Y62-F90 AromaticContact CD2-CE1 3.98Å; Y62-F90 HydrophobicContact CD2-CE1 3.98Å; Y62-F90 AromaticContact CE2-CD1 3.72Å; Y62-F90 HydrophobicContact CE2-CD1 3.72Å; Y62-F90 AromaticContact CE2-CE1 3.83Å; Y62-F90 HydrophobicContact CE2-CE1 3.83Å; Y88-F90 AromaticContact CE2-CE1 3.99Å; Y88-F90 HydrophobicContact CE2-CE1 3.99Å; Y88-F90 HydrophobicContact CE2-CE2 4.02Å; Y88-F90 AromaticContact CE2-CZ 3.66Å; Y88-F90 HydrophobicContact CE2-CZ 3.66Å; F90-W95 HydrophobicContact CB-CB 3.92Å; F90-W95 HydrophobicContact CB-CD2 3.98Å; F90-W95 HydrophobicContact CB-CE3 4.43Å; F90-W95 HydrophobicContact CB-CG 3.71Å; F90-W95 AromaticContact CD1-CD2 3.45Å; F90-W95 HydrophobicContact CD1-CD2 3.45Å; F90-W95 VanDerWaalsContact CD1-CD2 3.45Å; F90-W95 AromaticContact CD1-CE2 3.59Å; F90-W95 AromaticContact CD1-CE3 3.51Å; F90-W95 HydrophobicContact CD1-CE3 3.51Å; F90-W95 HydrophobicContact CD1-CG 4.1Å; F90-W95 AromaticContact CD1-CH2 3.92Å; F90-W95 HydrophobicContact CD1-CH2 3.92Å; F90-W95 AromaticContact CD1-CZ2 3.84Å; F90-W95 HydrophobicContact CD1-CZ2 3.84Å; F90-W95 AromaticContact CD1-CZ3 3.73Å; F90-W95 HydrophobicContact CD1-CZ3 3.73Å; F90-W95 HydrophobicContact CE1-CD2 4.32Å; F90-W95 HydrophobicContact CE1-CE3 4.03Å; F90-W95 AromaticContact CE1-CH2 3.85Å; F90-W95 HydrophobicContact CE1-CH2 3.85Å; F90-W95 HydrophobicContact CE1-CZ2 4.11Å; F90-W95 AromaticContact CE1-CZ3 3.77Å; F90-W95 HydrophobicContact CE1-CZ3 3.77Å; F90-W95 HydrophobicContact CG-CD2 4.13Å; F90-W95 HydrophobicContact CG-CE3 4.24Å; F90-W95 HydrophobicContact CG-CG 4.38Å; F90-K103 HydrophobicContact CD1-CG 4.34Å; F90-K103 HydrophobicContact CD2-CG 4.42Å; F90-K103 HydrophobicContact CE1-CB 4.46Å; F90-K103 HydrophobicContact CE1-CG 4.29Å; F90-K103 HydrophobicContact CE2-CB 4.08Å; F90-K103 HydrophobicContact CE2-CG 4.4Å; F90-K103 HydrophobicContact CG-CG 4.38Å; F90-K103 HydrophobicContact CZ-CB 4.02Å; F90-K103 HydrophobicContact CZ-CG 4.3Å; F90-I106 HydrophobicContact CE1-CB 4.33Å; F90-I106 HydrophobicContact CE1-CD1 4.28Å; F90-I106 HydrophobicContact CE1-CG2 3.99Å; F90-I106 HydrophobicContact CZ-CB 4.17Å; F90-I106 HydrophobicContact CZ-CG2 3.95Å; F90-R107 HydrophobicContact CE2-CG 3.97Å; F90-R107 HydrophobicContact CZ-CG 4.2Å
91	R	94.1	Very high	95	Very high	154 Å²	154	75.1 Å²	75.1	58%	0.581	37%	0.372	S	S	*	.			trans	-82.2	139.7	-173.3	-60.2	179	176.6	167.9	1.9	112.3	E89 W95	E89-R91 HydrophobicContact CB-CG 4.26Å; E89-R91 PolarHBondContact O-N 3.35Å; E89-R91 IonicContact OE2-NE 2.66Å; R91-W95 VanDerWaalsContact O-CD1 3.26Å; R91-W95 PolarHBondContact O-N 3.48Å
92	S	93.4	Very high	95	Very high	80 Å²	80	68.7 Å²	68.7	56%	0.559	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	149	167.7	-55.2	0	0	0	0	110.4	D96	S92-D96 WeakPolarHBondContact CB-OD1 3.38Å; S92-D96 WeakPolarHBondContact CB-OD2 3.36Å; S92-D96 PolarHBondContact OG-OD1 3.12Å; S92-D96 PolarHBondContact OG-OD2 3.35Å
93	P	94.1	Very high	95.1	Very high	88 Å²	88	69 Å²	69	57%	0.571	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	cis	-89.6	-12.3	6	34.8	-35.7	0	0	0	114.8	W95 D96	P93-W95 PolarHBondContact O-N 3.26Å; P93-W95 VanDerWaalsContact O-N 3.15Å; P93-D96 WeakPolarHBondContact O-CB 3.42Å; P93-D96 PolarHBondContact O-N 3.22Å
94	E	93.5	Very high	95.1	Very high	91 Å²	91	71.4 Å²	71.4	43%	0.425	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-30.5	-168.1	-60.8	78.2	-168.1	0	0	112.9	C66 Y68 I98	C66-E94 HydrophobicContact CB-CB 4.01Å; Y68-E94 HydrophobicContact CE1-CB 4.26Å; Y68-E94 HydrophobicContact CE1-CG 4.13Å; E94-I98 WeakPolarHBondContact O-CD1 3.37Å
95	W	95.4	Very high	95.2	Very high	2 Å²	2	69.3 Å²	69.3	1%	0.008	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-4.6	179.4	-73	92.3	0	0	0	114.7	Y62 L65 C66 Y68 F90 R91 P93 E97 I98 K103 I106	Y62-W95 HydrophobicContact CD1-CZ2 4.01Å; Y62-W95 HydrophobicContact CD2-CH2 4.01Å; Y62-W95 AromaticContact CD2-CZ2 3.48Å; Y62-W95 HydrophobicContact CD2-CZ2 3.48Å; Y62-W95 VanDerWaalsContact CD2-CZ2 3.48Å; Y62-W95 AromaticContact CE1-CZ2 3.96Å; Y62-W95 HydrophobicContact CE1-CZ2 3.96Å; Y62-W95 AromaticContact CE2-CE2 3.8Å; Y62-W95 HydrophobicContact CE2-CH2 4.27Å; Y62-W95 AromaticContact CE2-CZ2 3.42Å; Y62-W95 HydrophobicContact CE2-CZ2 3.42Å; Y62-W95 VanDerWaalsContact CE2-CZ2 3.42Å; Y62-W95 AromaticContact CE2-NE1 3.93Å; Y62-W95 HydrophobicContact CG-CH2 4.34Å; Y62-W95 AromaticContact CG-CZ2 3.76Å; Y62-W95 HydrophobicContact CG-CZ2 3.76Å; Y62-W95 AromaticContact CZ-CE2 3.77Å; Y62-W95 AromaticContact CZ-CZ2 3.64Å; Y62-W95 AromaticContact CZ-NE1 3.47Å; Y62-W95 PolarHBondContact OH-NE1 3.22Å; Y62-W95 VanDerWaalsContact OH-NE1 3.15Å; L65-W95 HydrophobicContact CB-CH2 4.13Å; L65-W95 HydrophobicContact CD1-CH2 4.17Å; L65-W95 HydrophobicContact CD1-CZ3 4.32Å; C66-W95 HydrophobicContact CB-CZ2 3.89Å; Y68-W95 AromaticContact CZ-NE1 3.9Å; Y68-W95 VanDerWaalsContact OH-CD1 3.3Å; Y68-W95 PolarHBondContact OH-NE1 3.29Å; F90-W95 HydrophobicContact CB-CB 3.92Å; F90-W95 HydrophobicContact CB-CD2 3.98Å; F90-W95 HydrophobicContact CB-CE3 4.43Å; F90-W95 HydrophobicContact CB-CG 3.71Å; F90-W95 AromaticContact CD1-CD2 3.45Å; F90-W95 HydrophobicContact CD1-CD2 3.45Å; F90-W95 VanDerWaalsContact CD1-CD2 3.45Å; F90-W95 AromaticContact CD1-CE2 3.59Å; F90-W95 AromaticContact CD1-CE3 3.51Å; F90-W95 HydrophobicContact CD1-CE3 3.51Å; F90-W95 HydrophobicContact CD1-CG 4.1Å; F90-W95 AromaticContact CD1-CH2 3.92Å; F90-W95 HydrophobicContact CD1-CH2 3.92Å; F90-W95 AromaticContact CD1-CZ2 3.84Å; F90-W95 HydrophobicContact CD1-CZ2 3.84Å; F90-W95 AromaticContact CD1-CZ3 3.73Å; F90-W95 HydrophobicContact CD1-CZ3 3.73Å; F90-W95 HydrophobicContact CE1-CD2 4.32Å; F90-W95 HydrophobicContact CE1-CE3 4.03Å; F90-W95 AromaticContact CE1-CH2 3.85Å; F90-W95 HydrophobicContact CE1-CH2 3.85Å; F90-W95 HydrophobicContact CE1-CZ2 4.11Å; F90-W95 AromaticContact CE1-CZ3 3.77Å; F90-W95 HydrophobicContact CE1-CZ3 3.77Å; F90-W95 HydrophobicContact CG-CD2 4.13Å; F90-W95 HydrophobicContact CG-CE3 4.24Å; F90-W95 HydrophobicContact CG-CG 4.38Å; R91-W95 VanDerWaalsContact O-CD1 3.26Å; R91-W95 PolarHBondContact O-N 3.48Å; P93-W95 PolarHBondContact O-N 3.26Å; P93-W95 VanDerWaalsContact O-N 3.15Å; W95-E97 VanDerWaalsContact C-N 3.34Å; W95-E97 PolarHBondContact O-N 3.2Å; W95-I98 HydrophobicContact CD2-CD1 3.72Å; W95-I98 HydrophobicContact CE3-CB 3.85Å; W95-I98 HydrophobicContact CE3-CD1 3.48Å; W95-I98 VanDerWaalsContact CE3-CD1 3.48Å; W95-I98 HydrophobicContact CE3-CG1 4.24Å; W95-I98 HydrophobicContact CE3-CG2 3.78Å; W95-I98 HydrophobicContact CG-CD1 4.3Å; W95-I98 HydrophobicContact CH2-CD1 4.2Å; W95-I98 HydrophobicContact CZ2-CD1 4.43Å; W95-I98 HydrophobicContact CZ3-CB 4.26Å; W95-I98 HydrophobicContact CZ3-CD1 3.76Å; W95-I98 HydrophobicContact CZ3-CG2 3.69Å; W95-I98 PolarHBondContact O-N 3.44Å; W95-K103 HydrophobicContact CE3-CD 4.37Å; W95-K103 HydrophobicContact CE3-CG 3.73Å; W95-K103 HydrophobicContact CZ3-CG 3.92Å; W95-K103 WeakPolarHBondContact O-CE 3.5Å; W95-K103 PolarHBondContact O-NZ 3.1Å; W95-I106 HydrophobicContact CH2-CD1 3.37Å; W95-I106 HydrophobicContact CZ2-CD1 4.42Å; W95-I106 HydrophobicContact CZ3-CD1 3.88Å
96	D	94.4	Very high	95.3	Very high	101 Å²	101	66.1 Å²	66.1	54%	0.54	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-36	-175.7	-65.8	-13.9	0	0	0	111.4	S92 P93	S92-D96 WeakPolarHBondContact CB-OD1 3.38Å; S92-D96 WeakPolarHBondContact CB-OD2 3.36Å; S92-D96 PolarHBondContact OG-OD1 3.12Å; S92-D96 PolarHBondContact OG-OD2 3.35Å; P93-D96 WeakPolarHBondContact O-CB 3.42Å; P93-D96 PolarHBondContact O-N 3.22Å
97	E	92.9	Very high	95.5	Very high	193 Å²	193	69.6 Å²	69.6	90%	0.902	34%	0.335	S	S	*	.	S	Bend	trans	-88.3	-11.8	179.4	-60.6	-175.6	173.4	0	0	113.6	W95	W95-E97 VanDerWaalsContact C-N 3.34Å; W95-E97 PolarHBondContact O-N 3.2Å
98	I	94.2	Very high	95.6	Very high	27 Å²	27	66 Å²	66	14%	0.138	32%	0.324	C	S	.	.	S	Bend	trans	-79.6	132.5	-178.1	-62.4	170.9	0	0	0	110.5	L65 C66 E94 W95 A102 K103	L65-I98 HydrophobicContact CB-CD1 3.89Å; L65-I98 HydrophobicContact CD1-CG2 4.36Å; C66-I98 HydrophobicContact CB-CD1 4.45Å; E94-I98 WeakPolarHBondContact O-CD1 3.37Å; W95-I98 HydrophobicContact CD2-CD1 3.72Å; W95-I98 HydrophobicContact CE3-CB 3.85Å; W95-I98 HydrophobicContact CE3-CD1 3.48Å; W95-I98 VanDerWaalsContact CE3-CD1 3.48Å; W95-I98 HydrophobicContact CE3-CG1 4.24Å; W95-I98 HydrophobicContact CE3-CG2 3.78Å; W95-I98 HydrophobicContact CG-CD1 4.3Å; W95-I98 HydrophobicContact CH2-CD1 4.2Å; W95-I98 HydrophobicContact CZ2-CD1 4.43Å; W95-I98 HydrophobicContact CZ3-CB 4.26Å; W95-I98 HydrophobicContact CZ3-CD1 3.76Å; W95-I98 HydrophobicContact CZ3-CG2 3.69Å; W95-I98 PolarHBondContact O-N 3.44Å; I98-A102 HydrophobicContact CG2-CB 3.88Å; I98-K103 WeakPolarHBondContact O-CE 3.45Å; I98-K103 PolarHBondContact O-NZ 2.66Å
99	S	94.3	Very high	95.6	Very high	56 Å²	56	64.2 Å²	64.2	39%	0.392	32%	0.317	S	S	.	.			trans	-57.7	146.2	-178	71.6	0	0	0	0	113.5	S101 A102 K103	S99-S101 PolarHBondContact O-N 3.21Å; S99-S101 PolarHBondContact OG-OG 3.11Å; S99-A102 PolarHBondContact O-N 3.3Å; S99-A102 VanDerWaalsContact O-N 3.16Å; S99-A102 PolarHBondContact OG-N 3.25Å; S99-K103 PolarHBondContact O-N 3Å
100	E	95.3	Very high	95.8	Very high	106 Å²	106	58.4 Å²	58.4	50%	0.495	29%	0.29	S	S	.	.	H	α-helix	trans	-64.9	-28.2	175.9	-169.3	55.6	-145.8	0	0	112	A102 K103 D104 R107	E100-A102 VanDerWaalsContact C-N 3.3Å; E100-A102 PolarHBondContact O-N 2.86Å; E100-K103 PolarHBondContact O-N 3.48Å; E100-K103 WeakPolarHBondContact OE2-CD 3.38Å; E100-D104 WeakPolarHBondContact O-CB 3.35Å; E100-D104 PolarHBondContact O-N 2.91Å; E100-R107 IonicContact OE1-CZ 2.96Å; E100-R107 IonicContact OE1-NH1 3.42Å; E100-R107 PolarHBondContact OE1-NH1 3.31Å; E100-R107 IonicContact OE1-NH2 2.84Å; E100-R107 PolarHBondContact OE1-NH2 3.06Å; E100-R107 IonicContact OE2-NH2 3.21Å
101	S	94.9	Very high	95.8	Very high	15 Å²	15	59.6 Å²	59.6	11%	0.105	30%	0.296	C	S	.	.	H	α-helix	trans	-62.1	-36.7	174.5	59.2	0	0	0	0	112.5	S99 L105 H126 Q131	S99-S101 PolarHBondContact O-N 3.21Å; S99-S101 PolarHBondContact OG-OG 3.11Å; S101-L105 PolarHBondContact O-N 3.31Å; S101-H126 PolarHBondContact O-CE1 3Å; S101-Q131 PolarHBondContact OG-OE1 2.9Å
102	A	95.4	Very high	95.9	Very high	1 Å²	1	54 Å²	54	1%	0.008	28%	0.28	C	S	.	.	H	α-helix	trans	-71.9	-44.8	175.7	0	0	0	0	0	111.6	M61 L65 I98 S99 E100 D104 L105 I106 F128	M61-A102 HydrophobicContact CE-CB 4.01Å; L65-A102 HydrophobicContact CD1-CB 4Å; I98-A102 HydrophobicContact CG2-CB 3.88Å; S99-A102 PolarHBondContact O-N 3.3Å; S99-A102 VanDerWaalsContact O-N 3.16Å; S99-A102 PolarHBondContact OG-N 3.25Å; E100-A102 VanDerWaalsContact C-N 3.3Å; E100-A102 PolarHBondContact O-N 2.86Å; A102-D104 VanDerWaalsContact C-N 3.34Å; A102-D104 PolarHBondContact O-N 2.78Å; A102-L105 PolarHBondContact O-N 3.43Å; A102-I106 WeakPolarHBondContact O-CG1 3.21Å; A102-I106 PolarHBondContact O-N 3.04Å; A102-F128 HydrophobicContact CB-CD2 3.7Å; A102-F128 HydrophobicContact CB-CE2 3.69Å
103	K	97.3	Very high	96	Very high	30 Å²	30	53.1 Å²	53.1	13%	0.13	27%	0.268	C	S	.	.	H	α-helix	trans	-59.6	-44.4	176.1	-68	170.6	-178.1	166.4	0	111.5	F90 W95 I98 S99 E100 I106 R107	F90-K103 HydrophobicContact CD1-CG 4.34Å; F90-K103 HydrophobicContact CD2-CG 4.42Å; F90-K103 HydrophobicContact CE1-CB 4.46Å; F90-K103 HydrophobicContact CE1-CG 4.29Å; F90-K103 HydrophobicContact CE2-CB 4.08Å; F90-K103 HydrophobicContact CE2-CG 4.4Å; F90-K103 HydrophobicContact CG-CG 4.38Å; F90-K103 HydrophobicContact CZ-CB 4.02Å; F90-K103 HydrophobicContact CZ-CG 4.3Å; W95-K103 HydrophobicContact CE3-CD 4.37Å; W95-K103 HydrophobicContact CE3-CG 3.73Å; W95-K103 HydrophobicContact CZ3-CG 3.92Å; W95-K103 WeakPolarHBondContact O-CE 3.5Å; W95-K103 PolarHBondContact O-NZ 3.1Å; I98-K103 WeakPolarHBondContact O-CE 3.45Å; I98-K103 PolarHBondContact O-NZ 2.66Å; S99-K103 PolarHBondContact O-N 3Å; E100-K103 PolarHBondContact O-N 3.48Å; E100-K103 WeakPolarHBondContact OE2-CD 3.38Å; K103-I106 PolarHBondContact O-N 3.23Å; K103-R107 WeakPolarHBondContact O-CG 3.29Å; K103-R107 PolarHBondContact O-N 2.97Å
104	D	97.3	Very high	96	Very high	51 Å²	51	50.3 Å²	50.3	27%	0.273	25%	0.25	S	C	.	.	H	α-helix	trans	-62.6	-42.6	177.7	-174.6	55.4	0	0	0	112.4	E100 A102 I106 R107 K108 H126	E100-D104 WeakPolarHBondContact O-CB 3.35Å; E100-D104 PolarHBondContact O-N 2.91Å; A102-D104 VanDerWaalsContact C-N 3.34Å; A102-D104 PolarHBondContact O-N 2.78Å; D104-I106 VanDerWaalsContact C-N 3.34Å; D104-I106 PolarHBondContact O-N 3.09Å; D104-R107 PolarHBondContact O-N 3.23Å; D104-K108 WeakPolarHBondContact O-CG 3.29Å; D104-K108 PolarHBondContact O-N 2.99Å; D104-K108 VanDerWaalsContact O-N 3.09Å; D104-K108 IonicContact OD1-NZ 3.95Å; D104-K108 VanDerWaalsContact OD2-CE 3.28Å; D104-K108 WeakPolarHBondContact OD2-CE 3.42Å; D104-K108 IonicContact OD2-NZ 2.67Å; D104-K108 PolarHBondContact OD2-NZ 2.88Å; D104-H126 IonicContact OD2-CE1 3.52Å; D104-H126 PolarHBondContact OD2-CE1 3.4Å; D104-H126 IonicContact OD2-NE2 3.72Å; D104-H126 PolarHBondContact OD2-NE2 3.2Å
105	L	97.7	Very high	96	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.1	-43.3	175.4	-176.5	56.6	0	0	0	111.7	M61 S101 A102 R107 K108 M109 I118 A123 H126 F128 F129	M61-L105 HydrophobicContact CE-CB 4.17Å; M61-L105 HydrophobicContact CE-CD2 3.94Å; M61-L105 HydrophobicContact CE-CG 4.28Å; M61-L105 HydrophobicContact SD-CD2 3.88Å; M61-L105 HydrophobicContact SD-CG 4.17Å; S101-L105 PolarHBondContact O-N 3.31Å; A102-L105 PolarHBondContact O-N 3.43Å; L105-R107 PolarHBondContact O-N 3.12Å; L105-K108 PolarHBondContact O-N 3.38Å; L105-M109 HydrophobicContact CD1-CE 3.85Å; L105-M109 HydrophobicContact CD1-CG 4.47Å; L105-M109 HydrophobicContact CD2-CE 3.99Å; L105-M109 HydrophobicContact CG-CE 3.81Å; L105-M109 HydrophobicContact CG-SD 4.36Å; L105-M109 WeakPolarHBondContact O-CG 3.46Å; L105-M109 PolarHBondContact O-N 2.8Å; L105-I118 HydrophobicContact CD1-CD1 4.11Å; L105-A123 HydrophobicContact CD1-CB 4.17Å; L105-H126 HydrophobicContact CD1-CB 3.99Å; L105-F128 HydrophobicContact CB-CB 4.48Å; L105-F128 HydrophobicContact CD2-CB 3.87Å; L105-F128 HydrophobicContact CD2-CD1 3.6Å; L105-F128 HydrophobicContact CD2-CE1 4.42Å; L105-F128 HydrophobicContact CD2-CG 3.9Å; L105-F129 HydrophobicContact CD2-CD2 4.21Å; L105-F129 HydrophobicContact CD2-CE2 3.69Å; L105-F129 HydrophobicContact CD2-CZ 4.45Å
106	I	98	Very high	96.1	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-42.7	176.4	-70.1	169	0	0	0	111.2	M61 Y62 L65 Y88 F90 W95 A102 K103 D104 K108 M109 L110	M61-I106 HydrophobicContact CB-CG1 4.49Å; M61-I106 HydrophobicContact CE-CD1 4.15Å; M61-I106 HydrophobicContact CE-CG1 3.84Å; M61-I106 HydrophobicContact CG-CD1 4.2Å; M61-I106 HydrophobicContact CG-CG1 4.05Å; M61-I106 HydrophobicContact SD-CG1 3.9Å; Y62-I106 HydrophobicContact CD2-CD1 4.45Å; Y62-I106 HydrophobicContact CD2-CG2 4.15Å; L65-I106 HydrophobicContact CD1-CD1 4.07Å; Y88-I106 HydrophobicContact CE2-CG2 4.18Å; F90-I106 HydrophobicContact CE1-CB 4.33Å; F90-I106 HydrophobicContact CE1-CD1 4.28Å; F90-I106 HydrophobicContact CE1-CG2 3.99Å; F90-I106 HydrophobicContact CZ-CB 4.17Å; F90-I106 HydrophobicContact CZ-CG2 3.95Å; W95-I106 HydrophobicContact CH2-CD1 3.37Å; W95-I106 HydrophobicContact CZ2-CD1 4.42Å; W95-I106 HydrophobicContact CZ3-CD1 3.88Å; A102-I106 WeakPolarHBondContact O-CG1 3.21Å; A102-I106 PolarHBondContact O-N 3.04Å; K103-I106 PolarHBondContact O-N 3.23Å; D104-I106 VanDerWaalsContact C-N 3.34Å; D104-I106 PolarHBondContact O-N 3.09Å; I106-K108 VanDerWaalsContact C-N 3.26Å; I106-K108 PolarHBondContact O-N 3.34Å; I106-M109 PolarHBondContact O-N 3Å; I106-M109 VanDerWaalsContact O-N 3.16Å; I106-L110 HydrophobicContact CG2-CD1 3.64Å; I106-L110 HydrophobicContact CG2-CG 4.08Å; I106-L110 WeakPolarHBondContact O-CB 3.42Å; I106-L110 PolarHBondContact O-N 3.36Å
107	R	98.2	Very high	96.3	Very high	91 Å²	91	58 Å²	58	34%	0.343	28%	0.277	S	S	.	.	H	α-helix	trans	-58.8	-37.8	175.6	-67.4	-179.2	-157.9	106.6	-0	112.6	Y88 F90 E100 K103 D104 L105	Y88-R107 VanDerWaalsContact OH-CA 3.24Å; Y88-R107 WeakPolarHBondContact OH-CA 3.41Å; Y88-R107 WeakPolarHBondContact OH-CG 3.47Å; F90-R107 HydrophobicContact CE2-CG 3.97Å; F90-R107 HydrophobicContact CZ-CG 4.2Å; E100-R107 IonicContact OE1-CZ 2.96Å; E100-R107 IonicContact OE1-NH1 3.42Å; E100-R107 PolarHBondContact OE1-NH1 3.31Å; E100-R107 IonicContact OE1-NH2 2.84Å; E100-R107 PolarHBondContact OE1-NH2 3.06Å; E100-R107 IonicContact OE2-NH2 3.21Å; K103-R107 WeakPolarHBondContact O-CG 3.29Å; K103-R107 PolarHBondContact O-N 2.97Å; D104-R107 PolarHBondContact O-N 3.23Å; L105-R107 PolarHBondContact O-N 3.12Å
108	K	97.8	Very high	96.5	Very high	79 Å²	79	49.8 Å²	49.8	34%	0.343	24%	0.239	S	C	.	.	H	α-helix	trans	-73.6	-30.6	177.4	-70.7	173.6	179.1	160	0	113.1	D104 L105 I106 I118 H126	D104-K108 WeakPolarHBondContact O-CG 3.29Å; D104-K108 PolarHBondContact O-N 2.99Å; D104-K108 VanDerWaalsContact O-N 3.09Å; D104-K108 IonicContact OD1-NZ 3.95Å; D104-K108 VanDerWaalsContact OD2-CE 3.28Å; D104-K108 WeakPolarHBondContact OD2-CE 3.42Å; D104-K108 IonicContact OD2-NZ 2.67Å; D104-K108 PolarHBondContact OD2-NZ 2.88Å; L105-K108 PolarHBondContact O-N 3.38Å; I106-K108 VanDerWaalsContact C-N 3.26Å; I106-K108 PolarHBondContact O-N 3.34Å; K108-I118 HydrophobicContact CB-CB 4.02Å; K108-I118 HydrophobicContact CB-CD1 4.24Å; K108-I118 HydrophobicContact CB-CG2 4.05Å; K108-I118 HydrophobicContact CD-CD1 4.18Å; K108-I118 WeakPolarHBondContact O-CG2 3.46Å; K108-I118 PolarHBondContact O-N 3.29Å; K108-I118 VanDerWaalsContact O-N 3.13Å; K108-H126 PolarHBondContact NZ-NE2 3.44Å
109	M	98.1	Very high	96.6	Very high	9 Å²	9	51.9 Å²	51.9	4%	0.044	25%	0.253	C	S	.	.	H	α-helix	trans	-78.3	-42.4	175.3	-70.5	-176.2	174.8	0	0	112.8	M54 C57 M61 L105 I106 Q111 R117 I118 A123	M54-M109 HydrophobicContact CE-CE 3.89Å; M54-M109 HydrophobicContact CE-SD 4.36Å; M54-M109 HydrophobicContact CG-CG 4.06Å; M54-M109 HydrophobicContact SD-CE 4.4Å; C57-M109 HydrophobicContact CB-SD 4.44Å; M61-M109 HydrophobicContact SD-SD 4.28Å; L105-M109 HydrophobicContact CD1-CE 3.85Å; L105-M109 HydrophobicContact CD1-CG 4.47Å; L105-M109 HydrophobicContact CD2-CE 3.99Å; L105-M109 HydrophobicContact CG-CE 3.81Å; L105-M109 HydrophobicContact CG-SD 4.36Å; L105-M109 WeakPolarHBondContact O-CG 3.46Å; L105-M109 PolarHBondContact O-N 2.8Å; I106-M109 PolarHBondContact O-N 3Å; I106-M109 VanDerWaalsContact O-N 3.16Å; M109-Q111 PolarHBondContact O-N 3.34Å; M109-Q111 VanDerWaalsContact O-N 3.11Å; M109-R117 VanDerWaalsContact O-CD 3.26Å; M109-R117 WeakPolarHBondContact O-CD 3.48Å; M109-R117 VanDerWaalsContact O-CG 3.29Å; M109-R117 WeakPolarHBondContact O-CG 3.19Å; M109-I118 HydrophobicContact CG-CG2 3.79Å; M109-A123 HydrophobicContact CE-CB 3.94Å
110	L	98	Very high	96.6	Very high	4 Å²	4	52 Å²	52	2%	0.021	26%	0.258	C	S	.	.	S	Bend	trans	-85.9	37.1	179.7	-62.3	-176.1	0	0	0	112.4	W55 V59 P70 F71 Y88 I106	W55-L110 HydrophobicContact CD2-CD2 3.98Å; W55-L110 HydrophobicContact CE3-CD2 4.16Å; W55-L110 HydrophobicContact CG-CD2 4.41Å; W55-L110 HydrophobicContact CZ2-CD2 4.46Å; W55-L110 HydrophobicContact CZ3-CB 4.3Å; W55-L110 HydrophobicContact CZ3-CD2 4.49Å; W55-L110 WeakPolarHBondContact CZ3-O 3.21Å; V59-L110 HydrophobicContact CG2-CD2 3.89Å; P70-L110 HydrophobicContact CB-CD1 4.42Å; P70-L110 HydrophobicContact CG-CD1 4.4Å; F71-L110 HydrophobicContact CE2-CD1 4.39Å; F71-L110 HydrophobicContact CE2-CD2 4.29Å; F71-L110 HydrophobicContact CZ-CD1 4.42Å; Y88-L110 HydrophobicContact CD1-CB 4.47Å; Y88-L110 HydrophobicContact CD1-CD1 4.04Å; Y88-L110 HydrophobicContact CD2-CD1 4.29Å; Y88-L110 HydrophobicContact CE1-CB 3.71Å; Y88-L110 HydrophobicContact CE1-CD1 3.81Å; Y88-L110 HydrophobicContact CE1-CG 4.43Å; Y88-L110 HydrophobicContact CE2-CD1 4.07Å; Y88-L110 HydrophobicContact CG-CD1 4.28Å; I106-L110 HydrophobicContact CG2-CD1 3.64Å; I106-L110 HydrophobicContact CG2-CG 4.08Å; I106-L110 WeakPolarHBondContact O-CB 3.42Å; I106-L110 PolarHBondContact O-N 3.36Å
111	Q	97.7	Very high	96.6	Very high	74 Å²	74	55.6 Å²	55.6	35%	0.346	27%	0.272	S	S	.	.			trans	-83.7	127.3	175.8	-173.2	62.8	-63.8	0	0	110.5	M109 K116 R117	M109-Q111 PolarHBondContact O-N 3.34Å; M109-Q111 VanDerWaalsContact O-N 3.11Å; Q111-K116 HydrophobicContact CG-CB 3.66Å; Q111-R117 HydrophobicContact CB-CB 4.13Å; Q111-R117 HydrophobicContact CB-CG 4.32Å; Q111-R117 PolarHBondContact O-NE 3.14Å; Q111-R117 PolarHBondContact O-NH2 2.92Å
112	V	96.8	Very high	96.6	Very high	37 Å²	37	60.1 Å²	60.1	22%	0.224	29%	0.291	C	S	.	.	S	Bend	trans	-67.6	-40.1	-175.3	177.8	0	0	0	0	111.8	P34 W55 G86 P114	P34-V112 HydrophobicContact CB-CG1 4.13Å; P34-V112 HydrophobicContact CG-CG1 4.19Å; W55-V112 HydrophobicContact CZ3-CG2 4.5Å; G86-V112 VanDerWaalsContact CA-CG2 3.42Å; V112-P114 VanDerWaalsContact O-CD 3.28Å; V112-P114 WeakPolarHBondContact O-CD 3.34Å
113	D	95.1	Very high	96.6	Very high	60 Å²	60	60.2 Å²	60.2	32%	0.321	29%	0.292	S	S	.	.	S	Bend	trans	-77.5	113.7	173.6	-177.6	3.8	0	0	0	109.7	K115 K116 R117	D113-K115 PolarHBondContact O-N 3.04Å; D113-K115 VanDerWaalsContact O-N 3.14Å; D113-K115 PolarHBondContact OD1-N 2.75Å; D113-K115 VanDerWaalsContact OD1-N 3.13Å; D113-K116 HydrophobicContact CB-CB 4.27Å; D113-K116 HydrophobicContact CB-CD 4.23Å; D113-K116 HydrophobicContact CB-CG 4.28Å; D113-K116 PolarHBondContact O-N 3.49Å; D113-R117 PolarHBondContact O-N 2.83Å
114	P	94.8	Very high	96.4	Very high	29 Å²	29	64.4 Å²	64.4	19%	0.188	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-59.1	-29.2	-178.6	-22.9	34.9	0	0	0	112.7	E35 E51 V112 K116 R117	E35-P114 HydrophobicContact CB-CG 4.19Å; E35-P114 HydrophobicContact CG-CG 4.01Å; E51-P114 HydrophobicContact CB-CB 4.13Å; E51-P114 HydrophobicContact CG-CB 4.38Å; V112-P114 VanDerWaalsContact O-CD 3.28Å; V112-P114 WeakPolarHBondContact O-CD 3.34Å; P114-K116 VanDerWaalsContact C-N 3.3Å; P114-K116 PolarHBondContact O-N 2.87Å; P114-R117 WeakPolarHBondContact O-CB 3.28Å; P114-R117 PolarHBondContact O-N 3.11Å
115	K	93.6	Very high	96.2	Very high	197 Å²	197	64.8 Å²	64.8	86%	0.857	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-71.1	-25.7	179.5	-65.4	-178	178.9	179.3	0	113.4	D113	D113-K115 PolarHBondContact O-N 3.04Å; D113-K115 VanDerWaalsContact O-N 3.14Å; D113-K115 PolarHBondContact OD1-N 2.75Å; D113-K115 VanDerWaalsContact OD1-N 3.13Å
116	K	96.4	Very high	96	Very high	150 Å²	150	65.6 Å²	65.6	65%	0.652	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-95.9	-6.7	177.2	-64.8	179.5	-173.8	178.9	0	112	Q111 D113 P114	Q111-K116 HydrophobicContact CG-CB 3.66Å; D113-K116 HydrophobicContact CB-CB 4.27Å; D113-K116 HydrophobicContact CB-CD 4.23Å; D113-K116 HydrophobicContact CB-CG 4.28Å; D113-K116 PolarHBondContact O-N 3.49Å; P114-K116 VanDerWaalsContact C-N 3.3Å; P114-K116 PolarHBondContact O-N 2.87Å
117	R	97.7	Very high	95.8	Very high	10 Å²	10	68 Å²	68	4%	0.038	35%	0.346	C	S	.	.	S	Bend	trans	-72.8	136.8	178	-164.4	178.9	-61.5	151.8	5.9	109	E35 E51 M54 M109 Q111 D113 P114	E35-R117 IonicContact OE1-CZ 2.91Å; E35-R117 VanDerWaalsContact OE1-CZ 3.3Å; E35-R117 IonicContact OE1-NH1 2.92Å; E35-R117 PolarHBondContact OE1-NH1 3.48Å; E35-R117 IonicContact OE1-NH2 3.87Å; E35-R117 PolarHBondContact OE1-NH2 3.06Å; E35-R117 VanDerWaalsContact OE1-NH2 3.1Å; E35-R117 IonicContact OE2-CZ 2.85Å; E35-R117 IonicContact OE2-NH1 3.75Å; E35-R117 IonicContact OE2-NH2 3.81Å; E35-R117 PolarHBondContact OE2-NH2 3.48Å; E51-R117 WeakPolarHBondContact O-CD 3.14Å; E51-R117 PolarHBondContact O-NH1 2.66Å; M54-R117 HydrophobicContact CB-CG 4.39Å; M109-R117 VanDerWaalsContact O-CD 3.26Å; M109-R117 WeakPolarHBondContact O-CD 3.48Å; M109-R117 VanDerWaalsContact O-CG 3.29Å; M109-R117 WeakPolarHBondContact O-CG 3.19Å; Q111-R117 HydrophobicContact CB-CB 4.13Å; Q111-R117 HydrophobicContact CB-CG 4.32Å; Q111-R117 PolarHBondContact O-NE 3.14Å; Q111-R117 PolarHBondContact O-NH2 2.92Å; D113-R117 PolarHBondContact O-N 2.83Å; P114-R117 WeakPolarHBondContact O-CB 3.28Å; P114-R117 PolarHBondContact O-N 3.11Å
118	I	97.5	Very high	95.5	Very high	20 Å²	20	66 Å²	66	10%	0.103	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-60.8	141.8	179.8	-165.8	166.7	0	0	0	111.1	M54 L105 K108 M109 E122 A123	M54-I118 HydrophobicContact CG-CG2 4Å; M54-I118 VanDerWaalsContact CG-O 3.29Å; M54-I118 WeakPolarHBondContact CG-O 3.18Å; L105-I118 HydrophobicContact CD1-CD1 4.11Å; K108-I118 HydrophobicContact CB-CB 4.02Å; K108-I118 HydrophobicContact CB-CD1 4.24Å; K108-I118 HydrophobicContact CB-CG2 4.05Å; K108-I118 HydrophobicContact CD-CD1 4.18Å; K108-I118 WeakPolarHBondContact O-CG2 3.46Å; K108-I118 PolarHBondContact O-N 3.29Å; K108-I118 VanDerWaalsContact O-N 3.13Å; M109-I118 HydrophobicContact CG-CG2 3.79Å; I118-E122 HydrophobicContact CD1-CB 4.05Å; I118-E122 HydrophobicContact CG1-CB 3.52Å; I118-A123 HydrophobicContact CD1-CB 4.02Å; I118-A123 HydrophobicContact CG1-CB 4.19Å; I118-A123 HydrophobicContact CG2-CB 4.27Å
119	T	96.9	Very high	95.1	Very high	70 Å²	70	66.3 Å²	66.3	43%	0.429	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-81.3	156.6	172.1	65.9	0	0	0	0	110.8	K121 E122 A123	T119-K121 PolarHBondContact O-N 3.49Å; T119-K121 VanDerWaalsContact O-N 3.13Å; T119-E122 PolarHBondContact N-OE2 3.33Å; T119-E122 PolarHBondContact O-N 3.07Å; T119-E122 VanDerWaalsContact O-N 3.09Å; T119-E122 VanDerWaalsContact OG1-CG 3.25Å; T119-E122 WeakPolarHBondContact OG1-CG 3.38Å; T119-E122 PolarHBondContact OG1-N 3.18Å; T119-E122 PolarHBondContact OG1-OE2 3.15Å; T119-A123 WeakPolarHBondContact O-CB 3.26Å; T119-A123 PolarHBondContact O-N 3.13Å
120	A	95.3	Very high	94.5	Very high	60 Å²	60	72.6 Å²	72.6	50%	0.496	37%	0.371	S	S	.	.	H	α-helix	trans	-56.5	-33.2	178.2	0	0	0	0	0	113.4	M54 L124	M54-A120 HydrophobicContact SD-CB 4.18Å; A120-L124 WeakPolarHBondContact O-CG 3.39Å; A120-L124 PolarHBondContact O-N 3.09Å; A120-L124 VanDerWaalsContact O-N 3.08Å
121	K	94	Very high	93.4	Very high	180 Å²	180	78.4 Å²	78.4	78%	0.783	40%	0.398	S	S	*	.	H	α-helix	trans	-68.7	-44.5	176.7	-69.4	-177.5	-179.6	177.3	0	112.1	T119 A123 L124 A125	T119-K121 PolarHBondContact O-N 3.49Å; T119-K121 VanDerWaalsContact O-N 3.13Å; K121-A123 VanDerWaalsContact C-N 3.35Å; K121-L124 PolarHBondContact O-N 3.45Å; K121-A125 PolarHBondContact O-N 3.37Å
122	E	95.4	Very high	92	Very high	110 Å²	110	79.5 Å²	79.5	51%	0.514	41%	0.409	S	S	.	.	H	α-helix	trans	-68	-37.4	176.6	-69.5	162	162.3	0	0	111.3	I118 T119 L124 A125 H126	I118-E122 HydrophobicContact CD1-CB 4.05Å; I118-E122 HydrophobicContact CG1-CB 3.52Å; T119-E122 PolarHBondContact N-OE2 3.33Å; T119-E122 PolarHBondContact O-N 3.07Å; T119-E122 VanDerWaalsContact O-N 3.09Å; T119-E122 VanDerWaalsContact OG1-CG 3.25Å; T119-E122 WeakPolarHBondContact OG1-CG 3.38Å; T119-E122 PolarHBondContact OG1-N 3.18Å; T119-E122 PolarHBondContact OG1-OE2 3.15Å; E122-L124 PolarHBondContact O-N 3.07Å; E122-A125 CarbonylContact O-C 3.48Å; E122-A125 PolarHBondContact O-N 2.71Å; E122-A125 VanDerWaalsContact O-N 3.12Å; E122-H126 PolarHBondContact O-N 3.49Å; E122-H126 VanDerWaalsContact O-N 3.13Å
123	A	95.5	Very high	90.4	Very high	3 Å²	3	83.3 Å²	83.3	3%	0.025	43%	0.432	C	S	.	.	H	α-helix	trans	-60.4	-45.6	175.5	0	0	0	0	0	111	M54 L105 M109 I118 T119 K121 A125 H126 F129	M54-A123 HydrophobicContact SD-CB 4.22Å; L105-A123 HydrophobicContact CD1-CB 4.17Å; M109-A123 HydrophobicContact CE-CB 3.94Å; I118-A123 HydrophobicContact CD1-CB 4.02Å; I118-A123 HydrophobicContact CG1-CB 4.19Å; I118-A123 HydrophobicContact CG2-CB 4.27Å; T119-A123 WeakPolarHBondContact O-CB 3.26Å; T119-A123 PolarHBondContact O-N 3.13Å; K121-A123 VanDerWaalsContact C-N 3.35Å; A123-A125 PolarHBondContact O-N 2.91Å; A123-H126 WeakPolarHBondContact O-CB 3.36Å; A123-H126 PolarHBondContact O-N 2.95Å; A123-F129 WeakPolarHBondContact O-CD2 3.35Å
124	L	92.5	Very high	88.7	Confident	119 Å²	119	85.5 Å²	85.5	62%	0.623	45%	0.449	S	S	*	.	H	α-helix	trans	-65.2	-26.6	175.2	-72.3	171.2	0	0	0	113.4	A120 K121 E122 H126	A120-L124 WeakPolarHBondContact O-CG 3.39Å; A120-L124 PolarHBondContact O-N 3.09Å; A120-L124 VanDerWaalsContact O-N 3.08Å; K121-L124 PolarHBondContact O-N 3.45Å; E122-L124 PolarHBondContact O-N 3.07Å; L124-H126 VanDerWaalsContact C-N 3.28Å
125	A	93.1	Very high	87.1	Confident	58 Å²	58	91 Å²	91	48%	0.479	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	0.4	173.8	0	0	0	0	0	113.2	K121 E122 A123 Q130	K121-A125 PolarHBondContact O-N 3.37Å; E122-A125 CarbonylContact O-C 3.48Å; E122-A125 PolarHBondContact O-N 2.71Å; E122-A125 VanDerWaalsContact O-N 3.12Å; A123-A125 PolarHBondContact O-N 2.91Å; A125-Q130 PolarHBondContact O-NE2 3Å
126	H	94.9	Very high	85.4	Confident	18 Å²	18	91.6 Å²	91.6	8%	0.083	48%	0.478	C	S	.	.	S	Bend	trans	-71.8	152.4	-179.5	-163.6	-102.3	0	0	0	112.3	S101 D104 L105 K108 E122 A123 L124 F128 F129 Q130	S101-H126 PolarHBondContact O-CE1 3Å; D104-H126 IonicContact OD2-CE1 3.52Å; D104-H126 PolarHBondContact OD2-CE1 3.4Å; D104-H126 IonicContact OD2-NE2 3.72Å; D104-H126 PolarHBondContact OD2-NE2 3.2Å; L105-H126 HydrophobicContact CD1-CB 3.99Å; K108-H126 PolarHBondContact NZ-NE2 3.44Å; E122-H126 PolarHBondContact O-N 3.49Å; E122-H126 VanDerWaalsContact O-N 3.13Å; A123-H126 WeakPolarHBondContact O-CB 3.36Å; A123-H126 PolarHBondContact O-N 2.95Å; L124-H126 VanDerWaalsContact C-N 3.28Å; H126-F128 PolarHBondContact ND1-N 3.25Å; H126-F128 PolarHBondContact O-N 3.27Å; H126-F129 PolarHBondContact O-N 3.02Å; H126-Q130 PolarHBondContact O-N 3.23Å
127	S	92.7	Very high	83.7	Confident	50 Å²	50	87.5 Å²	87.5	35%	0.35	48%	0.479	S	S	.	.	H	α-helix	trans	-52.8	-33.6	179.8	56.5	0	0	0	0	113.4	F129 Q130 Q131	S127-F129 VanDerWaalsContact C-N 3.34Å; S127-F129 PolarHBondContact O-N 3.3Å; S127-Q130 PolarHBondContact O-N 2.97Å; S127-Q131 WeakPolarHBondContact O-CB 3.45Å; S127-Q131 WeakPolarHBondContact O-CG 3.44Å; S127-Q131 PolarHBondContact O-N 2.7Å
128	F	92.5	Very high	82	Confident	50 Å²	50	91.5 Å²	91.5	22%	0.219	50%	0.504	C	S	.	.	H	α-helix	trans	-53.5	-45.3	175.1	177.8	-100.6	0	0	0	113.1	M61 A102 L105 H126	M61-F128 HydrophobicContact CE-CD1 4.3Å; M61-F128 HydrophobicContact CE-CD2 4.28Å; M61-F128 HydrophobicContact CE-CE1 4.08Å; M61-F128 HydrophobicContact CE-CE2 4.06Å; M61-F128 HydrophobicContact CE-CG 4.4Å; M61-F128 HydrophobicContact CE-CZ 3.95Å; A102-F128 HydrophobicContact CB-CD2 3.7Å; A102-F128 HydrophobicContact CB-CE2 3.69Å; L105-F128 HydrophobicContact CB-CB 4.48Å; L105-F128 HydrophobicContact CD2-CB 3.87Å; L105-F128 HydrophobicContact CD2-CD1 3.6Å; L105-F128 HydrophobicContact CD2-CE1 4.42Å; L105-F128 HydrophobicContact CD2-CG 3.9Å; H126-F128 PolarHBondContact ND1-N 3.25Å; H126-F128 PolarHBondContact O-N 3.27Å
129	F	89.9	Confident	80.1	Confident	85 Å²	85	99.5 Å²	99.5	37%	0.373	54%	0.538	S	S	.	.	H	α-helix	trans	-85.4	-24.2	178.7	-69.1	-73	0	0	0	112.9	L105 A123 H126 S127 Q131 V132	L105-F129 HydrophobicContact CD2-CD2 4.21Å; L105-F129 HydrophobicContact CD2-CE2 3.69Å; L105-F129 HydrophobicContact CD2-CZ 4.45Å; A123-F129 WeakPolarHBondContact O-CD2 3.35Å; H126-F129 PolarHBondContact O-N 3.02Å; S127-F129 VanDerWaalsContact C-N 3.34Å; S127-F129 PolarHBondContact O-N 3.3Å; F129-Q131 VanDerWaalsContact C-N 3.32Å; F129-V132 PolarHBondContact O-N 3.13Å
130	Q	83.6	Confident	78.4	Confident	141 Å²	141	103.2 Å²	103.2	66%	0.659	56%	0.555	S	S	*	*	H	α-helix	trans	-74.6	-22.4	176.2	-65.9	-176.1	-9	0	0	113.1	A125 H126 S127 V132	A125-Q130 PolarHBondContact O-NE2 3Å; H126-Q130 PolarHBondContact O-N 3.23Å; S127-Q130 PolarHBondContact O-N 2.97Å; Q130-V132 VanDerWaalsContact C-N 3.26Å; Q130-V132 PolarHBondContact O-N 2.84Å
131	Q	76.2	Confident	77.1	Confident	126 Å²	126	106.5 Å²	106.5	59%	0.589	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-16.9	175.9	-77.9	173.1	-24.8	0	0	113.3	S101 S127 F129 V133	S101-Q131 PolarHBondContact OG-OE1 2.9Å; S127-Q131 WeakPolarHBondContact O-CB 3.45Å; S127-Q131 WeakPolarHBondContact O-CG 3.44Å; S127-Q131 PolarHBondContact O-N 2.7Å; F129-Q131 VanDerWaalsContact C-N 3.32Å; Q131-V133 PolarHBondContact O-N 3.18Å
132	V	68.4	Low	75.8	Confident	96 Å²	96	102.8 Å²	102.8	58%	0.582	57%	0.565	S	S	*	*			trans	-75.4	96.7	175.7	-174.2	0	0	0	0	107.6	F129 Q130 P134	F129-V132 PolarHBondContact O-N 3.13Å; Q130-V132 VanDerWaalsContact C-N 3.26Å; Q130-V132 PolarHBondContact O-N 2.84Å; V132-P134 WeakPolarHBondContact O-CD 3.35Å; V132-P134 VanDerWaalsContact O-N 3.14Å
133	V	62.1	Low	74.6	Confident	117 Å²	117	103.8 Å²	103.8	71%	0.709	58%	0.579	S	S	*	*			trans	-52.4	120.5	160.7	-177.3	0	0	0	0	105.3	Q131 E135	Q131-V133 PolarHBondContact O-N 3.18Å; V133-E135 VanDerWaalsContact C-N 3.34Å; V133-E135 PolarHBondContact O-N 2.99Å
134	P	60.2	Low	73.8	Confident	106 Å²	106	110.4 Å²	110.4	69%	0.688	61%	0.607	S	S	*	*			trans	-57.5	107.7	172.8	-13.8	25.2	0	0	0	105.5	V132 E136	V132-P134 WeakPolarHBondContact O-CD 3.35Å; V132-P134 VanDerWaalsContact O-N 3.14Å; P134-E136 PolarHBondContact O-N 3.41Å
135	E	61.3	Low	73.4	Confident	145 Å²	145	107.3 Å²	107.3	68%	0.678	59%	0.591	S	S	*	*			trans	-53.4	119.1	166.4	-77	-164.7	165.8	0	0	105.5	V133 G137 V138	V133-E135 VanDerWaalsContact C-N 3.34Å; V133-E135 PolarHBondContact O-N 2.99Å; E135-G137 PolarHBondContact O-N 2.92Å; E135-V138 HydrophobicContact CB-CG2 4Å; E135-V138 PolarHBondContact O-N 3.17Å; E135-V138 VanDerWaalsContact O-N 3.14Å
136	E	57	Low	73	Confident	209 Å²	209	107.1 Å²	107.1	98%	0.977	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	73.1	176.9	-68.6	-178.9	159.6	0	0	108.7	P134	P134-E136 PolarHBondContact O-N 3.41Å
137	G	60.4	Low	72.6	Confident	64 Å²	64	113.6 Å²	113.6	66%	0.66	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	167.1	-34.6	-168	0	0	0	0	0	114.1	E135 K139	E135-G137 PolarHBondContact O-N 2.92Å; G137-K139 PolarHBondContact O-N 3.44Å
138	V	62.7	Low	72.4	Confident	95 Å²	95	116.8 Å²	116.8	58%	0.576	63%	0.625	S	S	*	*			trans	-80.9	75.1	173.9	-170.4	0	0	0	0	108.3	E135 L140	E135-V138 HydrophobicContact CB-CG2 4Å; E135-V138 PolarHBondContact O-N 3.17Å; E135-V138 VanDerWaalsContact O-N 3.14Å; V138-L140 VanDerWaalsContact C-N 3.27Å; V138-L140 PolarHBondContact O-N 3.5Å
139	K	57.5	Low	72.3	Confident	188 Å²	188	120.3 Å²	120.3	82%	0.817	64%	0.64	S	S	*	*			trans	-60.5	100.4	159.8	-68.5	-179.3	-177.1	175.1	0	105.6	G137 V141	G137-K139 PolarHBondContact O-N 3.44Å; K139-V141 PolarHBondContact O-N 2.92Å
140	L	61.6	Low	72.5	Confident	147 Å²	147	122.9 Å²	122.9	77%	0.77	65%	0.652	S	S	*	*			trans	-46.2	115.3	161.1	-70	175.5	0	0	0	105.3	V138 S142	V138-L140 VanDerWaalsContact C-N 3.27Å; V138-L140 PolarHBondContact O-N 3.5Å; L140-S142 PolarHBondContact O-N 2.86Å; L140-S142 VanDerWaalsContact O-N 3.13Å
141	V	67.2	Low	73	Confident	130 Å²	130	122.6 Å²	122.6	79%	0.788	64%	0.644	S	S	*	*			trans	-38.7	125.4	-176.1	174.1	0	0	0	0	107.6	K139 V143	K139-V141 PolarHBondContact O-N 2.92Å; V141-V143 PolarHBondContact O-N 2.77Å
142	S	67.6	Low	73.8	Confident	102 Å²	102	121.8 Å²	121.8	71%	0.713	64%	0.644	S	S	*	*	S	Bend	trans	-30.8	114.8	-171.9	63.2	0	0	0	0	109.8	L140 F144	L140-S142 PolarHBondContact O-N 2.86Å; L140-S142 VanDerWaalsContact O-N 3.13Å; S142-F144 PolarHBondContact O-N 3.01Å
143	V	69.9	Low	75.1	Confident	131 Å²	131	120.3 Å²	120.3	79%	0.794	64%	0.635	S	S	*	*			trans	-40	107.1	-171.6	179.5	0	0	0	0	107.8	V141 D145	V141-V143 PolarHBondContact O-N 2.77Å; V143-D145 PolarHBondContact O-N 2.72Å
144	F	78.8	Confident	76.7	Confident	141 Å²	141	117.3 Å²	117.3	62%	0.618	61%	0.614	S	S	*	*			trans	-62.3	95.9	-176.9	168.6	-100.1	0	0	0	106.3	S142 A146 K149	S142-F144 PolarHBondContact O-N 3.01Å; F144-A146 HydrophobicContact CD1-CB 4.01Å; F144-A146 HydrophobicContact CE1-CB 3.59Å; F144-A146 HydrophobicContact CZ-CB 4.43Å; F144-A146 PolarHBondContact O-N 3.32Å; F144-K149 HydrophobicContact CD2-CD 4.39Å; F144-K149 HydrophobicContact CE2-CD 3.4Å; F144-K149 HydrophobicContact CZ-CD 3.89Å
145	D	83.3	Confident	78.4	Confident	55 Å²	55	116.5 Å²	116.5	29%	0.294	61%	0.607	S	S	.	*			trans	-80.9	82.4	-176.8	-169.9	-29.2	0	0	0	107.1	V143 K147 K148 K149	V143-D145 PolarHBondContact O-N 2.72Å; D145-K147 PolarHBondContact O-N 3.29Å; D145-K147 VanDerWaalsContact O-N 3.12Å; D145-K147 WeakPolarHBondContact OD1-CB 3.49Å; D145-K147 PolarHBondContact OD1-N 3.12Å; D145-K148 HydrophobicContact CB-CB 3.99Å; D145-K148 HydrophobicContact CB-CD 4Å; D145-K148 HydrophobicContact CB-CG 4.17Å; D145-K148 VanDerWaalsContact CG-CG 3.46Å; D145-K148 PolarHBondContact O-N 2.93Å; D145-K148 PolarHBondContact OD1-N 3.02Å; D145-K148 WeakPolarHBondContact OD2-CD 3.25Å; D145-K148 WeakPolarHBondContact OD2-CE 2.97Å; D145-K148 VanDerWaalsContact OD2-CG 3.25Å; D145-K148 WeakPolarHBondContact OD2-CG 3.05Å; D145-K148 IonicContact OD2-NZ 3.04Å; D145-K148 PolarHBondContact OD2-NZ 2.88Å; D145-K149 PolarHBondContact O-N 3.4Å
146	A	85.4	Confident	80.1	Confident	54 Å²	54	115.6 Å²	115.6	45%	0.446	60%	0.603	S	S	.	*	H	α-helix	trans	-51.2	-35.9	180	0	0	0	0	0	111	F144 F150	F144-A146 HydrophobicContact CD1-CB 4.01Å; F144-A146 HydrophobicContact CE1-CB 3.59Å; F144-A146 HydrophobicContact CZ-CB 4.43Å; F144-A146 PolarHBondContact O-N 3.32Å; A146-F150 WeakPolarHBondContact O-CB 3.31Å; A146-F150 PolarHBondContact O-N 3.32Å
147	K	86.1	Confident	81.9	Confident	154 Å²	154	109.5 Å²	109.5	67%	0.67	58%	0.58	S	S	*	*	H	α-helix	trans	-68.2	-45.5	178.2	-64.5	-176.9	-179.5	178.8	0	111.5	D145 R151	D145-K147 PolarHBondContact O-N 3.29Å; D145-K147 VanDerWaalsContact O-N 3.12Å; D145-K147 WeakPolarHBondContact OD1-CB 3.49Å; D145-K147 PolarHBondContact OD1-N 3.12Å; K147-R151 WeakPolarHBondContact O-CB 3.4Å; K147-R151 VanDerWaalsContact O-CG 3.31Å; K147-R151 WeakPolarHBondContact O-CG 3.07Å; K147-R151 PolarHBondContact O-N 2.92Å
148	K	89.1	Confident	83.6	Confident	117 Å²	117	114.1 Å²	114.1	51%	0.509	58%	0.577	S	S	.	*	H	α-helix	trans	-62.7	-47.7	174.1	-75.6	177.3	-168.7	142.6	0	111.2	D145 F150 R151 L152	D145-K148 HydrophobicContact CB-CB 3.99Å; D145-K148 HydrophobicContact CB-CD 4Å; D145-K148 HydrophobicContact CB-CG 4.17Å; D145-K148 VanDerWaalsContact CG-CG 3.46Å; D145-K148 PolarHBondContact O-N 2.93Å; D145-K148 PolarHBondContact OD1-N 3.02Å; D145-K148 WeakPolarHBondContact OD2-CD 3.25Å; D145-K148 WeakPolarHBondContact OD2-CE 2.97Å; D145-K148 VanDerWaalsContact OD2-CG 3.25Å; D145-K148 WeakPolarHBondContact OD2-CG 3.05Å; D145-K148 IonicContact OD2-NZ 3.04Å; D145-K148 PolarHBondContact OD2-NZ 2.88Å; K148-F150 PolarHBondContact O-N 2.81Å; K148-R151 PolarHBondContact O-N 2.84Å; K148-L152 WeakPolarHBondContact O-CB 3.3Å; K148-L152 VanDerWaalsContact O-CG 3.3Å; K148-L152 WeakPolarHBondContact O-CG 3.4Å; K148-L152 PolarHBondContact O-N 2.94Å
149	K	90.3	Very high	85.1	Confident	123 Å²	123	114.2 Å²	114.2	54%	0.535	57%	0.574	S	S	.	*	H	α-helix	trans	-60.8	-46.4	179.5	-166.2	173.1	-175.4	176.8	0	111.1	F144 D145 R151 L152 T153	F144-K149 HydrophobicContact CD2-CD 4.39Å; F144-K149 HydrophobicContact CE2-CD 3.4Å; F144-K149 HydrophobicContact CZ-CD 3.89Å; D145-K149 PolarHBondContact O-N 3.4Å; K149-R151 PolarHBondContact O-N 2.95Å; K149-L152 PolarHBondContact O-N 3.43Å; K149-T153 PolarHBondContact O-N 2.97Å; K149-T153 PolarHBondContact O-OG1 3.48Å
150	F	94.9	Very high	86.9	Confident	140 Å²	140	109.9 Å²	109.9	61%	0.614	56%	0.559	S	S	*	*	H	α-helix	trans	-60.7	-45.5	176.9	-176.7	-113.1	0	0	0	112.5	A146 K148 L152 T153 I154	A146-F150 WeakPolarHBondContact O-CB 3.31Å; A146-F150 PolarHBondContact O-N 3.32Å; K148-F150 PolarHBondContact O-N 2.81Å; F150-L152 VanDerWaalsContact C-N 3.34Å; F150-L152 PolarHBondContact O-N 3.47Å; F150-T153 PolarHBondContact O-N 3.23Å; F150-I154 HydrophobicContact CD1-CD1 3.75Å; F150-I154 HydrophobicContact CE1-CD1 3.36Å; F150-I154 HydrophobicContact CE1-CG1 4.42Å; F150-I154 HydrophobicContact CE2-CD1 4.23Å; F150-I154 HydrophobicContact CG-CD1 4.35Å; F150-I154 HydrophobicContact CZ-CD1 3.63Å; F150-I154 HydrophobicContact CZ-CG1 4.34Å; F150-I154 WeakPolarHBondContact O-CG1 3.38Å; F150-I154 PolarHBondContact O-N 3.02Å
151	R	92.6	Very high	88.4	Confident	134 Å²	134	106.1 Å²	106.1	51%	0.506	54%	0.542	S	S	.	.	H	α-helix	trans	-59.3	-44.8	174.6	-77.2	-170.6	-63.5	-101.4	0.8	111.9	K147 K148 K149 I154 V155	K147-R151 WeakPolarHBondContact O-CB 3.4Å; K147-R151 VanDerWaalsContact O-CG 3.31Å; K147-R151 WeakPolarHBondContact O-CG 3.07Å; K147-R151 PolarHBondContact O-N 2.92Å; K148-R151 PolarHBondContact O-N 2.84Å; K149-R151 PolarHBondContact O-N 2.95Å; R151-I154 PolarHBondContact O-N 3.42Å; R151-V155 WeakPolarHBondContact O-CG2 3.34Å; R151-V155 PolarHBondContact O-N 2.81Å
152	L	93.7	Very high	89.4	Confident	110 Å²	110	108.6 Å²	108.6	58%	0.576	54%	0.537	S	S	*	.	H	α-helix	trans	-62.9	-44	177	-71.1	173.7	0	0	0	111.4	K148 K149 F150 I154 V155 Q156	K148-L152 WeakPolarHBondContact O-CB 3.3Å; K148-L152 VanDerWaalsContact O-CG 3.3Å; K148-L152 WeakPolarHBondContact O-CG 3.4Å; K148-L152 PolarHBondContact O-N 2.94Å; K149-L152 PolarHBondContact O-N 3.43Å; F150-L152 VanDerWaalsContact C-N 3.34Å; F150-L152 PolarHBondContact O-N 3.47Å; L152-I154 VanDerWaalsContact C-N 3.34Å; L152-I154 PolarHBondContact O-N 3.15Å; L152-V155 PolarHBondContact O-N 2.95Å; L152-V155 VanDerWaalsContact O-N 3.15Å; L152-Q156 WeakPolarHBondContact O-CB 3.49Å; L152-Q156 WeakPolarHBondContact O-CG 3.35Å; L152-Q156 PolarHBondContact O-N 3.35Å
153	T	95.5	Very high	90.5	Very high	64 Å²	64	108.1 Å²	108.1	39%	0.393	53%	0.526	S	S	.	.	H	α-helix	trans	-59	-44.8	175.7	-57.4	0	0	0	0	111.2	K149 F150 V155 Q156 V157	K149-T153 PolarHBondContact O-N 2.97Å; K149-T153 PolarHBondContact O-OG1 3.48Å; F150-T153 PolarHBondContact O-N 3.23Å; T153-V155 VanDerWaalsContact C-N 3.34Å; T153-V155 PolarHBondContact O-N 3.45Å; T153-Q156 PolarHBondContact O-N 3.28Å; T153-V157 HydrophobicContact CG2-CG2 4.46Å; T153-V157 VanDerWaalsContact O-CG2 3.28Å; T153-V157 WeakPolarHBondContact O-CG2 3.47Å; T153-V157 PolarHBondContact O-N 3.45Å
154	I	96.1	Very high	91.4	Very high	55 Å²	55	108.2 Å²	108.2	28%	0.282	52%	0.522	S	S	.	.	H	α-helix	trans	-60.2	-43.8	175.5	-69.3	167.7	0	0	0	111.3	F150 R151 L152 V157 R158	F150-I154 HydrophobicContact CD1-CD1 3.75Å; F150-I154 HydrophobicContact CE1-CD1 3.36Å; F150-I154 HydrophobicContact CE1-CG1 4.42Å; F150-I154 HydrophobicContact CE2-CD1 4.23Å; F150-I154 HydrophobicContact CG-CD1 4.35Å; F150-I154 HydrophobicContact CZ-CD1 3.63Å; F150-I154 HydrophobicContact CZ-CG1 4.34Å; F150-I154 WeakPolarHBondContact O-CG1 3.38Å; F150-I154 PolarHBondContact O-N 3.02Å; R151-I154 PolarHBondContact O-N 3.42Å; L152-I154 VanDerWaalsContact C-N 3.34Å; L152-I154 PolarHBondContact O-N 3.15Å; I154-V157 PolarHBondContact O-N 2.88Å; I154-R158 WeakPolarHBondContact O-CB 3.28Å; I154-R158 WeakPolarHBondContact O-CG 3.34Å; I154-R158 PolarHBondContact O-N 3.3Å
155	V	95.9	Very high	91.8	Very high	88 Å²	88	109 Å²	109	53%	0.533	52%	0.521	S	S	.	.	H	α-helix	trans	-64.7	-43	178.4	170.9	0	0	0	0	111.1	R151 L152 T153 R158 L159	R151-V155 WeakPolarHBondContact O-CG2 3.34Å; R151-V155 PolarHBondContact O-N 2.81Å; L152-V155 PolarHBondContact O-N 2.95Å; L152-V155 VanDerWaalsContact O-N 3.15Å; T153-V155 VanDerWaalsContact C-N 3.34Å; T153-V155 PolarHBondContact O-N 3.45Å; V155-R158 PolarHBondContact O-N 3.46Å; V155-L159 WeakPolarHBondContact O-CB 3.3Å; V155-L159 PolarHBondContact O-N 3.29Å
156	Q	95.7	Very high	91.7	Very high	126 Å²	126	111.3 Å²	111.3	59%	0.589	53%	0.532	S	S	*	.	H	α-helix	trans	-61.9	-44.6	176.1	-75.4	179.5	-29	0	0	111.7	L152 T153 R158 L159 L160	L152-Q156 WeakPolarHBondContact O-CB 3.49Å; L152-Q156 WeakPolarHBondContact O-CG 3.35Å; L152-Q156 PolarHBondContact O-N 3.35Å; T153-Q156 PolarHBondContact O-N 3.28Å; Q156-R158 PolarHBondContact O-N 3.28Å; Q156-L159 PolarHBondContact O-N 3.48Å; Q156-L160 VanDerWaalsContact O-CB 3.3Å; Q156-L160 WeakPolarHBondContact O-CB 3.45Å; Q156-L160 PolarHBondContact O-N 2.82Å
157	V	96.3	Very high	91.2	Very high	82 Å²	82	120.4 Å²	120.4	50%	0.497	56%	0.555	S	S	.	*	H	α-helix	trans	-61.2	-45.3	175.2	171.3	0	0	0	0	110.5	T153 I154 L159 L160 V161	T153-V157 HydrophobicContact CG2-CG2 4.46Å; T153-V157 VanDerWaalsContact O-CG2 3.28Å; T153-V157 WeakPolarHBondContact O-CG2 3.47Å; T153-V157 PolarHBondContact O-N 3.45Å; I154-V157 PolarHBondContact O-N 2.88Å; V157-L159 PolarHBondContact O-N 2.8Å; V157-L160 PolarHBondContact O-N 3.01Å; V157-V161 HydrophobicContact CG1-CG2 4.5Å; V157-V161 WeakPolarHBondContact O-CB 3.44Å; V157-V161 VanDerWaalsContact O-CG2 3.28Å; V157-V161 WeakPolarHBondContact O-CG2 3.49Å; V157-V161 PolarHBondContact O-N 2.9Å
158	R	94.7	Very high	90.9	Very high	161 Å²	161	119.9 Å²	119.9	61%	0.608	56%	0.559	S	S	*	*	H	α-helix	trans	-62.6	-40.4	176.4	-75.6	176.1	171.2	145	0.7	112.5	I154 V155 Q156 R162	I154-R158 WeakPolarHBondContact O-CB 3.28Å; I154-R158 WeakPolarHBondContact O-CG 3.34Å; I154-R158 PolarHBondContact O-N 3.3Å; V155-R158 PolarHBondContact O-N 3.46Å; Q156-R158 PolarHBondContact O-N 3.28Å; R158-R162 WeakPolarHBondContact O-CB 3.43Å; R158-R162 WeakPolarHBondContact O-CG 3.43Å; R158-R162 PolarHBondContact O-N 2.81Å
159	L	94.9	Very high	90	Very high	97 Å²	97	118.1 Å²	118.1	51%	0.508	56%	0.557	S	S	.	*	H	α-helix	trans	-65	-46.6	176	177.3	63.8	0	0	0	110.9	V155 Q156 V157 V161 R162 L163	V155-L159 WeakPolarHBondContact O-CB 3.3Å; V155-L159 PolarHBondContact O-N 3.29Å; Q156-L159 PolarHBondContact O-N 3.48Å; V157-L159 PolarHBondContact O-N 2.8Å; L159-V161 PolarHBondContact O-N 3.35Å; L159-R162 CarbonylContact O-C 3.54Å; L159-R162 WeakPolarHBondContact O-CB 3.28Å; L159-R162 PolarHBondContact O-N 2.83Å; L159-R162 VanDerWaalsContact O-N 3.11Å; L159-L163 HydrophobicContact CD1-CD1 4.31Å; L159-L163 HydrophobicContact CD1-CG 4.28Å; L159-L163 HydrophobicContact CG-CD1 4.04Å; L159-L163 HydrophobicContact CG-CG 4.42Å; L159-L163 WeakPolarHBondContact O-CG 3.49Å; L159-L163 PolarHBondContact O-N 3.11Å
160	L	95	Very high	88.7	Confident	97 Å²	97	116 Å²	116	51%	0.508	56%	0.556	S	S	.	*	H	α-helix	trans	-58.8	-47.6	176.9	178.5	63.3	0	0	0	110.8	Q156 V157 R162 L163 L164	Q156-L160 VanDerWaalsContact O-CB 3.3Å; Q156-L160 WeakPolarHBondContact O-CB 3.45Å; Q156-L160 PolarHBondContact O-N 2.82Å; V157-L160 PolarHBondContact O-N 3.01Å; L160-R162 VanDerWaalsContact C-N 3.28Å; L160-R162 PolarHBondContact O-N 3.2Å; L160-L163 PolarHBondContact O-N 3.35Å; L160-L164 HydrophobicContact CD1-CD1 4.15Å; L160-L164 HydrophobicContact CD1-CG 4.13Å; L160-L164 HydrophobicContact CG-CD1 4.01Å; L160-L164 HydrophobicContact CG-CG 4.38Å; L160-L164 WeakPolarHBondContact O-CB 3.28Å; L160-L164 VanDerWaalsContact O-CG 3.28Å; L160-L164 WeakPolarHBondContact O-CG 3.34Å; L160-L164 PolarHBondContact O-N 3.47Å
161	V	93.1	Very high	87.5	Confident	67 Å²	67	115.3 Å²	115.3	41%	0.406	56%	0.563	S	S	.	*	H	α-helix	trans	-59	-40.2	175.2	171.4	0	0	0	0	111.3	V157 L159 R165	V157-V161 HydrophobicContact CG1-CG2 4.5Å; V157-V161 WeakPolarHBondContact O-CB 3.44Å; V157-V161 VanDerWaalsContact O-CG2 3.28Å; V157-V161 WeakPolarHBondContact O-CG2 3.49Å; V157-V161 PolarHBondContact O-N 2.9Å; L159-V161 PolarHBondContact O-N 3.35Å; V161-R165 WeakPolarHBondContact O-CB 3.4Å; V161-R165 VanDerWaalsContact O-CG 3.32Å; V161-R165 WeakPolarHBondContact O-CG 3.48Å; V161-R165 PolarHBondContact O-N 3.05Å; V161-R165 VanDerWaalsContact O-N 3.09Å
162	R	89.2	Confident	86.3	Confident	182 Å²	182	116.9 Å²	116.9	69%	0.687	58%	0.581	S	S	*	*	H	α-helix	trans	-66.6	-41.9	175.5	-77	176.9	175.8	159.4	-1.4	112.7	R158 L159 L160 R165 I166	R158-R162 WeakPolarHBondContact O-CB 3.43Å; R158-R162 WeakPolarHBondContact O-CG 3.43Å; R158-R162 PolarHBondContact O-N 2.81Å; L159-R162 CarbonylContact O-C 3.54Å; L159-R162 WeakPolarHBondContact O-CB 3.28Å; L159-R162 PolarHBondContact O-N 2.83Å; L159-R162 VanDerWaalsContact O-N 3.11Å; L160-R162 VanDerWaalsContact C-N 3.28Å; L160-R162 PolarHBondContact O-N 3.2Å; R162-R165 CarbonylContact O-C 3.46Å; R162-R165 PolarHBondContact O-N 2.96Å; R162-I166 PolarHBondContact O-N 3.17Å
163	L	89.2	Confident	85.4	Confident	92 Å²	92	114.3 Å²	114.3	48%	0.482	57%	0.57	S	S	.	*	H	α-helix	trans	-66.4	-43.6	177.2	-74.7	172.2	0	0	0	111.7	L159 L160 R165 I166	L159-L163 HydrophobicContact CD1-CD1 4.31Å; L159-L163 HydrophobicContact CD1-CG 4.28Å; L159-L163 HydrophobicContact CG-CD1 4.04Å; L159-L163 HydrophobicContact CG-CG 4.42Å; L159-L163 WeakPolarHBondContact O-CG 3.49Å; L159-L163 PolarHBondContact O-N 3.11Å; L160-L163 PolarHBondContact O-N 3.35Å; L163-R165 PolarHBondContact O-N 2.81Å; L163-I166 WeakPolarHBondContact O-CB 3.31Å; L163-I166 WeakPolarHBondContact O-CG2 3.47Å; L163-I166 PolarHBondContact O-N 3.48Å
164	L	89.3	Confident	84.7	Confident	134 Å²	134	114.4 Å²	114.4	70%	0.702	57%	0.573	S	S	*	*	H	α-helix	trans	-63	-31.2	174.9	-69.2	174.9	0	0	0	111.8	L160	L160-L164 HydrophobicContact CD1-CD1 4.15Å; L160-L164 HydrophobicContact CD1-CG 4.13Å; L160-L164 HydrophobicContact CG-CD1 4.01Å; L160-L164 HydrophobicContact CG-CG 4.38Å; L160-L164 WeakPolarHBondContact O-CB 3.28Å; L160-L164 VanDerWaalsContact O-CG 3.28Å; L160-L164 WeakPolarHBondContact O-CG 3.34Å; L160-L164 PolarHBondContact O-N 3.47Å
165	R	87.1	Confident	84	Confident	157 Å²	157	116.9 Å²	116.9	59%	0.592	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	8.8	174	-65.6	-174.1	-174.4	-148.8	2.8	113.7	V161 R162 L163 R167 L168 V169	V161-R165 WeakPolarHBondContact O-CB 3.4Å; V161-R165 VanDerWaalsContact O-CG 3.32Å; V161-R165 WeakPolarHBondContact O-CG 3.48Å; V161-R165 PolarHBondContact O-N 3.05Å; V161-R165 VanDerWaalsContact O-N 3.09Å; R162-R165 CarbonylContact O-C 3.46Å; R162-R165 PolarHBondContact O-N 2.96Å; L163-R165 PolarHBondContact O-N 2.81Å; R165-R167 PolarHBondContact O-N 3.1Å; R165-R167 VanDerWaalsContact O-N 3.17Å; R165-L168 HydrophobicContact CB-CD1 4.4Å; R165-L168 HydrophobicContact CG-CD1 4.33Å; R165-L168 WeakPolarHBondContact O-CA 3.49Å; R165-L168 WeakPolarHBondContact O-CB 3.34Å; R165-L168 PolarHBondContact O-N 2.8Å; R165-V169 PolarHBondContact O-N 3.47Å
166	I	80.7	Confident	83.4	Confident	104 Å²	104	116.2 Å²	116.2	53%	0.533	59%	0.59	S	S	.	*	G	3₁₀ helix	trans	-59.5	-34.3	-173.3	-161.8	168.9	0	0	0	112.9	R162 L163 L168 V169	R162-I166 PolarHBondContact O-N 3.17Å; L163-I166 WeakPolarHBondContact O-CB 3.31Å; L163-I166 WeakPolarHBondContact O-CG2 3.47Å; L163-I166 PolarHBondContact O-N 3.48Å; I166-L168 PolarHBondContact O-N 3.13Å; I166-V169 PolarHBondContact O-N 3.06Å; I166-V169 VanDerWaalsContact O-O 3.08Å
167	R	75.9	Confident	82.9	Confident	244 Å²	244	112.9 Å²	112.9	92%	0.921	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-64.4	-24.8	175.4	-66.3	-172.2	-179.9	178.4	0.6	113.1	R165	R165-R167 PolarHBondContact O-N 3.1Å; R165-R167 VanDerWaalsContact O-N 3.17Å
168	L	79.7	Confident	82.4	Confident	144 Å²	144	110.7 Å²	110.7	75%	0.754	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-88.1	-17.3	175	-60.8	168.8	0	0	0	112	R165 I166	R165-L168 HydrophobicContact CB-CD1 4.4Å; R165-L168 HydrophobicContact CG-CD1 4.33Å; R165-L168 WeakPolarHBondContact O-CA 3.49Å; R165-L168 WeakPolarHBondContact O-CB 3.34Å; R165-L168 PolarHBondContact O-N 2.8Å; I166-L168 PolarHBondContact O-N 3.13Å
169	V	69.3	Low	82.1	Confident	79 Å²	79	110.6 Å²	110.6	48%	0.479	58%	0.576	S	S	.	*	S	Bend	trans	-83.8	126	176.9	-177.8	0	0	0	0	108.3	R165 I166 V171	R165-V169 PolarHBondContact O-N 3.47Å; I166-V169 PolarHBondContact O-N 3.06Å; I166-V169 VanDerWaalsContact O-O 3.08Å; V169-V171 PolarHBondContact O-N 3.29Å
170	P	64.6	Low	81.9	Confident	79 Å²	79	112.2 Å²	112.2	51%	0.513	59%	0.59	S	S	.	*			trans	-59.2	128	179.5	25.3	-35	0	0	0	110.6	L172 K187	P170-L172 PolarHBondContact O-N 3.01Å; P170-K187 HydrophobicContact CB-CD 4.04Å
171	V	69	Low	81.7	Confident	126 Å²	126	111.4 Å²	111.4	76%	0.764	59%	0.586	S	S	*	*			trans	-32	128.2	173.9	177.4	0	0	0	0	111.7	V169 V173	V169-V171 PolarHBondContact O-N 3.29Å; V171-V173 PolarHBondContact O-N 3.09Å; V171-V173 VanDerWaalsContact O-N 3.1Å
172	L	67.1	Low	81.4	Confident	167 Å²	167	110.4 Å²	110.4	87%	0.874	58%	0.581	S	S	*	*			trans	-50.6	115.2	179	-62.7	171.9	0	0	0	109.4	P170 S174	P170-L172 PolarHBondContact O-N 3.01Å; L172-S174 PolarHBondContact O-N 3.47Å
173	V	74.6	Confident	81.3	Confident	56 Å²	56	106.4 Å²	106.4	34%	0.339	57%	0.567	S	S	.	*			trans	-74.2	126.2	170.7	-167.9	0	0	0	0	106.9	V171 V175 V178 T185 I188	V171-V173 PolarHBondContact O-N 3.09Å; V171-V173 VanDerWaalsContact O-N 3.1Å; V173-V175 PolarHBondContact O-N 3.31Å; V173-V178 HydrophobicContact CB-CG2 4.12Å; V173-V178 HydrophobicContact CG1-CG2 3.31Å; V173-T185 HydrophobicContact CG1-CG2 4.22Å; V173-T185 HydrophobicContact CG2-CG2 4.04Å; V173-I188 HydrophobicContact CB-CD1 4.21Å; V173-I188 HydrophobicContact CG1-CD1 3.81Å; V173-I188 HydrophobicContact CG2-CD1 4.26Å
174	S	81.5	Confident	81.2	Confident	65 Å²	65	105.1 Å²	105.1	46%	0.455	57%	0.569	S	S	.	*			trans	-58.1	121	177.1	176.8	0	0	0	0	110.5	L172 S176 A177 V178	L172-S174 PolarHBondContact O-N 3.47Å; S174-S176 VanDerWaalsContact C-N 3.27Å; S174-S176 PolarHBondContact O-N 3.46Å; S174-S176 PolarHBondContact OG-OG 3.2Å; S174-A177 WeakPolarHBondContact O-CB 3.32Å; S174-A177 PolarHBondContact O-N 3.14Å; S174-A177 VanDerWaalsContact O-N 3.11Å; S174-V178 WeakPolarHBondContact O-CG2 3.37Å; S174-V178 PolarHBondContact O-N 3.47Å; S174-V178 VanDerWaalsContact O-N 3.11Å
175	V	80.4	Confident	80.9	Confident	107 Å²	107	100.6 Å²	100.6	65%	0.648	55%	0.547	S	S	*	.	H	α-helix	trans	-59	-40.6	-177.6	178.9	0	0	0	0	111.1	V173 A177 V178 Q179	V173-V175 PolarHBondContact O-N 3.31Å; V175-A177 VanDerWaalsContact C-N 3.33Å; V175-A177 PolarHBondContact O-N 3.44Å; V175-V178 PolarHBondContact O-N 2.99Å; V175-Q179 WeakPolarHBondContact O-CG 3.19Å; V175-Q179 PolarHBondContact O-N 3.11Å
176	S	84.7	Confident	80.7	Confident	75 Å²	75	101.8 Å²	101.8	52%	0.524	55%	0.552	S	S	.	*	H	α-helix	trans	-63.5	-37.8	178.2	50.4	0	0	0	0	112.2	S174 Q179 V180	S174-S176 VanDerWaalsContact C-N 3.27Å; S174-S176 PolarHBondContact O-N 3.46Å; S174-S176 PolarHBondContact OG-OG 3.2Å; S176-Q179 PolarHBondContact O-N 3.43Å; S176-V180 PolarHBondContact O-N 3.11Å
177	A	84.7	Confident	80.8	Confident	55 Å²	55	102.8 Å²	102.8	46%	0.455	55%	0.552	S	S	.	*	H	α-helix	trans	-68.1	-36.3	175.7	0	0	0	0	0	112.3	S174 V175 N181	S174-A177 WeakPolarHBondContact O-CB 3.32Å; S174-A177 PolarHBondContact O-N 3.14Å; S174-A177 VanDerWaalsContact O-N 3.11Å; V175-A177 VanDerWaalsContact C-N 3.33Å; V175-A177 PolarHBondContact O-N 3.44Å; A177-N181 PolarHBondContact O-N 3.33Å; A177-N181 VanDerWaalsContact O-N 3.14Å
178	V	85.4	Confident	81.3	Confident	36 Å²	36	92.9 Å²	92.9	22%	0.218	52%	0.517	C	S	.	.	H	α-helix	trans	-69.5	-36.6	177.5	179.1	0	0	0	0	112	V173 S174 V175 V180 N181 P182 I188	V173-V178 HydrophobicContact CB-CG2 4.12Å; V173-V178 HydrophobicContact CG1-CG2 3.31Å; S174-V178 WeakPolarHBondContact O-CG2 3.37Å; S174-V178 PolarHBondContact O-N 3.47Å; S174-V178 VanDerWaalsContact O-N 3.11Å; V175-V178 PolarHBondContact O-N 2.99Å; V178-V180 VanDerWaalsContact C-N 3.32Å; V178-V180 PolarHBondContact O-N 3.2Å; V178-N181 CarbonylContact O-C 3.57Å; V178-P182 HydrophobicContact CG1-CB 4.04Å; V178-P182 WeakPolarHBondContact O-CA 3.4Å; V178-P182 WeakPolarHBondContact O-CB 3.23Å; V178-P182 VanDerWaalsContact O-CD 3.23Å; V178-P182 WeakPolarHBondContact O-CD 3.49Å; V178-I188 HydrophobicContact CB-CD1 4.12Å; V178-I188 HydrophobicContact CG1-CD1 3.7Å; V178-I188 HydrophobicContact CG2-CD1 3.22Å
179	Q	88.6	Confident	81.7	Confident	159 Å²	159	91.5 Å²	91.5	74%	0.743	50%	0.502	S	S	*	.	H	α-helix	trans	-62.7	-39.6	178	-78.3	178.3	-27.4	0	0	112.2	V175 S176	V175-Q179 WeakPolarHBondContact O-CG 3.19Å; V175-Q179 PolarHBondContact O-N 3.11Å; S176-Q179 PolarHBondContact O-N 3.43Å
180	V	91.3	Very high	82.6	Confident	131 Å²	131	93.6 Å²	93.6	79%	0.794	51%	0.505	S	S	*	.	H	α-helix	trans	-75	-45.1	179.6	179.8	0	0	0	0	111.3	S176 V178	S176-V180 PolarHBondContact O-N 3.11Å; V178-V180 VanDerWaalsContact C-N 3.32Å; V178-V180 PolarHBondContact O-N 3.2Å
181	N	89.5	Confident	83.6	Confident	80 Å²	80	92.3 Å²	92.3	43%	0.428	50%	0.501	S	S	.	.			trans	-146.7	91.9	178.5	-172	-13.2	0	0	0	111.8	A177 V178 Y183 A184	A177-N181 PolarHBondContact O-N 3.33Å; A177-N181 VanDerWaalsContact O-N 3.14Å; V178-N181 CarbonylContact O-C 3.57Å; N181-Y183 PolarHBondContact O-N 2.98Å; N181-Y183 PolarHBondContact OD1-N 2.94Å; N181-Y183 VanDerWaalsContact OD1-N 3.13Å; N181-A184 HydrophobicContact CB-CB 4.11Å; N181-A184 WeakPolarHBondContact O-CB 3.12Å; N181-A184 PolarHBondContact O-N 3.05Å; N181-A184 VanDerWaalsContact O-N 3.16Å; N181-A184 PolarHBondContact OD1-N 3.3Å; N181-A184 VanDerWaalsContact OD1-N 3.14Å
182	P	86.7	Confident	84.6	Confident	46 Å²	46	88.7 Å²	88.7	30%	0.299	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-22.8	-179	26.4	-33.2	0	0	0	112.6	V178 A184 I188 I192	V178-P182 HydrophobicContact CG1-CB 4.04Å; V178-P182 WeakPolarHBondContact O-CA 3.4Å; V178-P182 WeakPolarHBondContact O-CB 3.23Å; V178-P182 VanDerWaalsContact O-CD 3.23Å; V178-P182 WeakPolarHBondContact O-CD 3.49Å; P182-A184 VanDerWaalsContact C-N 3.34Å; P182-I188 HydrophobicContact CB-CG2 4.13Å; P182-I188 WeakPolarHBondContact O-CB 3.4Å; P182-I188 WeakPolarHBondContact O-CG2 3.5Å; P182-I192 HydrophobicContact CB-CD1 3.99Å
183	Y	88	Confident	85.6	Confident	99 Å²	99	83.3 Å²	83.3	39%	0.388	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-14.3	177.2	-78.1	-89.6	0	0	0	113.5	N181 T185 R189 I192	N181-Y183 PolarHBondContact O-N 2.98Å; N181-Y183 PolarHBondContact OD1-N 2.94Å; N181-Y183 VanDerWaalsContact OD1-N 3.13Å; Y183-T185 VanDerWaalsContact C-N 3.26Å; Y183-T185 PolarHBondContact O-N 2.76Å; Y183-R189 HydrophobicContact CD1-CB 4.29Å; Y183-R189 HydrophobicContact CD1-CG 3.77Å; Y183-R189 HydrophobicContact CE1-CG 4.25Å; Y183-R189 VanDerWaalsContact O-CZ 3.27Å; Y183-R189 PolarHBondContact O-NE 3.22Å; Y183-R189 PolarHBondContact O-NH2 3.01Å; Y183-I192 HydrophobicContact CE1-CG2 4.38Å; Y183-I192 HydrophobicContact CE2-CD1 4.45Å; Y183-I192 WeakPolarHBondContact OH-CG2 3.33Å
184	A	86.6	Confident	86.2	Confident	64 Å²	64	83.6 Å²	83.6	53%	0.529	46%	0.457	S	S	.	.	S	Bend	trans	-60.6	-37	178.2	0	0	0	0	0	111.9	N181 P182	N181-A184 HydrophobicContact CB-CB 4.11Å; N181-A184 WeakPolarHBondContact O-CB 3.12Å; N181-A184 PolarHBondContact O-N 3.05Å; N181-A184 VanDerWaalsContact O-N 3.16Å; N181-A184 PolarHBondContact OD1-N 3.3Å; N181-A184 VanDerWaalsContact OD1-N 3.14Å; P182-A184 VanDerWaalsContact C-N 3.34Å
185	T	82.8	Confident	86.5	Confident	40 Å²	40	85.7 Å²	85.7	25%	0.245	46%	0.462	C	S	.	.	S	Bend	trans	-89.8	119.5	-178.1	-58.2	0	0	0	0	111.3	V173 Y183 K187 I188 R189	V173-T185 HydrophobicContact CG1-CG2 4.22Å; V173-T185 HydrophobicContact CG2-CG2 4.04Å; Y183-T185 VanDerWaalsContact C-N 3.26Å; Y183-T185 PolarHBondContact O-N 2.76Å; T185-K187 HydrophobicContact CG2-CB 4.3Å; T185-K187 PolarHBondContact O-N 3.43Å; T185-K187 VanDerWaalsContact O-N 3.11Å; T185-I188 HydrophobicContact CG2-CD1 4.39Å; T185-I188 HydrophobicContact CG2-CG1 4.2Å; T185-I188 PolarHBondContact O-N 3.43Å; T185-R189 WeakPolarHBondContact O-CB 3.37Å; T185-R189 PolarHBondContact O-N 2.97Å
186	R	83.6	Confident	86.8	Confident	182 Å²	182	81.5 Å²	81.5	69%	0.687	44%	0.439	S	S	*	.	H	α-helix	trans	-52.3	-37.2	179.6	-171.8	178.9	-176.2	-165.7	1.5	113.9	K190	R186-K190 WeakPolarHBondContact O-CB 3.45Å; R186-K190 VanDerWaalsContact O-CG 3.29Å; R186-K190 WeakPolarHBondContact O-CG 3.12Å; R186-K190 PolarHBondContact O-N 3.41Å
187	K	82	Confident	86.8	Confident	124 Å²	124	82.2 Å²	82.2	54%	0.539	43%	0.433	S	S	.	.	H	α-helix	trans	-68.1	-43.3	179.1	-67.6	179	-177	165	0	112.2	P170 T185 A191	P170-K187 HydrophobicContact CB-CD 4.04Å; T185-K187 HydrophobicContact CG2-CB 4.3Å; T185-K187 PolarHBondContact O-N 3.43Å; T185-K187 VanDerWaalsContact O-N 3.11Å; K187-A191 PolarHBondContact O-N 2.95Å; K187-A191 VanDerWaalsContact O-N 3.11Å
188	I	86.2	Confident	86.8	Confident	36 Å²	36	89.7 Å²	89.7	19%	0.185	45%	0.449	C	S	.	.	H	α-helix	trans	-70.8	-45.5	179.5	-63.4	178.6	0	0	0	109.9	V173 V178 P182 T185 K190 A191 I192	V173-I188 HydrophobicContact CB-CD1 4.21Å; V173-I188 HydrophobicContact CG1-CD1 3.81Å; V173-I188 HydrophobicContact CG2-CD1 4.26Å; V178-I188 HydrophobicContact CB-CD1 4.12Å; V178-I188 HydrophobicContact CG1-CD1 3.7Å; V178-I188 HydrophobicContact CG2-CD1 3.22Å; P182-I188 HydrophobicContact CB-CG2 4.13Å; P182-I188 WeakPolarHBondContact O-CB 3.4Å; P182-I188 WeakPolarHBondContact O-CG2 3.5Å; T185-I188 HydrophobicContact CG2-CD1 4.39Å; T185-I188 HydrophobicContact CG2-CG1 4.2Å; T185-I188 PolarHBondContact O-N 3.43Å; I188-K190 VanDerWaalsContact C-N 3.34Å; I188-K190 PolarHBondContact O-N 3.41Å; I188-A191 WeakPolarHBondContact O-CB 3.26Å; I188-A191 PolarHBondContact O-N 2.81Å; I188-I192 HydrophobicContact CG2-CD1 3.7Å; I188-I192 HydrophobicContact CG2-CG1 4.24Å; I188-I192 WeakPolarHBondContact O-CG1 3.18Å; I188-I192 PolarHBondContact O-N 3.2Å
189	R	89.3	Confident	86.8	Confident	115 Å²	115	91.9 Å²	91.9	43%	0.434	46%	0.462	S	S	.	.	H	α-helix	trans	-50.8	-53	171.6	-178.8	-178.2	-42.3	179.5	4.2	111.6	Y183 T185 A191 I192 D193	Y183-R189 HydrophobicContact CD1-CB 4.29Å; Y183-R189 HydrophobicContact CD1-CG 3.77Å; Y183-R189 HydrophobicContact CE1-CG 4.25Å; Y183-R189 VanDerWaalsContact O-CZ 3.27Å; Y183-R189 PolarHBondContact O-NE 3.22Å; Y183-R189 PolarHBondContact O-NH2 3.01Å; T185-R189 WeakPolarHBondContact O-CB 3.37Å; T185-R189 PolarHBondContact O-N 2.97Å; R189-A191 VanDerWaalsContact C-N 3.27Å; R189-A191 PolarHBondContact O-N 2.84Å; R189-I192 PolarHBondContact O-N 2.87Å; R189-D193 WeakPolarHBondContact CG-OD2 3.39Å; R189-D193 WeakPolarHBondContact O-CB 3.33Å; R189-D193 PolarHBondContact O-N 3.37Å
190	K	86.9	Confident	86.6	Confident	124 Å²	124	90.4 Å²	90.4	54%	0.539	45%	0.451	S	S	.	.	H	α-helix	trans	-57.2	-38.2	177.3	-79.6	-176.7	175.6	-168.2	0	113.2	R186 I188 A194	R186-K190 WeakPolarHBondContact O-CB 3.45Å; R186-K190 VanDerWaalsContact O-CG 3.29Å; R186-K190 WeakPolarHBondContact O-CG 3.12Å; R186-K190 PolarHBondContact O-N 3.41Å; I188-K190 VanDerWaalsContact C-N 3.34Å; I188-K190 PolarHBondContact O-N 3.41Å; K190-A194 WeakPolarHBondContact O-CB 3.46Å; K190-A194 PolarHBondContact O-N 3.03Å
191	A	86.6	Confident	86	Confident	52 Å²	52	85 Å²	85	43%	0.43	42%	0.422	S	S	.	.	H	α-helix	trans	-69.9	-44.5	178.2	0	0	0	0	0	111.8	K187 I188 R189 A194 L195	K187-A191 PolarHBondContact O-N 2.95Å; K187-A191 VanDerWaalsContact O-N 3.11Å; I188-A191 WeakPolarHBondContact O-CB 3.26Å; I188-A191 PolarHBondContact O-N 2.81Å; R189-A191 VanDerWaalsContact C-N 3.27Å; R189-A191 PolarHBondContact O-N 2.84Å; A191-A194 PolarHBondContact O-N 3.26Å; A191-L195 WeakPolarHBondContact O-CG 3.33Å; A191-L195 PolarHBondContact O-N 3.04Å
192	I	89.8	Confident	85.6	Confident	50 Å²	50	87.8 Å²	87.8	26%	0.256	43%	0.432	S	S	.	.	H	α-helix	trans	-60.7	-49.3	175.1	-65.7	170.1	0	0	0	109.8	P182 Y183 I188 R189 A194 L195 A196	P182-I192 HydrophobicContact CB-CD1 3.99Å; Y183-I192 HydrophobicContact CE1-CG2 4.38Å; Y183-I192 HydrophobicContact CE2-CD1 4.45Å; Y183-I192 WeakPolarHBondContact OH-CG2 3.33Å; I188-I192 HydrophobicContact CG2-CD1 3.7Å; I188-I192 HydrophobicContact CG2-CG1 4.24Å; I188-I192 WeakPolarHBondContact O-CG1 3.18Å; I188-I192 PolarHBondContact O-N 3.2Å; R189-I192 PolarHBondContact O-N 2.87Å; I192-A194 VanDerWaalsContact C-N 3.33Å; I192-A194 PolarHBondContact O-N 3.11Å; I192-L195 PolarHBondContact O-N 3.17Å; I192-A196 WeakPolarHBondContact O-CB 3.41Å; I192-A196 PolarHBondContact O-N 3.28Å
193	D	88.6	Confident	85.3	Confident	53 Å²	53	94.7 Å²	94.7	28%	0.283	45%	0.452	S	S	.	.	H	α-helix	trans	-63.8	-38.4	-179.6	-63.3	-17.8	0	0	0	111.7	R189 A196 F197	R189-D193 WeakPolarHBondContact CG-OD2 3.39Å; R189-D193 WeakPolarHBondContact O-CB 3.33Å; R189-D193 PolarHBondContact O-N 3.37Å; D193-A196 PolarHBondContact O-N 3.17Å; D193-F197 VanDerWaalsContact O-CB 3.26Å; D193-F197 WeakPolarHBondContact O-CB 3.19Å; D193-F197 PolarHBondContact O-N 2.91Å
194	A	86.6	Confident	84.6	Confident	62 Å²	62	91.8 Å²	91.8	51%	0.512	45%	0.445	S	S	.	.	H	α-helix	trans	-65.3	-41.3	175.8	0	0	0	0	0	112	K190 A191 I192 R198	K190-A194 WeakPolarHBondContact O-CB 3.46Å; K190-A194 PolarHBondContact O-N 3.03Å; A191-A194 PolarHBondContact O-N 3.26Å; I192-A194 VanDerWaalsContact C-N 3.33Å; I192-A194 PolarHBondContact O-N 3.11Å; A194-R198 WeakPolarHBondContact O-CB 3.45Å; A194-R198 PolarHBondContact O-N 3.11Å
195	L	87.7	Confident	83.7	Confident	109 Å²	109	96.9 Å²	96.9	57%	0.571	46%	0.455	S	S	*	.	H	α-helix	trans	-67.9	-44.3	175.2	-72	171.3	0	0	0	111.6	A191 I192 F197 R198 V199	A191-L195 WeakPolarHBondContact O-CG 3.33Å; A191-L195 PolarHBondContact O-N 3.04Å; I192-L195 PolarHBondContact O-N 3.17Å; L195-F197 VanDerWaalsContact C-N 3.34Å; L195-F197 PolarHBondContact O-N 3.03Å; L195-R198 WeakPolarHBondContact O-CB 3.5Å; L195-R198 PolarHBondContact O-N 2.86Å; L195-R198 VanDerWaalsContact O-N 3.13Å; L195-V199 WeakPolarHBondContact O-CG2 3.33Å; L195-V199 PolarHBondContact O-N 3.25Å; L195-V199 VanDerWaalsContact O-N 3.1Å
196	A	87.9	Confident	83	Confident	19 Å²	19	105.7 Å²	105.7	16%	0.157	49%	0.49	C	S	.	.	H	α-helix	trans	-60	-44.6	175.9	0	0	0	0	0	111	I192 D193 R198 V199 Y200	I192-A196 WeakPolarHBondContact O-CB 3.41Å; I192-A196 PolarHBondContact O-N 3.28Å; D193-A196 PolarHBondContact O-N 3.17Å; A196-R198 VanDerWaalsContact C-N 3.31Å; A196-R198 PolarHBondContact O-N 3.1Å; A196-V199 PolarHBondContact O-N 3.4Å; A196-Y200 VanDerWaalsContact O-CD2 3.31Å; A196-Y200 WeakPolarHBondContact O-CD2 3.34Å; A196-Y200 PolarHBondContact O-N 3.14Å
197	F	84.8	Confident	82.3	Confident	91 Å²	91	99.2 Å²	99.2	40%	0.399	48%	0.48	S	S	.	.	H	α-helix	trans	-66.5	-32	175.5	-167.8	-94.5	0	0	0	112.4	D193 L195 V199 G201 V204	D193-F197 VanDerWaalsContact O-CB 3.26Å; D193-F197 WeakPolarHBondContact O-CB 3.19Å; D193-F197 PolarHBondContact O-N 2.91Å; L195-F197 VanDerWaalsContact C-N 3.34Å; L195-F197 PolarHBondContact O-N 3.03Å; F197-V199 VanDerWaalsContact C-N 3.27Å; F197-V199 PolarHBondContact O-N 3.07Å; F197-G201 WeakPolarHBondContact O-CA 3.29Å; F197-G201 PolarHBondContact O-N 3.16Å; F197-V204 HydrophobicContact CE2-CG2 4.41Å
198	R	83.3	Confident	81.4	Confident	211 Å²	211	105.6 Å²	105.6	80%	0.796	50%	0.5	S	S	*	.	H	α-helix	trans	-63.9	-35.2	173.3	-163.5	175.8	86.1	146.4	4	112.1	A194 L195 A196	A194-R198 WeakPolarHBondContact O-CB 3.45Å; A194-R198 PolarHBondContact O-N 3.11Å; L195-R198 WeakPolarHBondContact O-CB 3.5Å; L195-R198 PolarHBondContact O-N 2.86Å; L195-R198 VanDerWaalsContact O-N 3.13Å; A196-R198 VanDerWaalsContact C-N 3.31Å; A196-R198 PolarHBondContact O-N 3.1Å
199	V	85.6	Confident	80.1	Confident	82 Å²	82	112.6 Å²	112.6	50%	0.497	53%	0.532	S	S	.	.	H	α-helix	trans	-79.4	-50.9	177.9	177.2	0	0	0	0	111	L195 A196 F197 H202	L195-V199 WeakPolarHBondContact O-CG2 3.33Å; L195-V199 PolarHBondContact O-N 3.25Å; L195-V199 VanDerWaalsContact O-N 3.1Å; A196-V199 PolarHBondContact O-N 3.4Å; F197-V199 VanDerWaalsContact C-N 3.27Å; F197-V199 PolarHBondContact O-N 3.07Å; V199-H202 PolarHBondContact O-CE1 3.46Å; V199-H202 PolarHBondContact O-ND1 3.34Å
200	Y	84.9	Confident	78.7	Confident	128 Å²	128	111.1 Å²	111.1	50%	0.502	53%	0.53	S	S	.	.	H	α-helix	trans	-100.4	-6.2	-169.3	-61.2	-69.7	0	0	0	115.1	A196 H202 W203	A196-Y200 VanDerWaalsContact O-CD2 3.31Å; A196-Y200 WeakPolarHBondContact O-CD2 3.34Å; A196-Y200 PolarHBondContact O-N 3.14Å; Y200-H202 PolarHBondContact O-N 3.25Å; Y200-W203 WeakPolarHBondContact O-CB 3.41Å; Y200-W203 PolarHBondContact O-N 3.29Å
201	G	79.4	Confident	77.4	Confident	17 Å²	17	113 Å²	113	18%	0.175	54%	0.539	C	S	.	.	G	3₁₀ helix	trans	-60.9	-22.7	-173.2	0	0	0	0	0	114.2	F197 W203 V204	F197-G201 WeakPolarHBondContact O-CA 3.29Å; F197-G201 PolarHBondContact O-N 3.16Å; G201-W203 VanDerWaalsContact C-N 3.34Å; G201-V204 PolarHBondContact O-N 3.13Å
202	H	80.3	Confident	76	Confident	140 Å²	140	119.7 Å²	119.7	65%	0.648	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-73	-23.2	175.1	67.2	-84.8	0	0	0	113.7	V199 Y200 V204	V199-H202 PolarHBondContact O-CE1 3.46Å; V199-H202 PolarHBondContact O-ND1 3.34Å; Y200-H202 PolarHBondContact O-N 3.25Å; H202-V204 VanDerWaalsContact C-N 3.28Å
203	W	80.2	Confident	74.8	Confident	190 Å²	190	122.8 Å²	122.8	72%	0.72	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-78.8	-14.5	172.9	-59.6	91.6	0	0	0	112.3	Y200 G201 K205	Y200-W203 WeakPolarHBondContact O-CB 3.41Å; Y200-W203 PolarHBondContact O-N 3.29Å; G201-W203 VanDerWaalsContact C-N 3.34Å; W203-K205 PolarHBondContact O-N 3.12Å
204	V	72.7	Confident	73.5	Confident	38 Å²	38	123.3 Å²	123.3	23%	0.23	58%	0.582	C	S	.	*	S	Bend	trans	-82.4	114.3	178.3	-174.1	0	0	0	0	109.3	F197 G201 H202 K206 L215	F197-V204 HydrophobicContact CE2-CG2 4.41Å; G201-V204 PolarHBondContact O-N 3.13Å; H202-V204 VanDerWaalsContact C-N 3.28Å; V204-K206 PolarHBondContact O-N 3.27Å; V204-L215 HydrophobicContact CG2-CB 4.27Å; V204-L215 HydrophobicContact CG2-CD1 3.76Å; V204-L215 HydrophobicContact CG2-CD2 4.38Å; V204-L215 HydrophobicContact CG2-CG 4.36Å
205	K	69.1	Low	72.2	Confident	172 Å²	172	122.9 Å²	122.9	75%	0.748	57%	0.571	S	S	*	*			trans	-66.7	129.6	179.5	-72.7	-178	178.3	-179.7	0	110.6	W203 G207 Q210	W203-K205 PolarHBondContact O-N 3.12Å; K205-G207 PolarHBondContact O-N 3.13Å; K205-Q210 PolarHBondContact O-NE2 3.05Å; K205-Q210 PolarHBondContact O-OE1 3.31Å
206	K	66.6	Low	70.9	Confident	224 Å²	224	123.4 Å²	123.4	97%	0.974	57%	0.568	S	S	*	*			trans	-75	92.7	175	-64.9	179.6	-179.4	177	0	110.5	V204	V204-K206 PolarHBondContact O-N 3.27Å
207	G	69.4	Low	69.8	Low	46 Å²	46	124.8 Å²	124.8	47%	0.474	58%	0.584	S	S	.	*			trans	-126.4	162.5	176.1	0	0	0	0	0	112.5	K205 E209	K205-G207 PolarHBondContact O-N 3.13Å; G207-E209 PolarHBondContact O-N 3.44Å
208	R	63.6	Low	68.3	Low	259 Å²	259	128.4 Å²	128.4	98%	0.977	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-21.3	-176	-71.7	-172.9	178.4	-169.2	-0.2	114.5
209	E	59.2	Low	67.2	Low	183 Å²	183	124.4 Å²	124.4	86%	0.855	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.7	63.6	-174.7	-62.6	-174.7	168.7	0	0	111.5	G207	G207-E209 PolarHBondContact O-N 3.44Å
210	Q	59.5	Low	65.8	Low	84 Å²	84	126.8 Å²	126.8	39%	0.393	62%	0.621	S	S	.	*			trans	-128.2	121.3	171.9	-69.7	-173.4	39	0	0	111.9	K205	K205-Q210 PolarHBondContact O-NE2 3.05Å; K205-Q210 PolarHBondContact O-OE1 3.31Å
211	F	59.3	Low	64.3	Low	163 Å²	163	128.7 Å²	128.7	72%	0.715	63%	0.632	S	S	*	*			trans	-79	139.2	166.6	-60.2	-81.6	0	0	0	108.6	D213 A214	F211-D213 HydrophobicContact CB-CB 4.45Å; F211-D213 PolarHBondContact O-N 3Å; F211-A214 WeakPolarHBondContact O-CB 3.38Å; F211-A214 PolarHBondContact O-N 3.44Å
212	R	57.6	Low	62.6	Low	192 Å²	192	132.9 Å²	132.9	73%	0.725	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-47.8	-27.1	175.1	-81.8	-178	169.3	-176	-3.1	112.9	A214 L215	R212-A214 PolarHBondContact O-N 2.95Å; R212-L215 PolarHBondContact O-N 2.76Å
213	D	63.7	Low	61.4	Low	115 Å²	115	132.3 Å²	132.3	62%	0.615	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-64.1	-21.2	-179.3	-47.5	-31.2	0	0	0	113.3	F211 L215 F216 G217	F211-D213 HydrophobicContact CB-CB 4.45Å; F211-D213 PolarHBondContact O-N 3Å; D213-L215 PolarHBondContact O-N 3.06Å; D213-L215 VanDerWaalsContact O-N 3.12Å; D213-F216 PolarHBondContact O-N 3.47Å; D213-G217 PolarHBondContact O-N 3.03Å
214	A	62.8	Low	59.6	Low	64 Å²	64	130.4 Å²	130.4	53%	0.529	66%	0.66	S	S	.	*	G	3₁₀ helix	trans	-60.5	-22.5	176.1	0	0	0	0	0	113	F211 R212 F216	F211-A214 WeakPolarHBondContact O-CB 3.38Å; F211-A214 PolarHBondContact O-N 3.44Å; R212-A214 PolarHBondContact O-N 2.95Å; A214-F216 VanDerWaalsContact C-N 3.32Å
215	L	58.1	Low	58.7	Low	54 Å²	54	134.9 Å²	134.9	28%	0.283	68%	0.683	S	S	.	*	G	3₁₀ helix	trans	-69.6	-28.4	175.3	-176.1	66.6	0	0	0	112.7	V204 R212 D213	V204-L215 HydrophobicContact CG2-CB 4.27Å; V204-L215 HydrophobicContact CG2-CD1 3.76Å; V204-L215 HydrophobicContact CG2-CD2 4.38Å; V204-L215 HydrophobicContact CG2-CG 4.36Å; R212-L215 PolarHBondContact O-N 2.76Å; D213-L215 PolarHBondContact O-N 3.06Å; D213-L215 VanDerWaalsContact O-N 3.12Å
216	F	60.7	Low	57.8	Low	120 Å²	120	138 Å²	138	53%	0.526	69%	0.69	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.4	2.8	-175.9	-57.4	-73.8	0	0	0	113.3	D213 A214 N218	D213-F216 PolarHBondContact O-N 3.47Å; A214-F216 VanDerWaalsContact C-N 3.32Å; F216-N218 PolarHBondContact O-N 3.03Å
217	G	64.9	Low	57.3	Low	47 Å²	47	137.1 Å²	137.1	49%	0.485	68%	0.682	S	S	.	*			trans	-75.7	118.7	178.7	0	0	0	0	0	111.8	D213 V219	D213-G217 PolarHBondContact O-N 3.03Å; G217-V219 PolarHBondContact O-N 2.96Å
218	N	53.3	Low	56.5	Low	168 Å²	168	145 Å²	145	90%	0.898	70%	0.697	S	S	*	*			trans	-75	20.2	174.9	-83.5	-2.8	0	0	0	114.2	F216 V220	F216-N218 PolarHBondContact O-N 3.03Å; N218-V220 PolarHBondContact O-N 2.96Å
219	V	60.9	Low	55.7	Low	126 Å²	126	142.2 Å²	142.2	76%	0.764	69%	0.692	S	S	*	*			trans	-89.3	110.8	-178.9	-173.9	0	0	0	0	109	G217 K221	G217-V219 PolarHBondContact O-N 2.96Å; V219-K221 PolarHBondContact O-N 2.91Å; V219-K221 VanDerWaalsContact O-N 3.13Å
220	V	55.2	Low	55.4	Low	133 Å²	133	143.1 Å²	143.1	81%	0.806	69%	0.693	S	S	*	*			trans	-60.5	114.7	169	-173.7	0	0	0	0	107.5	N218 C222	N218-V220 PolarHBondContact O-N 2.96Å; V220-C222 PolarHBondContact O-N 3.15Å; V220-C222 VanDerWaalsContact O-N 3.15Å
221	K	53.7	Low	54.8	Low	167 Å²	167	145.1 Å²	145.1	73%	0.726	71%	0.714	S	S	*	*			trans	-67.9	111.9	175.3	-83	-176.8	173.8	177	0	109.4	V219	V219-K221 PolarHBondContact O-N 2.91Å; V219-K221 VanDerWaalsContact O-N 3.13Å
222	C	43.6	Very low	54.3	Low	106 Å²	106	142.4 Å²	142.4	72%	0.716	72%	0.721	S	S	*	*			trans	-96.2	89.5	171.6	-148	0	0	0	0	108.5	V220 M224	V220-C222 PolarHBondContact O-N 3.15Å; V220-C222 VanDerWaalsContact O-N 3.15Å; C222-M224 PolarHBondContact O-N 3.16Å
223	D	55.5	Low	54	Low	127 Å²	127	140.6 Å²	140.6	68%	0.679	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-74.6	15.8	-174.7	-82.5	-22	0	0	0	114.2
224	M	42	Very low	53	Low	150 Å²	150	143.7 Å²	143.7	74%	0.739	74%	0.737	S	S	*	*	G	3₁₀ helix	trans	-86.2	-17.9	-171.8	-66.7	-65.2	-105.8	0	0	115.1	C222 R226	C222-M224 PolarHBondContact O-N 3.16Å; M224-R226 VanDerWaalsContact C-N 3.27Å; M224-R226 PolarHBondContact O-N 3.28Å
225	D	53.3	Low	51.8	Low	133 Å²	133	147.5 Å²	147.5	71%	0.711	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-75	-10.5	-176.6	-82.2	-30.7	0	0	0	114.7	Y227	D225-Y227 PolarHBondContact O-N 3.27Å; D225-Y227 VanDerWaalsContact O-N 3.16Å
226	R	51.5	Low	51.1	Low	237 Å²	237	153.6 Å²	153.6	89%	0.894	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-64.3	-17.8	176.3	-92.4	-172.3	-173.4	-169.3	1.9	114.2	M224	M224-R226 VanDerWaalsContact C-N 3.27Å; M224-R226 PolarHBondContact O-N 3.28Å
227	Y	54.5	Low	50	Low	206 Å²	206	154.2 Å²	154.2	81%	0.808	79%	0.791	S	S	*	*	G	3₁₀ helix	trans	-99.2	0.5	-174.2	-69.2	-78.6	0	0	0	114.9	D225 K229	D225-Y227 PolarHBondContact O-N 3.27Å; D225-Y227 VanDerWaalsContact O-N 3.16Å; Y227-K229 PolarHBondContact O-N 3.34Å
228	R	53.5	Low	48.6	Very low	210 Å²	210	160.5 Å²	160.5	79%	0.792	81%	0.805	S	S	*	*			trans	-85.9	102.3	-178.7	-157.7	173.1	-167.7	167.2	2.4	111.6
229	K	47.6	Very low	47.6	Very low	201 Å²	201	159.5 Å²	159.5	87%	0.874	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-65	130.6	172.3	-74.1	-179.2	177.5	178.1	0	110.7	Y227	Y227-K229 PolarHBondContact O-N 3.34Å
230	K	53.2	Low	46.3	Very low	202 Å²	202	161.9 Å²	161.9	88%	0.878	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-89.1	135.5	176.4	-67.1	-176.7	177.7	-177.6	0	110.9
231	P	45.8	Very low	45.2	Very low	127 Å²	127	161 Å²	161	83%	0.825	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-76.5	149.9	175.8	29.8	-32.1	0	0	0	112.6
232	A	48.6	Very low	44.2	Very low	106 Å²	106	157.4 Å²	157.4	88%	0.876	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-75.8	130.7	-175.1	0	0	0	0	0	112.1
233	D	51.9	Low	43.7	Very low	153 Å²	153	159.3 Å²	159.3	82%	0.818	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-92	120.9	179.3	-169.3	7	0	0	0	110.1
234	E	41.5	Very low	42.7	Very low	180 Å²	180	160.2 Å²	160.2	84%	0.841	79%	0.794	S	S	*	*			trans	-113	68	-172.8	-167.8	173.3	-143.9	0	0	108
235	N	38.2	Very low	42.4	Very low	145 Å²	145	158 Å²	158	78%	0.775	80%	0.799	S	S	*	*			trans	-169.5	77.2	168.1	-93.9	-33.1	0	0	0	111.4
236	Q	44	Very low	41.5	Very low	181 Å²	181	157.9 Å²	157.9	85%	0.846	80%	0.803	S	S	*	*			trans	-130.1	114.8	157	-89.4	-173.8	-16.4	0	0	109.2	K238	Q236-K238 PolarHBondContact O-N 3.46Å
237	P	38.1	Very low	40.9	Very low	133 Å²	133	151.4 Å²	151.4	86%	0.864	80%	0.8	S	S	*	*			trans	-66	132.2	172.5	-6.5	20.5	0	0	0	109.4
238	K	34.1	Very low	39.9	Very low	180 Å²	180	145.9 Å²	145.9	78%	0.783	80%	0.797	S	S	*	*			trans	-80.9	154.3	172.5	-65.3	174.6	176	174.6	0	109.4	Q236	Q236-K238 PolarHBondContact O-N 3.46Å
239	D	32.2	Very low	39	Very low	147 Å²	147	141.9 Å²	141.9	79%	0.786	80%	0.796	S	S	*	*			trans	108	126.2	152.3	-54.3	-31.7	0	0	0	119
240	M	33.4	Very low	38.4	Very low	175 Å²	175	143.9 Å²	143.9	86%	0.862	80%	0.798	S	S	*	*			trans	94.1	132	149.6	-68.6	172.4	67	0	0	120
241	V	33	Very low	37.8	Very low	116 Å²	116	143.5 Å²	143.5	70%	0.703	82%	0.821	S	S	*	*			cis	-173.5	141.5	-16.6	128.2	0	0	0	0	104.2
242	S	33.7	Very low	37.4	Very low	90 Å²	90	144.4 Å²	144.4	63%	0.629	82%	0.821	S	S	*	*			trans	37.3	137.7	154.6	72.8	0	0	0	0	121.2
243	H	33.1	Very low	36.8	Very low	147 Å²	147	146.4 Å²	146.4	68%	0.681	82%	0.818	S	S	*	*				-171.9	148.2	62	-120.2	-96	0	0	0	109.2
244	E	33.8	Very low	35.9	Very low	146 Å²	146	146 Å²	146	68%	0.682	82%	0.818	S	S	*	*			trans	66.9	104.4	151.9	-72.4	158	-160.2	0	0	118.5
245	A	35.7	Very low	35.6	Very low	104 Å²	104	144 Å²	144	86%	0.86	82%	0.816	S	S	*	*				47	64.2	63.8	0	0	0	0	0	113
246	V	35.1	Very low	35.4	Very low	129 Å²	129	143.9 Å²	143.9	78%	0.782	82%	0.819	S	S	*	*			trans	-126.6	128.5	160.4	-175.7	0	0	0	0	108.9
247	A	38	Very low	34.9	Very low	102 Å²	102	141.5 Å²	141.5	84%	0.843	82%	0.817	S	S	*	*			trans	79.9	56.9	167.1	0	0	0	0	0	117.9
248	A	34.2	Very low	34.6	Very low	90 Å²	90	142.1 Å²	142.1	74%	0.744	81%	0.814	S	S	*	*			trans	-116.2	110.6	147.6	0	0	0	0	0	110.1
249	V	33.7	Very low	34.7	Very low	126 Å²	126	139.2 Å²	139.2	76%	0.764	82%	0.816	S	S	*	*	S	Bend	trans	70.9	93.4	144.8	-174.7	0	0	0	0	117
250	R	36	Very low	34.9	Very low	242 Å²	242	138.5 Å²	138.5	91%	0.913	82%	0.819	S	S	*	*				164.8	96.9	123.7	-89.6	155.2	-173.7	-167.3	3.2	112.1
251	S	39.2	Very low	35	Very low	195 Å²	195	135.2 Å²	135.2	100%	1.364	82%	0.815	S	S	*	*			trans	-121	0	134	62.6	0	0	0	0	106.7

Retrieved 251 of 251 residues in 188.2 ms (Link to these results)

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