A0A087XWH0_POEFO Loading...

Serine/threonine-protein kinase

Proto-oncogene with serine/threonine kinase activity involved in cell survival and cell proliferation.

AlphaFold DB , UniProt , Accession A0A087XWH0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 333 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	37.9	Very low	33.2	Very low	243 Å²	243	154.3 Å²	154.3	100%	1.197	83%	0.83	S	S	*	*				0	117.7	0	-77.8	177.6	179.6	0	0	108.1
2	L	34.2	Very low	33.1	Very low	171 Å²	171	155.9 Å²	155.9	90%	0.895	84%	0.835	S	S	*	*			trans	42.2	104.4	161	-74.8	149.3	0	0	0	121.1
3	L	30.4	Very low	33.1	Very low	155 Å²	155	153 Å²	153	81%	0.812	83%	0.832	S	S	*	*			trans	-19.5	143.4	143.2	-62.6	153.5	0	0	0	115.1
4	S	31.5	Very low	33.3	Very low	108 Å²	108	150.8 Å²	150.8	76%	0.755	83%	0.826	S	S	*	*				173.7	126.1	70.5	45.5	0	0	0	0	108.9
5	K	34.8	Very low	33.8	Very low	179 Å²	179	149.2 Å²	149.2	78%	0.778	83%	0.826	S	S	*	*				89.7	112.7	96.1	-77.5	-158.9	171.1	177.7	0	116.7
6	F	33.8	Very low	33.9	Very low	204 Å²	204	147.3 Å²	147.3	90%	0.895	83%	0.827	S	S	*	*			trans	54.4	133.6	133.1	-72.2	-81.8	0	0	0	122.6
7	G	30.3	Very low	34.1	Very low	81 Å²	81	144.7 Å²	144.7	84%	0.835	82%	0.82	S	S	*	*			trans	160.3	119.1	147.4	0	0	0	0	0	113.7
8	S	33	Very low	34.4	Very low	94 Å²	94	146.3 Å²	146.3	66%	0.657	82%	0.822	S	S	*	*			trans	-104.1	166.9	-173.7	-172.8	0	0	0	0	112.3
9	F	30.6	Very low	34.6	Very low	183 Å²	183	146.2 Å²	146.2	80%	0.803	82%	0.819	S	S	*	*			trans	91.5	120.4	152.9	-71.7	-71	0	0	0	121.7
10	S	32.4	Very low	35.4	Very low	89 Å²	89	147.9 Å²	147.9	62%	0.622	82%	0.82	S	S	*	*			trans	70	119.1	130	62.2	0	0	0	0	121.9
11	H	36	Very low	35.7	Very low	190 Å²	190	148.1 Å²	148.1	88%	0.88	82%	0.819	S	S	*	*			trans	45.8	107.5	138.8	-61.3	-71.2	0	0	0	119.1
12	I	32.7	Very low	36	Very low	174 Å²	174	141.7 Å²	141.7	89%	0.892	80%	0.796	S	S	*	*			trans	-106.7	119.1	168.3	-62.3	172.9	0	0	0	108.4
13	C	32.9	Very low	36.3	Very low	118 Å²	118	139.7 Å²	139.7	80%	0.797	79%	0.79	S	S	*	*			trans	-129.9	109.2	163.2	-141.1	0	0	0	0	108.5
14	T	35.5	Very low	37.1	Very low	122 Å²	122	140.8 Å²	140.8	75%	0.748	79%	0.788	S	S	*	*			trans	36.3	135.2	154.4	55	0	0	0	0	123.1
15	P	40.5	Very low	37.8	Very low	127 Å²	127	142.2 Å²	142.2	83%	0.825	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-89.1	154.1	169.8	36	-30.4	0	0	0	113.8
16	S	35.4	Very low	38.2	Very low	119 Å²	119	142 Å²	142	83%	0.832	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-64.9	133.4	-177.4	55.4	0	0	0	0	115.8
17	S	37.2	Very low	38.7	Very low	103 Å²	103	139.2 Å²	139.2	72%	0.72	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-101.6	122.1	162.6	44.7	0	0	0	0	110.2
18	M	40.3	Very low	39.4	Very low	173 Å²	173	140.3 Å²	140.3	85%	0.852	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-76.7	116.1	169.6	-81.3	180	154.5	0	0	109.5
19	D	38.7	Very low	40.2	Very low	144 Å²	144	140.8 Å²	140.8	77%	0.77	78%	0.775	S	S	*	*			trans	-86.5	114.9	171.5	-77.4	-33.3	0	0	0	110.7	L21	D19-L21 PolarHBondContact O-N 3.36Å
20	H	48.8	Very low	40.9	Very low	180 Å²	180	138.2 Å²	138.2	83%	0.833	77%	0.774	S	S	*	*			trans	-82.2	102.5	162.8	-76.2	-76.1	0	0	0	109.2
21	L	41.8	Very low	41.8	Very low	154 Å²	154	142.8 Å²	142.8	81%	0.806	78%	0.783	S	S	*	*			trans	-74.5	125.8	170.2	-84.9	152.7	0	0	0	110.3	D19 V23	D19-L21 PolarHBondContact O-N 3.36Å; L21-V23 PolarHBondContact O-N 2.73Å
22	P	44.4	Very low	42.8	Very low	108 Å²	108	140 Å²	140	70%	0.701	78%	0.779	S	S	*	*			trans	-74.9	115.7	168.1	29	-29.1	0	0	0	108.8	K24	P22-K24 PolarHBondContact O-N 2.94Å
23	V	41.4	Very low	44.7	Very low	128 Å²	128	140.3 Å²	140.3	78%	0.776	78%	0.776	S	S	*	*			trans	-65.8	99.4	169.9	179.6	0	0	0	0	108	L21 I25	L21-V23 PolarHBondContact O-N 2.73Å; V23-I25 HydrophobicContact CG1-CG1 3.96Å; V23-I25 PolarHBondContact O-N 2.86Å; V23-I25 VanDerWaalsContact O-N 3.11Å
24	K	46.4	Very low	47.2	Very low	179 Å²	179	139.3 Å²	139.3	78%	0.778	76%	0.758	S	S	*	*			trans	-73	96.8	164.8	-79.6	-178.1	177	177.8	0	107.8	P22 Q26	P22-K24 PolarHBondContact O-N 2.94Å; K24-Q26 VanDerWaalsContact C-N 3.29Å; K24-Q26 PolarHBondContact O-N 3.16Å
25	I	45.7	Very low	49.9	Very low	137 Å²	137	139.5 Å²	139.5	70%	0.703	75%	0.751	S	S	*	*			trans	-68.8	94	165.1	-56.5	176.7	0	0	0	106.6	V23 L27	V23-I25 HydrophobicContact CG1-CG1 3.96Å; V23-I25 PolarHBondContact O-N 2.86Å; V23-I25 VanDerWaalsContact O-N 3.11Å; I25-L27 HydrophobicContact CG2-CG 4.29Å; I25-L27 PolarHBondContact O-N 2.98Å
26	Q	45.1	Very low	52.5	Low	174 Å²	174	136.5 Å²	136.5	81%	0.813	73%	0.731	S	S	*	*			trans	-76.2	96.1	163.3	-80.4	174.9	-4.6	0	0	107	K24	K24-Q26 VanDerWaalsContact C-N 3.29Å; K24-Q26 PolarHBondContact O-N 3.16Å
27	L	44.2	Very low	55.5	Low	147 Å²	147	131.6 Å²	131.6	77%	0.77	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-60.1	126.8	163	-73.3	164.7	0	0	0	107.1	I25	I25-L27 HydrophobicContact CG2-CG 4.29Å; I25-L27 PolarHBondContact O-N 2.98Å
28	P	44.4	Very low	58.3	Low	104 Å²	104	132.4 Å²	132.4	68%	0.675	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-57.8	141.7	173.1	23.2	-30.6	0	0	0	108.4	V30	P28-V30 PolarHBondContact O-N 3.19Å
29	P	50.8	Low	61	Low	104 Å²	104	131.1 Å²	131.1	68%	0.675	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-56.8	117.3	176	22.8	-30.9	0	0	0	107.9	K31	P29-K31 VanDerWaalsContact C-N 3.34Å; P29-K31 PolarHBondContact O-N 2.82Å
30	V	43.4	Very low	63.9	Low	129 Å²	129	125.5 Å²	125.5	78%	0.782	65%	0.648	S	S	*	*			trans	-61.3	102.8	171.2	178.4	0	0	0	0	105.7	P28 V32	P28-V30 PolarHBondContact O-N 3.19Å; V30-V32 VanDerWaalsContact C-N 3.28Å; V30-V32 HydrophobicContact CG1-CG2 4.45Å; V30-V32 PolarHBondContact O-N 3.34Å
31	K	52.2	Low	66.2	Low	185 Å²	185	117.5 Å²	117.5	80%	0.804	61%	0.611	S	S	*	*			trans	-64.2	99	165.5	-78.6	-175.4	177.4	-177.8	0	105.4	P29 E33	P29-K31 VanDerWaalsContact C-N 3.34Å; P29-K31 PolarHBondContact O-N 2.82Å; K31-E33 VanDerWaalsContact C-N 3.31Å; K31-E33 PolarHBondContact O-N 2.87Å
32	V	57.9	Low	68.9	Low	132 Å²	132	116.2 Å²	116.2	80%	0.8	60%	0.6	S	S	*	*			trans	-64.9	102.5	165	-179	0	0	0	0	105	V30 K34	V30-V32 VanDerWaalsContact C-N 3.28Å; V30-V32 HydrophobicContact CG1-CG2 4.45Å; V30-V32 PolarHBondContact O-N 3.34Å; V32-K34 PolarHBondContact O-N 2.83Å
33	E	71.3	Confident	71.5	Confident	180 Å²	180	114.5 Å²	114.5	84%	0.841	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-62.1	121.7	173.6	-75.6	-171.2	167.3	0	0	107.9	K31	K31-E33 VanDerWaalsContact C-N 3.31Å; K31-E33 PolarHBondContact O-N 2.87Å
34	K	86.3	Confident	74.1	Confident	96 Å²	96	110.4 Å²	110.4	42%	0.417	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-66.7	136.1	177.6	-170.7	-176.6	178.4	-154.1	0	109	V32 D113 Y114 Y115	V32-K34 PolarHBondContact O-N 2.83Å; K34-D113 VanDerWaalsContact CE-CG 3.41Å; K34-D113 WeakPolarHBondContact CE-OD1 3.26Å; K34-D113 WeakPolarHBondContact CE-OD2 3.37Å; K34-D113 IonicContact NZ-OD1 2.67Å; K34-D113 PolarHBondContact NZ-OD1 3.2Å; K34-D113 IonicContact NZ-OD2 3.31Å; K34-D113 PolarHBondContact NZ-OD2 2.96Å; K34-Y114 PolarHBondContact NZ-O 3.11Å; K34-Y115 HydrophobicContact CD-CD1 4.34Å; K34-Y115 HydrophobicContact CD-CE1 3.94Å; K34-Y115 HydrophobicContact CG-CE1 4.37Å
35	E	92.6	Very high	76.5	Confident	126 Å²	126	105.8 Å²	105.8	59%	0.589	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-57.2	137.4	176.7	-68.9	-168.6	150.6	0	0	111	V40 Y115	E35-V40 HydrophobicContact CB-CG2 3.69Å; E35-Y115 WeakPolarHBondContact O-CE1 3.35Å
36	P	95.2	Very high	79	Confident	65 Å²	65	103.2 Å²	103.2	42%	0.422	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-53.7	142.8	177.3	-26.1	33.1	0	0	0	112.5	E38 K39	P36-E38 VanDerWaalsContact C-N 3.26Å; P36-E38 PolarHBondContact O-N 2.86Å; P36-K39 HydrophobicContact CB-CG 4.4Å; P36-K39 HydrophobicContact CG-CD 4.38Å; P36-K39 WeakPolarHBondContact O-CB 3.38Å; P36-K39 PolarHBondContact O-N 2.85Å
37	F	96.9	Very high	81.3	Confident	16 Å²	16	99.4 Å²	99.4	7%	0.07	54%	0.537	C	S	.	.	H	α-helix	trans	-50.8	-45.1	-176.9	170.2	-97.4	0	0	0	112.5	K39 V40 Y41 V43 V69 Y115 L122 V124	F37-K39 PolarHBondContact O-N 2.94Å; F37-K39 VanDerWaalsContact O-N 3.16Å; F37-V40 PolarHBondContact O-N 3.2Å; F37-Y41 AromaticContact CD2-CD2 3.72Å; F37-Y41 HydrophobicContact CD2-CD2 3.72Å; F37-Y41 HydrophobicContact CD2-CG 4.35Å; F37-Y41 AromaticContact CE2-CD2 3.77Å; F37-Y41 HydrophobicContact CE2-CD2 3.77Å; F37-Y41 AromaticContact CE2-CG 3.97Å; F37-Y41 HydrophobicContact CE2-CG 3.97Å; F37-Y41 PolarHBondContact O-N 3.3Å; F37-V43 HydrophobicContact CE1-CG2 3.56Å; F37-V43 HydrophobicContact CZ-CG2 3.58Å; F37-V69 HydrophobicContact CE2-CG1 4.08Å; F37-V69 HydrophobicContact CE2-CG2 4.31Å; F37-V69 HydrophobicContact CZ-CG1 3.95Å; F37-V69 HydrophobicContact CZ-CG2 4.19Å; F37-Y115 HydrophobicContact CB-CD1 3.87Å; F37-Y115 HydrophobicContact CB-CD2 4.21Å; F37-Y115 HydrophobicContact CB-CE1 3.89Å; F37-Y115 HydrophobicContact CB-CE2 4.26Å; F37-Y115 HydrophobicContact CB-CG 4.01Å; F37-Y115 AromaticContact CD2-CD2 3.71Å; F37-Y115 HydrophobicContact CD2-CD2 3.71Å; F37-Y115 AromaticContact CD2-CE2 3.68Å; F37-Y115 HydrophobicContact CD2-CE2 3.68Å; F37-Y115 HydrophobicContact CD2-CG 4.31Å; F37-Y115 HydrophobicContact CG-CD2 4.4Å; F37-Y115 HydrophobicContact CG-CE2 4.46Å; F37-L122 HydrophobicContact CB-CD1 4.41Å; F37-L122 HydrophobicContact CD1-CD1 3.72Å; F37-L122 HydrophobicContact CD2-CD1 3.72Å; F37-L122 HydrophobicContact CE1-CD1 3.84Å; F37-L122 HydrophobicContact CE2-CD1 3.84Å; F37-L122 HydrophobicContact CG-CD1 3.66Å; F37-L122 HydrophobicContact CZ-CD1 3.9Å; F37-V124 HydrophobicContact CD2-CG2 4.43Å; F37-V124 HydrophobicContact CE2-CG2 4Å
38	E	96.8	Very high	83.6	Confident	120 Å²	120	94 Å²	94	56%	0.561	52%	0.516	S	S	*	.	H	α-helix	trans	-67.7	-15.1	-176.4	-58.2	77.4	-169.8	0	0	113.4	P36	P36-E38 VanDerWaalsContact C-N 3.26Å; P36-E38 PolarHBondContact O-N 2.86Å
39	K	97.4	Very high	85.8	Confident	146 Å²	146	93.7 Å²	93.7	64%	0.635	52%	0.517	S	S	*	.	H	α-helix	trans	-88.6	-19.7	172.9	-64.3	-167.4	-176.5	178.3	0	113	P36 F37	P36-K39 HydrophobicContact CB-CG 4.4Å; P36-K39 HydrophobicContact CG-CD 4.38Å; P36-K39 WeakPolarHBondContact O-CB 3.38Å; P36-K39 PolarHBondContact O-N 2.85Å; F37-K39 PolarHBondContact O-N 2.94Å; F37-K39 VanDerWaalsContact O-N 3.16Å
40	V	98.3	Very high	87.4	Confident	25 Å²	25	90.8 Å²	90.8	15%	0.152	51%	0.506	C	S	.	.	H	α-helix	trans	-105	-34.9	-174.6	-172.3	0	0	0	0	111.6	E35 F37 I61	E35-V40 HydrophobicContact CB-CG2 3.69Å; F37-V40 PolarHBondContact O-N 3.2Å; V40-I61 PolarHBondContact O-N 3.48Å
41	Y	98.6	Very high	89.1	Confident	13 Å²	13	87.6 Å²	87.6	5%	0.051	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	143.9	-174.4	-58	-78.2	0	0	0	112.1	F37 S59 R60 V67 D113 Y115 V124	F37-Y41 AromaticContact CD2-CD2 3.72Å; F37-Y41 HydrophobicContact CD2-CD2 3.72Å; F37-Y41 HydrophobicContact CD2-CG 4.35Å; F37-Y41 AromaticContact CE2-CD2 3.77Å; F37-Y41 HydrophobicContact CE2-CD2 3.77Å; F37-Y41 AromaticContact CE2-CG 3.97Å; F37-Y41 HydrophobicContact CE2-CG 3.97Å; F37-Y41 PolarHBondContact O-N 3.3Å; Y41-S59 WeakPolarHBondContact CA-O 3.05Å; Y41-R60 HydrophobicContact CD1-CB 3.98Å; Y41-R60 HydrophobicContact CD1-CG 4.32Å; Y41-R60 HydrophobicContact CE1-CB 3.88Å; Y41-R60 HydrophobicContact CE1-CG 3.99Å; Y41-V67 HydrophobicContact CD1-CG1 4.35Å; Y41-V67 HydrophobicContact CD1-CG2 3.97Å; Y41-V67 HydrophobicContact CE1-CG1 4.13Å; Y41-V67 HydrophobicContact CE1-CG2 4.5Å; Y41-D113 HydrophobicContact CE2-CB 4.37Å; Y41-Y115 HydrophobicContact CD2-CE2 4.11Å; Y41-Y115 AromaticContact CE2-CE2 3.82Å; Y41-Y115 HydrophobicContact CE2-CE2 3.82Å; Y41-V124 HydrophobicContact CD1-CG1 4.06Å; Y41-V124 HydrophobicContact CD2-CG2 4.35Å; Y41-V124 HydrophobicContact CE1-CG1 3.66Å; Y41-V124 HydrophobicContact CE2-CG1 4.26Å; Y41-V124 HydrophobicContact CE2-CG2 4.2Å
42	Q	98.3	Very high	90.5	Very high	127 Å²	127	81.9 Å²	81.9	59%	0.593	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.9	128.9	168.9	-175.9	176	34.6	0	0	109.2	G58 S59 I61	Q42-G58 CarbonylContact O-C 3.5Å; Q42-G58 WeakPolarHBondContact O-CA 3.39Å; Q42-S59 PolarHBondContact N-O 2.79Å; Q42-S59 PolarHBondContact O-N 2.8Å; Q42-I61 HydrophobicContact CB-CG1 4.36Å
43	V	97.9	Very high	92.1	Very high	71 Å²	71	75.9 Å²	75.9	43%	0.43	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	138.4	177.2	-179.1	0	0	0	0	109.9	F37 Y56	F37-V43 HydrophobicContact CE1-CG2 3.56Å; F37-V43 HydrophobicContact CZ-CG2 3.58Å; V43-Y56 HydrophobicContact CG1-CD1 3.98Å; V43-Y56 HydrophobicContact CG1-CG 3.92Å
44	G	97.3	Very high	93.3	Very high	42 Å²	42	69 Å²	69	43%	0.433	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	-147.6	176.8	0	0	0	0	0	112.5	A57	G44-A57 WeakPolarHBondContact CA-O 3.21Å; G44-A57 PolarHBondContact N-O 2.96Å
45	S	97	Very high	93.9	Very high	83 Å²	83	66.1 Å²	66.1	58%	0.58	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.3	158.5	-178.3	56.8	0	0	0	0	112.9	Y56 A57	S45-Y56 CarbonylContact O-C 3.51Å; S45-Y56 WeakPolarHBondContact O-CA 3.34Å; S45-A57 PolarHBondContact O-N 2.97Å
46	V	97.4	Very high	94.1	Very high	82 Å²	82	63.3 Å²	63.3	50%	0.497	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	133.8	168.8	177.8	0	0	0	0	109.2	T54 Y56	V46-T54 HydrophobicContact CG1-CG2 3.96Å; V46-T54 HydrophobicContact CG2-CG2 4.23Å; V46-Y56 HydrophobicContact CG2-CD1 3.78Å; V46-Y56 HydrophobicContact CG2-CE1 3.53Å
47	L	94.2	Very high	94.3	Very high	95 Å²	95	60.8 Å²	60.8	50%	0.497	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-37.3	171.1	-66.9	173.2	0	0	0	111.2	V55 A57	L47-V55 HydrophobicContact CB-CG1 4.43Å; L47-V55 HydrophobicContact CD1-CG1 4.29Å; L47-V55 PolarHBondContact N-O 2.8Å; L47-A57 HydrophobicContact CD1-CB 4.09Å; L47-A57 HydrophobicContact CD2-CB 4.04Å; L47-A57 HydrophobicContact CG-CB 3.99Å
48	G	92.2	Very high	94.3	Very high	33 Å²	33	60.3 Å²	60.3	34%	0.34	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.8	162.1	178.7	0	0	0	0	0	112.1	V55	G48-V55 PolarHBondContact N-O 2.84Å; G48-V55 PolarHBondContact O-N 2.64Å
49	S	90.2	Very high	94.4	Very high	97 Å²	97	56.1 Å²	56.1	68%	0.678	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.1	139.3	177	62.8	0	0	0	0	111	G53	S49-G53 WeakPolarHBondContact CA-O 3.35Å
50	G	84.6	Confident	94.4	Very high	44 Å²	44	52.6 Å²	52.6	45%	0.454	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165	-157.6	-180	0	0	0	0	0	113.3	F52 G53 R76	G50-F52 PolarHBondContact O-N 2.99Å; G50-G53 PolarHBondContact N-O 2.93Å; G50-G53 PolarHBondContact O-N 2.88Å; G50-R76 PolarHBondContact O-NH1 3.49Å
51	G	79.8	Confident	94.4	Very high	62 Å²	62	55.9 Å²	55.9	64%	0.639	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-38.1	178.7	0	0	0	0	0	112.7	G53	G51-G53 VanDerWaalsContact C-N 3.27Å; G51-G53 PolarHBondContact O-N 3.42Å
52	F	80.8	Confident	94.4	Very high	64 Å²	64	60 Å²	60	28%	0.281	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	4.3	-177.3	-50.7	-69.6	0	0	0	114.7	G50 K70 D191 S194	G50-F52 PolarHBondContact O-N 2.99Å; F52-K70 WeakPolarHBondContact O-CE 3.35Å; F52-D191 WeakPolarHBondContact CD2-OD2 3.48Å; F52-S194 WeakPolarHBondContact CE1-OG 3.17Å; F52-S194 WeakPolarHBondContact CZ-OG 3.46Å
53	G	91.9	Very high	94.3	Very high	7 Å²	7	58.2 Å²	58.2	7%	0.072	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	114.9	-160.6	178.6	0	0	0	0	0	113.3	S49 G50 G51 H71	S49-G53 WeakPolarHBondContact CA-O 3.35Å; G50-G53 PolarHBondContact N-O 2.93Å; G50-G53 PolarHBondContact O-N 2.88Å; G51-G53 VanDerWaalsContact C-N 3.27Å; G51-G53 PolarHBondContact O-N 3.42Å; G53-H71 WeakPolarHBondContact CA-O 3.42Å
54	T	96.6	Very high	94.3	Very high	35 Å²	35	57.2 Å²	57.2	22%	0.215	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	128.3	-178.8	-54	0	0	0	0	109.8	V46 Y56 K70 H71	V46-T54 HydrophobicContact CG1-CG2 3.96Å; V46-T54 HydrophobicContact CG2-CG2 4.23Å; T54-Y56 HydrophobicContact CG2-CD2 4.25Å; T54-Y56 HydrophobicContact CG2-CE1 4.13Å; T54-Y56 HydrophobicContact CG2-CE2 3.58Å; T54-Y56 VanDerWaalsContact CG2-CZ 3.5Å; T54-K70 CarbonylContact O-C 3.57Å; T54-K70 WeakPolarHBondContact O-CA 3.4Å; T54-H71 PolarHBondContact N-O 3.09Å; T54-H71 VanDerWaalsContact N-O 3.09Å; T54-H71 PolarHBondContact O-N 3.22Å
55	V	97.6	Very high	94.3	Very high	36 Å²	36	56.5 Å²	56.5	22%	0.218	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	128.4	178	-171.9	0	0	0	0	109	L47 G48 A68 V69 K70	L47-V55 HydrophobicContact CB-CG1 4.43Å; L47-V55 HydrophobicContact CD1-CG1 4.29Å; L47-V55 PolarHBondContact N-O 2.8Å; G48-V55 PolarHBondContact N-O 2.84Å; G48-V55 PolarHBondContact O-N 2.64Å; V55-A68 HydrophobicContact CG1-CB 4.1Å; V55-V69 WeakPolarHBondContact CA-O 3.43Å; V55-K70 HydrophobicContact CG2-CB 4.09Å; V55-K70 HydrophobicContact CG2-CD 4.3Å; V55-K70 HydrophobicContact CG2-CG 4.01Å
56	Y	98	Very high	94.3	Very high	66 Å²	66	54.1 Å²	54.1	26%	0.259	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	146.1	177	-57	-97.3	0	0	0	109.9	V43 S45 V46 T54 A68 V69 H71	V43-Y56 HydrophobicContact CG1-CD1 3.98Å; V43-Y56 HydrophobicContact CG1-CG 3.92Å; S45-Y56 CarbonylContact O-C 3.51Å; S45-Y56 WeakPolarHBondContact O-CA 3.34Å; V46-Y56 HydrophobicContact CG2-CD1 3.78Å; V46-Y56 HydrophobicContact CG2-CE1 3.53Å; T54-Y56 HydrophobicContact CG2-CD2 4.25Å; T54-Y56 HydrophobicContact CG2-CE1 4.13Å; T54-Y56 HydrophobicContact CG2-CE2 3.58Å; T54-Y56 VanDerWaalsContact CG2-CZ 3.5Å; Y56-A68 CarbonylContact O-C 3.56Å; Y56-A68 WeakPolarHBondContact O-CA 3.38Å; Y56-V69 WeakPolarHBondContact CD2-O 3.35Å; Y56-V69 PolarHBondContact N-O 2.83Å; Y56-V69 PolarHBondContact O-N 3.33Å; Y56-H71 HydrophobicContact CE2-CB 4.16Å
57	A	97.8	Very high	94.4	Very high	13 Å²	13	50.2 Å²	50.2	11%	0.107	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	152.6	159.4	0	0	0	0	0	108.5	G44 S45 L47	G44-A57 WeakPolarHBondContact CA-O 3.21Å; G44-A57 PolarHBondContact N-O 2.96Å; S45-A57 PolarHBondContact O-N 2.97Å; L47-A57 HydrophobicContact CD1-CB 4.09Å; L47-A57 HydrophobicContact CD2-CB 4.04Å; L47-A57 HydrophobicContact CG-CB 3.99Å
58	G	97.9	Very high	94.6	Very high	6 Å²	6	46.2 Å²	46.2	6%	0.062	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	177.4	169.3	0	0	0	0	0	111.6	Q42 V67 R127	Q42-G58 CarbonylContact O-C 3.5Å; Q42-G58 WeakPolarHBondContact O-CA 3.39Å; G58-V67 PolarHBondContact N-O 2.8Å; G58-V67 PolarHBondContact O-N 3.31Å; G58-R127 PolarHBondContact O-NH2 2.86Å
59	S	98.3	Very high	94.9	Very high	32 Å²	32	44.7 Å²	44.7	22%	0.224	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	142.6	171.9	55.5	0	0	0	0	110.1	Y41 Q42 A65	Y41-S59 WeakPolarHBondContact CA-O 3.05Å; Q42-S59 PolarHBondContact N-O 2.79Å; Q42-S59 PolarHBondContact O-N 2.8Å; S59-A65 CarbonylContact C-O 3.47Å; S59-A65 WeakPolarHBondContact CA-O 3.32Å
60	R	98.4	Very high	95.3	Very high	72 Å²	72	40.3 Å²	40.3	27%	0.272	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	127.4	167.9	-179.3	168.2	59	-161.5	1.4	108.9	Y41 S62 D63 G64 A65 V67	Y41-R60 HydrophobicContact CD1-CB 3.98Å; Y41-R60 HydrophobicContact CD1-CG 4.32Å; Y41-R60 HydrophobicContact CE1-CB 3.88Å; Y41-R60 HydrophobicContact CE1-CG 3.99Å; R60-S62 VanDerWaalsContact C-N 3.31Å; R60-S62 WeakPolarHBondContact CG-OG 3.5Å; R60-S62 PolarHBondContact O-N 2.81Å; R60-D63 WeakPolarHBondContact CB-OD1 3.43Å; R60-D63 IonicContact CZ-OD1 3.07Å; R60-D63 IonicContact CZ-OD2 2.73Å; R60-D63 IonicContact NE-OD1 2.85Å; R60-D63 PolarHBondContact NE-OD1 2.63Å; R60-D63 IonicContact NE-OD2 2.8Å; R60-D63 PolarHBondContact NE-OD2 2.63Å; R60-D63 IonicContact NH2-OD1 2.74Å; R60-D63 IonicContact NH2-OD2 3.18Å; R60-D63 PolarHBondContact NH2-OD2 2.83Å; R60-G64 WeakPolarHBondContact O-CA 3.4Å; R60-G64 PolarHBondContact O-N 3.43Å; R60-A65 HydrophobicContact CB-CB 4.46Å; R60-A65 PolarHBondContact N-O 2.83Å; R60-V67 HydrophobicContact CB-CG1 4.49Å
61	I	98.3	Very high	95.9	Very high	93 Å²	93	39.8 Å²	39.8	48%	0.477	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-34.7	-171.3	-68.7	170.4	0	0	0	111.8	V40 Q42 D63	V40-I61 PolarHBondContact O-N 3.48Å; Q42-I61 HydrophobicContact CB-CG1 4.36Å; I61-D63 VanDerWaalsContact C-N 3.34Å; I61-D63 PolarHBondContact O-N 3.36Å
62	S	97.6	Very high	96.7	Very high	99 Å²	99	37.4 Å²	37.4	69%	0.692	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-32.1	-173.9	57.8	0	0	0	0	114.5	R60	R60-S62 VanDerWaalsContact C-N 3.31Å; R60-S62 WeakPolarHBondContact CG-OG 3.5Å; R60-S62 PolarHBondContact O-N 2.81Å
63	D	97.4	Very high	97.4	Very high	91 Å²	91	35.2 Å²	35.2	49%	0.487	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-140.4	1.1	-171.7	63.5	-12.4	0	0	0	114.2	R60 I61 A65	R60-D63 WeakPolarHBondContact CB-OD1 3.43Å; R60-D63 IonicContact CZ-OD1 3.07Å; R60-D63 IonicContact CZ-OD2 2.73Å; R60-D63 IonicContact NE-OD1 2.85Å; R60-D63 PolarHBondContact NE-OD1 2.63Å; R60-D63 IonicContact NE-OD2 2.8Å; R60-D63 PolarHBondContact NE-OD2 2.63Å; R60-D63 IonicContact NH2-OD1 2.74Å; R60-D63 IonicContact NH2-OD2 3.18Å; R60-D63 PolarHBondContact NH2-OD2 2.83Å; I61-D63 VanDerWaalsContact C-N 3.34Å; I61-D63 PolarHBondContact O-N 3.36Å; D63-A65 PolarHBondContact O-N 2.84Å; D63-A65 WeakPolarHBondContact OD1-CB 3.35Å; D63-A65 PolarHBondContact OD1-N 2.81Å
64	G	97.2	Very high	97.5	Very high	50 Å²	50	39.3 Å²	39.3	52%	0.515	23%	0.231	S	C	.	.			trans	72.7	5.9	-178.1	0	0	0	0	0	114.3	R60	R60-G64 WeakPolarHBondContact O-CA 3.4Å; R60-G64 PolarHBondContact O-N 3.43Å
65	A	97.3	Very high	97.4	Very high	27 Å²	27	45.1 Å²	45.1	22%	0.223	26%	0.256	C	S	.	.			trans	-60.6	133.1	-174	0	0	0	0	0	111.5	S59 R60 D63 V67	S59-A65 CarbonylContact C-O 3.47Å; S59-A65 WeakPolarHBondContact CA-O 3.32Å; R60-A65 HydrophobicContact CB-CB 4.46Å; R60-A65 PolarHBondContact N-O 2.83Å; D63-A65 PolarHBondContact O-N 2.84Å; D63-A65 WeakPolarHBondContact OD1-CB 3.35Å; D63-A65 PolarHBondContact OD1-N 2.81Å; A65-V67 PolarHBondContact O-N 2.85Å
66	P	97.8	Very high	97.1	Very high	33 Å²	33	49.8 Å²	49.8	21%	0.214	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	133.4	178.9	27	-34.8	0	0	0	111.3	R127 E129	P66-R127 HydrophobicContact CB-CB 4.49Å; P66-R127 WeakPolarHBondContact CG-O 3.47Å; P66-R127 PolarHBondContact O-N 2.85Å; P66-E129 HydrophobicContact CB-CG 4.47Å; P66-E129 HydrophobicContact CG-CG 3.76Å
67	V	98.4	Very high	96.8	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	157.4	175.6	-59.2	0	0	0	0	111.1	Y41 G58 R60 A65 V69 L112 V124 M125 R127	Y41-V67 HydrophobicContact CD1-CG1 4.35Å; Y41-V67 HydrophobicContact CD1-CG2 3.97Å; Y41-V67 HydrophobicContact CE1-CG1 4.13Å; Y41-V67 HydrophobicContact CE1-CG2 4.5Å; G58-V67 PolarHBondContact N-O 2.8Å; G58-V67 PolarHBondContact O-N 3.31Å; R60-V67 HydrophobicContact CB-CG1 4.49Å; A65-V67 PolarHBondContact O-N 2.85Å; V67-V69 HydrophobicContact CG2-CG2 4.08Å; V67-L112 HydrophobicContact CG1-CD1 3.63Å; V67-V124 HydrophobicContact CB-CG1 4Å; V67-V124 HydrophobicContact CG1-CG1 4.24Å; V67-V124 HydrophobicContact CG2-CG1 4.19Å; V67-M125 CarbonylContact C-O 3.56Å; V67-M125 VanDerWaalsContact CA-O 3.32Å; V67-M125 WeakPolarHBondContact CA-O 3.16Å; V67-M125 WeakPolarHBondContact CB-O 3.5Å; V67-R127 VanDerWaalsContact C-CB 3.48Å; V67-R127 PolarHBondContact O-NE 3.39Å
68	A	98.3	Very high	96.3	Very high	11 Å²	11	52.1 Å²	52.1	9%	0.091	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	132	165.7	0	0	0	0	0	108.3	V55 Y56 V124 M125 R127	V55-A68 HydrophobicContact CG1-CB 4.1Å; Y56-A68 CarbonylContact O-C 3.56Å; Y56-A68 WeakPolarHBondContact O-CA 3.38Å; A68-V124 WeakPolarHBondContact O-CA 3.46Å; A68-M125 HydrophobicContact CB-CB 4.5Å; A68-M125 HydrophobicContact CB-CE 4.43Å; A68-M125 PolarHBondContact N-O 3.18Å; A68-M125 PolarHBondContact O-N 2.74Å; A68-R127 HydrophobicContact CB-CB 4.15Å
69	V	98.4	Very high	96.1	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	106.5	179.5	-175.4	0	0	0	0	108	F37 V55 Y56 V67 L122 I123	F37-V69 HydrophobicContact CE2-CG1 4.08Å; F37-V69 HydrophobicContact CE2-CG2 4.31Å; F37-V69 HydrophobicContact CZ-CG1 3.95Å; F37-V69 HydrophobicContact CZ-CG2 4.19Å; V55-V69 WeakPolarHBondContact CA-O 3.43Å; Y56-V69 WeakPolarHBondContact CD2-O 3.35Å; Y56-V69 PolarHBondContact N-O 2.83Å; Y56-V69 PolarHBondContact O-N 3.33Å; V67-V69 HydrophobicContact CG2-CG2 4.08Å; V69-L122 HydrophobicContact CG1-CB 4.23Å; V69-L122 HydrophobicContact CG1-CD2 4.06Å; V69-I123 WeakPolarHBondContact CA-O 3.39Å
70	K	98.3	Very high	96	Very high	5 Å²	5	58.3 Å²	58.3	2%	0.022	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	122.2	175.3	-178.7	173.8	178	178.9	0	109.3	F52 T54 V55 V72 E94 L122 I123 M125 D191	F52-K70 WeakPolarHBondContact O-CE 3.35Å; T54-K70 CarbonylContact O-C 3.57Å; T54-K70 WeakPolarHBondContact O-CA 3.4Å; V55-K70 HydrophobicContact CG2-CB 4.09Å; V55-K70 HydrophobicContact CG2-CD 4.3Å; V55-K70 HydrophobicContact CG2-CG 4.01Å; K70-V72 HydrophobicContact CD-CG2 4.43Å; K70-V72 HydrophobicContact CG-CG2 4.08Å; K70-E94 VanDerWaalsContact NZ-CD 3.31Å; K70-E94 IonicContact NZ-OE1 3.37Å; K70-E94 PolarHBondContact NZ-OE1 2.83Å; K70-E94 IonicContact NZ-OE2 2.64Å; K70-E94 PolarHBondContact NZ-OE2 2.65Å; K70-L122 CarbonylContact O-C 3.6Å; K70-L122 WeakPolarHBondContact O-CA 3.4Å; K70-I123 HydrophobicContact CB-CB 4.27Å; K70-I123 PolarHBondContact N-O 2.91Å; K70-I123 PolarHBondContact O-N 2.78Å; K70-M125 HydrophobicContact CB-CE 3.73Å; K70-M125 HydrophobicContact CD-CE 4.47Å; K70-D191 VanDerWaalsContact NZ-CG 3.25Å; K70-D191 IonicContact NZ-OD1 3.46Å; K70-D191 PolarHBondContact NZ-OD1 3.27Å; K70-D191 IonicContact NZ-OD2 2.68Å; K70-D191 PolarHBondContact NZ-OD2 3.36Å; K70-D191 VanDerWaalsContact NZ-OD2 3.07Å
71	H	97.9	Very high	95.8	Very high	33 Å²	33	55.2 Å²	55.2	15%	0.153	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	121.6	171.2	179.7	-122.6	0	0	0	110.1	G53 T54 Y56 D119 W121 L122	G53-H71 WeakPolarHBondContact CA-O 3.42Å; T54-H71 PolarHBondContact N-O 3.09Å; T54-H71 VanDerWaalsContact N-O 3.09Å; T54-H71 PolarHBondContact O-N 3.22Å; Y56-H71 HydrophobicContact CE2-CB 4.16Å; H71-D119 IonicContact NE2-OD1 3.5Å; H71-D119 IonicContact NE2-OD2 3.81Å; H71-W121 WeakPolarHBondContact CA-O 3.5Å; H71-W121 PolarHBondContact CD2-O 2.9Å; H71-L122 HydrophobicContact CB-CD2 3.9Å
72	V	96.9	Very high	95.6	Very high	12 Å²	12	54 Å²	54	7%	0.073	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	113	175.9	-172.1	0	0	0	0	108.5	K70 V77 G120 W121 I123	K70-V72 HydrophobicContact CD-CG2 4.43Å; K70-V72 HydrophobicContact CG-CG2 4.08Å; V72-V77 HydrophobicContact CG1-CG2 3.96Å; V72-G120 CarbonylContact O-C 3.6Å; V72-G120 WeakPolarHBondContact O-CA 3.39Å; V72-W121 PolarHBondContact N-O 3.19Å; V72-W121 PolarHBondContact O-N 2.9Å; V72-I123 HydrophobicContact CG2-CD1 4.01Å
73	A	95.9	Very high	95.2	Very high	17 Å²	17	49.6 Å²	49.6	14%	0.14	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	142.4	178.4	0	0	0	0	0	110.9	E75 R76 D119	A73-E75 VanDerWaalsContact C-N 3.27Å; A73-E75 WeakPolarHBondContact CB-OE1 3.49Å; A73-E75 PolarHBondContact O-N 2.93Å; A73-R76 HydrophobicContact CB-CG 4.27Å; A73-R76 PolarHBondContact O-N 3.07Å; A73-D119 WeakPolarHBondContact CA-O 3.47Å
74	K	94.1	Very high	94.6	Very high	93 Å²	93	52.1 Å²	52.1	40%	0.404	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-58.8	-38.4	-171.6	-168.5	163.6	-175.4	156.9	0	112.8	R76 V77 E116 D119	K74-R76 PolarHBondContact O-N 2.82Å; K74-V77 PolarHBondContact O-N 2.63Å; K74-E116 IonicContact NZ-OE1 2.85Å; K74-D119 PolarHBondContact N-O 3.16Å
75	E	92.8	Very high	93.8	Very high	157 Å²	157	57.6 Å²	57.6	73%	0.734	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-69.8	-15.5	178	65.6	-85.3	-165	0	0	114.2	A73	A73-E75 VanDerWaalsContact C-N 3.27Å; A73-E75 WeakPolarHBondContact CB-OE1 3.49Å; A73-E75 PolarHBondContact O-N 2.93Å
76	R	91.2	Very high	93	Very high	135 Å²	135	59.9 Å²	59.9	51%	0.509	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-93.5	-5.2	177.1	-63.2	-172.7	-177.6	-170.2	1.2	113.3	G50 A73 K74 T78	G50-R76 PolarHBondContact O-NH1 3.49Å; A73-R76 HydrophobicContact CB-CG 4.27Å; A73-R76 PolarHBondContact O-N 3.07Å; K74-R76 PolarHBondContact O-N 2.82Å; R76-T78 PolarHBondContact O-N 2.79Å
77	V	91.9	Very high	92.3	Very high	20 Å²	20	65.5 Å²	65.5	12%	0.121	33%	0.329	C	S	.	.			trans	-78.8	102.1	177.4	-175.3	0	0	0	0	109.3	V72 K74 E79 W80 P92	V72-V77 HydrophobicContact CG1-CG2 3.96Å; K74-V77 PolarHBondContact O-N 2.63Å; V77-E79 WeakPolarHBondContact CG1-O 3.46Å; V77-W80 HydrophobicContact CB-CZ2 3.9Å; V77-W80 HydrophobicContact CG1-CD2 3.99Å; V77-W80 VanDerWaalsContact CG1-CE2 3.49Å; V77-W80 HydrophobicContact CG1-CG 4.43Å; V77-W80 HydrophobicContact CG1-CH2 4.28Å; V77-W80 HydrophobicContact CG1-CZ2 3.66Å; V77-P92 HydrophobicContact CG1-CB 3.87Å; V77-P92 HydrophobicContact CG1-CG 3.97Å; V77-P92 HydrophobicContact CG2-CB 4.46Å; V77-P92 HydrophobicContact CG2-CG 4.01Å
78	T	89	Confident	91.6	Very high	108 Å²	108	67 Å²	67	66%	0.663	35%	0.345	S	S	*	.			trans	-85.6	-37.3	-179.3	52.2	0	0	0	0	112.6	R76	R76-T78 PolarHBondContact O-N 2.79Å
79	E	93.1	Very high	91.2	Very high	63 Å²	63	68.1 Å²	68.1	29%	0.294	35%	0.354	S	S	.	.			trans	-118.9	140	-177.5	-63.8	-163.5	-129.5	0	0	112	V77 L93 R171	V77-E79 WeakPolarHBondContact CG1-O 3.46Å; E79-L93 HydrophobicContact CB-CB 3.71Å; E79-L93 HydrophobicContact CB-CD2 3.75Å; E79-L93 HydrophobicContact CB-CG 4.38Å; E79-L93 HydrophobicContact CG-CD2 4.37Å; E79-L93 PolarHBondContact O-N 3.32Å; E79-L93 WeakPolarHBondContact OE2-CD2 3.46Å; E79-R171 IonicContact OE1-NH2 3.89Å; E79-R171 PolarHBondContact OE1-NH2 3.41Å
80	W	95.4	Very high	91	Very high	104 Å²	104	73.6 Å²	73.6	39%	0.394	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	146.4	-177.5	-66.6	81.8	0	0	0	111	V77 M90 V91 W121	V77-W80 HydrophobicContact CB-CZ2 3.9Å; V77-W80 HydrophobicContact CG1-CD2 3.99Å; V77-W80 VanDerWaalsContact CG1-CE2 3.49Å; V77-W80 HydrophobicContact CG1-CG 4.43Å; V77-W80 HydrophobicContact CG1-CH2 4.28Å; V77-W80 HydrophobicContact CG1-CZ2 3.66Å; W80-M90 HydrophobicContact CB-CE 4.38Å; W80-M90 HydrophobicContact CD2-CE 4.34Å; W80-M90 HydrophobicContact CE3-CB 4.42Å; W80-M90 HydrophobicContact CE3-CE 4.23Å; W80-M90 HydrophobicContact CG-CE 4.42Å; W80-V91 WeakPolarHBondContact CA-O 3.32Å; W80-W121 HydrophobicContact CH2-CZ2 4.17Å; W80-W121 AromaticContact CH2-NE1 3.68Å; W80-W121 AromaticContact CZ3-CZ2 3.76Å; W80-W121 HydrophobicContact CZ3-CZ2 3.76Å
81	G	94.4	Very high	90.9	Very high	8 Å²	8	73.4 Å²	73.4	8%	0.082	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	161.9	176	0	0	0	0	0	112.3	M90 V91	G81-M90 WeakPolarHBondContact O-CA 3.33Å; G81-V91 PolarHBondContact N-O 3.09Å; G81-V91 PolarHBondContact O-N 3.03Å
82	T	94	Very high	90.9	Very high	68 Å²	68	72.1 Å²	72.1	42%	0.417	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.8	-177.8	-56	0	0	0	0	111.3	L84 A89	T82-L84 HydrophobicContact CG2-CD2 4.14Å; T82-L84 PolarHBondContact O-N 2.92Å; T82-A89 WeakPolarHBondContact CA-O 3.48Å
83	I	89.1	Confident	90.9	Very high	6 Å²	6	72.3 Å²	72.3	3%	0.031	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	98.4	172.1	-58.7	171.2	0	0	0	109.1	L85 Q86 G88 A89 V91 I95 L96 K99 Y114	I83-L85 VanDerWaalsContact C-N 3.3Å; I83-L85 PolarHBondContact O-N 2.88Å; I83-Q86 HydrophobicContact CB-CB 4.42Å; I83-Q86 HydrophobicContact CG2-CB 3.98Å; I83-Q86 HydrophobicContact CG2-CG 3.89Å; I83-Q86 PolarHBondContact O-N 2.99Å; I83-Q86 VanDerWaalsContact O-N 3.13Å; I83-G88 WeakPolarHBondContact O-CA 3.09Å; I83-G88 PolarHBondContact O-N 3.45Å; I83-A89 PolarHBondContact N-O 2.92Å; I83-A89 PolarHBondContact O-N 3.38Å; I83-V91 HydrophobicContact CD1-CG1 3.93Å; I83-V91 HydrophobicContact CD1-CG2 3.78Å; I83-V91 HydrophobicContact CG1-CG2 3.89Å; I83-I95 HydrophobicContact CD1-CG2 4.43Å; I83-L96 HydrophobicContact CG1-CD1 4.15Å; I83-K99 HydrophobicContact CD1-CD 3.93Å; I83-K99 HydrophobicContact CG1-CD 4.21Å; I83-K99 HydrophobicContact CG2-CD 4.16Å; I83-Y114 HydrophobicContact CD1-CE1 4.28Å; I83-Y114 WeakPolarHBondContact CD1-OH 3.47Å
84	L	84.5	Confident	91	Very high	144 Å²	144	72.2 Å²	72.2	75%	0.754	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-59.9	-37.6	-176.8	-62	178.6	0	0	0	113.3	T82 Q86	T82-L84 HydrophobicContact CG2-CD2 4.14Å; T82-L84 PolarHBondContact O-N 2.92Å; L84-Q86 PolarHBondContact O-N 3.29Å; L84-Q86 VanDerWaalsContact O-N 3.15Å
85	L	81.1	Confident	91.2	Very high	165 Å²	165	67.8 Å²	67.8	86%	0.864	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-70.8	-5.4	-179.4	-63.1	176.2	0	0	0	114	I83	I83-L85 VanDerWaalsContact C-N 3.3Å; I83-L85 PolarHBondContact O-N 2.88Å
86	Q	80.8	Confident	91.4	Very high	75 Å²	75	61.6 Å²	61.6	35%	0.35	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-121.9	51.8	177.9	-68.6	174.6	-25.5	0	0	110.4	I83 L84 G88 A89 Y114	I83-Q86 HydrophobicContact CB-CB 4.42Å; I83-Q86 HydrophobicContact CG2-CB 3.98Å; I83-Q86 HydrophobicContact CG2-CG 3.89Å; I83-Q86 PolarHBondContact O-N 2.99Å; I83-Q86 VanDerWaalsContact O-N 3.13Å; L84-Q86 PolarHBondContact O-N 3.29Å; L84-Q86 VanDerWaalsContact O-N 3.15Å; Q86-G88 PolarHBondContact O-N 3.18Å; Q86-G88 VanDerWaalsContact O-N 3.09Å; Q86-A89 HydrophobicContact CB-CB 4.16Å; Q86-A89 WeakPolarHBondContact O-CB 3.21Å; Q86-A89 PolarHBondContact O-N 3.3Å; Q86-Y114 PolarHBondContact NE2-OH 3.36Å; Q86-Y114 PolarHBondContact OE1-OH 3.33Å
87	N	82.9	Confident	91.7	Very high	150 Å²	150	55.2 Å²	55.2	80%	0.802	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	30.1	178.9	-58.4	-21	0	0	0	113.8
88	G	84.5	Confident	92	Very high	32 Å²	32	54.2 Å²	54.2	33%	0.33	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.3	30.3	-179.1	0	0	0	0	0	114.3	I83 Q86 M90	I83-G88 WeakPolarHBondContact O-CA 3.09Å; I83-G88 PolarHBondContact O-N 3.45Å; Q86-G88 PolarHBondContact O-N 3.18Å; Q86-G88 VanDerWaalsContact O-N 3.09Å; G88-M90 PolarHBondContact O-N 3.33Å
89	A	89.4	Confident	92.4	Very high	35 Å²	35	53.1 Å²	53.1	29%	0.289	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54	126.9	174.5	0	0	0	0	0	111.3	T82 I83 Q86	T82-A89 WeakPolarHBondContact CA-O 3.48Å; I83-A89 PolarHBondContact N-O 2.92Å; I83-A89 PolarHBondContact O-N 3.38Å; Q86-A89 HydrophobicContact CB-CB 4.16Å; Q86-A89 WeakPolarHBondContact O-CB 3.21Å; Q86-A89 PolarHBondContact O-N 3.3Å
90	M	94.2	Very high	92.6	Very high	116 Å²	116	54.2 Å²	54.2	57%	0.571	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	130.1	171.5	-76.3	-178.6	51.1	0	0	109.8	W80 G81 G88 W121	W80-M90 HydrophobicContact CB-CE 4.38Å; W80-M90 HydrophobicContact CD2-CE 4.34Å; W80-M90 HydrophobicContact CE3-CB 4.42Å; W80-M90 HydrophobicContact CE3-CE 4.23Å; W80-M90 HydrophobicContact CG-CE 4.42Å; G81-M90 WeakPolarHBondContact O-CA 3.33Å; G88-M90 PolarHBondContact O-N 3.33Å; M90-W121 WeakPolarHBondContact O-CH2 3.35Å
91	V	96.7	Very high	92.7	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.006	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	159.2	179.5	-63.9	0	0	0	0	109.6	W80 G81 I83 L93 I95 L96 Y114 W121	W80-V91 WeakPolarHBondContact CA-O 3.32Å; G81-V91 PolarHBondContact N-O 3.09Å; G81-V91 PolarHBondContact O-N 3.03Å; I83-V91 HydrophobicContact CD1-CG1 3.93Å; I83-V91 HydrophobicContact CD1-CG2 3.78Å; I83-V91 HydrophobicContact CG1-CG2 3.89Å; V91-L93 PolarHBondContact O-N 3.03Å; V91-I95 HydrophobicContact CB-CB 4.22Å; V91-I95 HydrophobicContact CB-CD1 4.44Å; V91-I95 HydrophobicContact CB-CG2 4.17Å; V91-I95 HydrophobicContact CG1-CG2 4.45Å; V91-I95 HydrophobicContact CG2-CB 4.16Å; V91-I95 HydrophobicContact CG2-CG2 4.04Å; V91-L96 HydrophobicContact CG2-CB 4.27Å; V91-Y114 HydrophobicContact CG1-CD2 4.49Å; V91-Y114 HydrophobicContact CG1-CE2 3.78Å; V91-W121 HydrophobicContact CB-CH2 4.4Å; V91-W121 HydrophobicContact CB-CZ3 4.37Å; V91-W121 HydrophobicContact CG1-CH2 4Å; V91-W121 HydrophobicContact CG1-CZ3 3.9Å
92	P	97.1	Very high	92.6	Very high	5 Å²	5	50.5 Å²	50.5	3%	0.032	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-46.2	138.5	164	-29	31.1	0	0	0	111.5	V77 E94 I95 L96 W121	V77-P92 HydrophobicContact CG1-CB 3.87Å; V77-P92 HydrophobicContact CG1-CG 3.97Å; V77-P92 HydrophobicContact CG2-CB 4.46Å; V77-P92 HydrophobicContact CG2-CG 4.01Å; P92-E94 PolarHBondContact O-N 2.9Å; P92-I95 HydrophobicContact CB-CD1 4.29Å; P92-I95 HydrophobicContact CG-CD1 3.99Å; P92-I95 PolarHBondContact O-N 2.8Å; P92-L96 PolarHBondContact O-N 3.32Å; P92-W121 VanDerWaalsContact CD-CD2 3.43Å; P92-W121 HydrophobicContact CG-CB 4.2Å; P92-W121 HydrophobicContact CG-CD2 3.68Å; P92-W121 HydrophobicContact CG-CE3 4.39Å; P92-W121 HydrophobicContact CG-CG 3.53Å
93	L	96.9	Very high	92.3	Very high	16 Å²	16	49.7 Å²	49.7	8%	0.084	27%	0.27	C	S	.	.	H	α-helix	trans	-55.6	-38.7	-179	-178.9	60.3	0	0	0	111.4	E79 V91 I95 L96 L97	E79-L93 HydrophobicContact CB-CB 3.71Å; E79-L93 HydrophobicContact CB-CD2 3.75Å; E79-L93 HydrophobicContact CB-CG 4.38Å; E79-L93 HydrophobicContact CG-CD2 4.37Å; E79-L93 PolarHBondContact O-N 3.32Å; E79-L93 WeakPolarHBondContact OE2-CD2 3.46Å; V91-L93 PolarHBondContact O-N 3.03Å; L93-I95 VanDerWaalsContact C-N 3.29Å; L93-I95 PolarHBondContact O-N 3.48Å; L93-L96 HydrophobicContact CD1-CB 4.47Å; L93-L96 HydrophobicContact CD1-CD2 4.14Å; L93-L96 WeakPolarHBondContact O-CA 3.36Å; L93-L96 WeakPolarHBondContact O-CB 3.24Å; L93-L96 PolarHBondContact O-N 3.38Å; L93-L97 HydrophobicContact CD1-CD2 4.01Å; L93-L97 HydrophobicContact CD1-CG 4.06Å; L93-L97 HydrophobicContact CD2-CD1 4.41Å; L93-L97 HydrophobicContact CG-CD1 3.99Å; L93-L97 HydrophobicContact CG-CD2 4.35Å; L93-L97 HydrophobicContact CG-CG 3.96Å; L93-L97 WeakPolarHBondContact O-CG 3.12Å; L93-L97 PolarHBondContact O-N 2.85Å
94	E	97.5	Very high	92.5	Very high	15 Å²	15	55.2 Å²	55.2	7%	0.07	31%	0.309	C	S	.	.	H	α-helix	trans	-50.2	-45.5	175.1	-176.7	175.3	-177.1	0	0	112.8	K70 P92 L96 L97 L98 I123 F192	K70-E94 VanDerWaalsContact NZ-CD 3.31Å; K70-E94 IonicContact NZ-OE1 3.37Å; K70-E94 PolarHBondContact NZ-OE1 2.83Å; K70-E94 IonicContact NZ-OE2 2.64Å; K70-E94 PolarHBondContact NZ-OE2 2.65Å; P92-E94 PolarHBondContact O-N 2.9Å; E94-L96 PolarHBondContact O-N 3.04Å; E94-L97 PolarHBondContact O-N 3.08Å; E94-L98 HydrophobicContact CG-CD1 4.02Å; E94-L98 VanDerWaalsContact O-CB 3.3Å; E94-L98 WeakPolarHBondContact O-CB 2.91Å; E94-L98 WeakPolarHBondContact O-CG 3.43Å; E94-L98 PolarHBondContact O-N 3.36Å; E94-I123 HydrophobicContact CB-CD1 4.49Å; E94-I123 HydrophobicContact CG-CD1 4.11Å; E94-F192 HydrophobicContact CG-CB 4.18Å
95	I	97.9	Very high	93	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.5	-42.6	177.5	-71.4	164	0	0	0	110.6	I83 V91 P92 L93 K99 L111 Y114 W121 I123	I83-I95 HydrophobicContact CD1-CG2 4.43Å; V91-I95 HydrophobicContact CB-CB 4.22Å; V91-I95 HydrophobicContact CB-CD1 4.44Å; V91-I95 HydrophobicContact CB-CG2 4.17Å; V91-I95 HydrophobicContact CG1-CG2 4.45Å; V91-I95 HydrophobicContact CG2-CB 4.16Å; V91-I95 HydrophobicContact CG2-CG2 4.04Å; P92-I95 HydrophobicContact CB-CD1 4.29Å; P92-I95 HydrophobicContact CG-CD1 3.99Å; P92-I95 PolarHBondContact O-N 2.8Å; L93-I95 VanDerWaalsContact C-N 3.29Å; L93-I95 PolarHBondContact O-N 3.48Å; I95-K99 VanDerWaalsContact O-CB 3.26Å; I95-K99 WeakPolarHBondContact O-CB 3.34Å; I95-K99 PolarHBondContact O-N 3.33Å; I95-L111 HydrophobicContact CG2-CD2 4.36Å; I95-Y114 HydrophobicContact CD1-CD2 3.94Å; I95-Y114 HydrophobicContact CD1-CG 3.97Å; I95-Y114 HydrophobicContact CG1-CG 4.37Å; I95-Y114 HydrophobicContact CG2-CD1 3.61Å; I95-Y114 HydrophobicContact CG2-CD2 4.15Å; I95-Y114 HydrophobicContact CG2-CE1 3.9Å; I95-Y114 HydrophobicContact CG2-CE2 4.41Å; I95-Y114 HydrophobicContact CG2-CG 3.76Å; I95-W121 HydrophobicContact CD1-CB 4.45Å; I95-W121 HydrophobicContact CD1-CD2 4.29Å; I95-W121 HydrophobicContact CD1-CE3 3.73Å; I95-W121 HydrophobicContact CD1-CZ3 4.4Å; I95-I123 HydrophobicContact CD1-CD1 4.31Å; I95-I123 HydrophobicContact CD1-CG1 3.98Å; I95-I123 HydrophobicContact CG1-CD1 3.79Å; I95-I123 HydrophobicContact CG1-CG1 3.77Å; I95-I123 HydrophobicContact CG1-CG2 4.41Å
96	L	97.9	Very high	93.7	Very high	28 Å²	28	51 Å²	51	15%	0.147	27%	0.274	C	S	.	.	H	α-helix	trans	-63.9	-44.3	178	176.5	63.5	0	0	0	111.3	I83 V91 P92 L93 E94 K99 K100	I83-L96 HydrophobicContact CG1-CD1 4.15Å; V91-L96 HydrophobicContact CG2-CB 4.27Å; P92-L96 PolarHBondContact O-N 3.32Å; L93-L96 HydrophobicContact CD1-CB 4.47Å; L93-L96 HydrophobicContact CD1-CD2 4.14Å; L93-L96 WeakPolarHBondContact O-CA 3.36Å; L93-L96 WeakPolarHBondContact O-CB 3.24Å; L93-L96 PolarHBondContact O-N 3.38Å; E94-L96 PolarHBondContact O-N 3.04Å; L96-K99 PolarHBondContact O-N 2.82Å; L96-K100 HydrophobicContact CG-CD 4.4Å; L96-K100 WeakPolarHBondContact O-CG 3.47Å; L96-K100 PolarHBondContact O-N 2.95Å
97	L	98.3	Very high	94.4	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.5	-49.5	179.1	-60.8	-178.3	0	0	0	110.9	L93 E94 K99 K100 V101 V168 F192 I197	L93-L97 HydrophobicContact CD1-CD2 4.01Å; L93-L97 HydrophobicContact CD1-CG 4.06Å; L93-L97 HydrophobicContact CD2-CD1 4.41Å; L93-L97 HydrophobicContact CG-CD1 3.99Å; L93-L97 HydrophobicContact CG-CD2 4.35Å; L93-L97 HydrophobicContact CG-CG 3.96Å; L93-L97 WeakPolarHBondContact O-CG 3.12Å; L93-L97 PolarHBondContact O-N 2.85Å; E94-L97 PolarHBondContact O-N 3.08Å; L97-K99 VanDerWaalsContact C-N 3.28Å; L97-K99 PolarHBondContact O-N 2.78Å; L97-K100 WeakPolarHBondContact O-CB 2.9Å; L97-K100 PolarHBondContact O-N 2.95Å; L97-V101 WeakPolarHBondContact O-CG2 3.31Å; L97-V101 PolarHBondContact O-N 3.29Å; L97-V168 HydrophobicContact CB-CG1 4.17Å; L97-V168 HydrophobicContact CD1-CG1 4.45Å; L97-V168 HydrophobicContact CD2-CG1 4.12Å; L97-V168 HydrophobicContact CD2-CG2 3.99Å; L97-V168 HydrophobicContact CG-CG1 4.46Å; L97-F192 HydrophobicContact CB-CB 4.21Å; L97-F192 HydrophobicContact CB-CD1 4.14Å; L97-F192 HydrophobicContact CD1-CB 4.48Å; L97-I197 HydrophobicContact CD2-CD1 3.65Å; L97-I197 HydrophobicContact CD2-CG1 4.38Å
98	L	97.9	Very high	95.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-55.8	-42.9	174.9	-81.7	173.1	0	0	0	111.5	E94 K100 V101 S102 I109 L111 I123 M125 F192	E94-L98 HydrophobicContact CG-CD1 4.02Å; E94-L98 VanDerWaalsContact O-CB 3.3Å; E94-L98 WeakPolarHBondContact O-CB 2.91Å; E94-L98 WeakPolarHBondContact O-CG 3.43Å; E94-L98 PolarHBondContact O-N 3.36Å; L98-K100 VanDerWaalsContact C-N 3.32Å; L98-K100 PolarHBondContact O-N 2.75Å; L98-V101 WeakPolarHBondContact O-CG2 3.5Å; L98-V101 PolarHBondContact O-N 2.91Å; L98-S102 WeakPolarHBondContact O-CB 3.32Å; L98-S102 PolarHBondContact O-N 2.79Å; L98-S102 PolarHBondContact O-OG 3.37Å; L98-I109 HydrophobicContact CD2-CG2 4.05Å; L98-L111 HydrophobicContact CB-CB 4.07Å; L98-L111 HydrophobicContact CB-CD2 4.18Å; L98-L111 HydrophobicContact CD1-CD1 4.36Å; L98-I123 HydrophobicContact CD1-CG2 3.83Å; L98-M125 HydrophobicContact CD1-SD 4.19Å; L98-F192 HydrophobicContact CD2-CD2 3.48Å; L98-F192 VanDerWaalsContact CD2-CD2 3.48Å; L98-F192 HydrophobicContact CD2-CE2 3.95Å; L98-F192 HydrophobicContact CD2-CG 4.17Å; L98-F192 HydrophobicContact CG-CB 4.25Å; L98-F192 HydrophobicContact CG-CD2 4.11Å; L98-F192 HydrophobicContact CG-CG 4.35Å
99	K	96.6	Very high	95.8	Very high	84 Å²	84	39.8 Å²	39.8	37%	0.365	21%	0.211	S	C	.	.	H	α-helix	trans	-62.7	-36.6	176	-169	-175.6	-174.6	81.2	0	112.5	I83 I95 L96 L97 L111	I83-K99 HydrophobicContact CD1-CD 3.93Å; I83-K99 HydrophobicContact CG1-CD 4.21Å; I83-K99 HydrophobicContact CG2-CD 4.16Å; I95-K99 VanDerWaalsContact O-CB 3.26Å; I95-K99 WeakPolarHBondContact O-CB 3.34Å; I95-K99 PolarHBondContact O-N 3.33Å; L96-K99 PolarHBondContact O-N 2.82Å; L97-K99 VanDerWaalsContact C-N 3.28Å; L97-K99 PolarHBondContact O-N 2.78Å; K99-L111 HydrophobicContact CB-CD2 4.12Å
100	K	97.1	Very high	96.2	Very high	86 Å²	86	42.7 Å²	42.7	37%	0.374	22%	0.217	S	C	.	.	H	α-helix	trans	-69.1	-38.3	178	-73.6	172.2	60.5	62.7	0	112.4	L96 L97 L98 C166 V168 I197	L96-K100 HydrophobicContact CG-CD 4.4Å; L96-K100 WeakPolarHBondContact O-CG 3.47Å; L96-K100 PolarHBondContact O-N 2.95Å; L97-K100 WeakPolarHBondContact O-CB 2.9Å; L97-K100 PolarHBondContact O-N 2.95Å; L98-K100 VanDerWaalsContact C-N 3.32Å; L98-K100 PolarHBondContact O-N 2.75Å; K100-C166 WeakPolarHBondContact CE-O 3.19Å; K100-C166 PolarHBondContact NZ-O 3.46Å; K100-C166 PolarHBondContact O-SG 2.91Å; K100-C166 VanDerWaalsContact O-SG 3.4Å; K100-V168 HydrophobicContact CB-CG2 3.92Å; K100-V168 HydrophobicContact CD-CG2 4.17Å; K100-I197 HydrophobicContact CD-CD1 3.92Å
101	V	97.6	Very high	96.3	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.006	20%	0.195	C	C	.	.	H	α-helix	trans	-89.6	-17.3	-178.7	-58.4	0	0	0	0	113.4	L97 L98 S103 V108 H162 C163 C166 V168 F192	L97-V101 WeakPolarHBondContact O-CG2 3.31Å; L97-V101 PolarHBondContact O-N 3.29Å; L98-V101 WeakPolarHBondContact O-CG2 3.5Å; L98-V101 PolarHBondContact O-N 2.91Å; V101-S103 PolarHBondContact O-N 2.62Å; V101-V108 HydrophobicContact CB-CG1 4.27Å; V101-V108 HydrophobicContact CG2-CG1 3.68Å; V101-H162 PolarHBondContact O-NE2 3.4Å; V101-C163 HydrophobicContact CG1-CB 4.41Å; V101-C166 HydrophobicContact CG1-CB 4Å; V101-V168 HydrophobicContact CG1-CB 3.86Å; V101-V168 HydrophobicContact CG1-CG1 4.14Å; V101-V168 HydrophobicContact CG1-CG2 3.8Å; V101-F192 HydrophobicContact CG1-CE1 4.09Å; V101-F192 HydrophobicContact CG1-CZ 4.44Å; V101-F192 HydrophobicContact CG2-CE1 4.04Å; V101-F192 HydrophobicContact CG2-CE2 4.27Å; V101-F192 HydrophobicContact CG2-CZ 3.81Å
102	S	92.9	Very high	96.4	Very high	33 Å²	33	40.9 Å²	40.9	23%	0.231	21%	0.209	C	C	.	.			trans	-69.4	90.4	177.5	-69.4	0	0	0	0	110.8	L98 L111	L98-S102 WeakPolarHBondContact O-CB 3.32Å; L98-S102 PolarHBondContact O-N 2.79Å; L98-S102 PolarHBondContact O-OG 3.37Å; S102-L111 WeakPolarHBondContact OG-CB 3.46Å; S102-L111 PolarHBondContact OG-N 2.83Å
103	S	88.4	Confident	96.4	Very high	51 Å²	51	42.2 Å²	42.2	36%	0.357	22%	0.216	S	C	.	.	S	Bend	trans	-120.7	-157.7	176.4	76.7	0	0	0	0	110.3	V101 F105 H162	V101-S103 PolarHBondContact O-N 2.62Å; S103-F105 WeakPolarHBondContact OG-CB 3.29Å; S103-F105 PolarHBondContact OG-N 3.28Å; S103-H162 PolarHBondContact OG-CE1 3.41Å
104	S	91.5	Very high	96.4	Very high	122 Å²	122	43 Å²	43	85%	0.853	22%	0.218	S	C	*	.	S	Bend	trans	-77.8	-5.3	167.6	52.5	0	0	0	0	113.5	R106	S104-R106 PolarHBondContact O-N 3.18Å
105	F	95.7	Very high	96.4	Very high	62 Å²	62	43.4 Å²	43.4	27%	0.272	22%	0.219	S	C	.	.			trans	-67.7	126.2	177.9	-178	-100.8	0	0	0	110.7	S103 G107 V108 E158 A159 H162	S103-F105 WeakPolarHBondContact OG-CB 3.29Å; S103-F105 PolarHBondContact OG-N 3.28Å; F105-G107 VanDerWaalsContact CE1-N 3.28Å; F105-V108 HydrophobicContact CD1-CB 4.42Å; F105-V108 HydrophobicContact CD1-CG2 4.05Å; F105-V108 HydrophobicContact CE1-CG2 4.05Å; F105-E158 HydrophobicContact CE2-CB 4.3Å; F105-E158 HydrophobicContact CZ-CB 4.01Å; F105-A159 HydrophobicContact CE1-CB 3.99Å; F105-A159 HydrophobicContact CZ-CB 4.34Å; F105-H162 HydrophobicContact CD1-CB 3.76Å; F105-H162 AromaticContact CD1-CD2 3.34Å; F105-H162 WeakPolarHBondContact CD1-CD2 3.5Å; F105-H162 AromaticContact CD1-CG 3.48Å; F105-H162 VanDerWaalsContact CD1-CG 3.48Å; F105-H162 HydrophobicContact CD2-CB 4.27Å; F105-H162 HydrophobicContact CE1-CB 3.83Å; F105-H162 HydrophobicContact CE2-CB 4.34Å; F105-H162 HydrophobicContact CG-CB 3.99Å; F105-H162 AromaticContact CG-CD2 3.78Å; F105-H162 AromaticContact CG-CG 3.58Å; F105-H162 AromaticContact CG-ND1 3.95Å; F105-H162 HydrophobicContact CZ-CB 4.13Å
106	R	95.1	Very high	96.3	Very high	160 Å²	160	49.1 Å²	49.1	60%	0.604	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-22	-171.8	-63.5	-161.3	-63.1	-132.2	-0.1	114.4	S104 V108 E186 K188	S104-R106 PolarHBondContact O-N 3.18Å; R106-V108 PolarHBondContact O-N 3.48Å; R106-E186 IonicContact CZ-OE1 3.81Å; R106-E186 IonicContact NE-OE1 3.48Å; R106-E186 PolarHBondContact NE-OE1 3.45Å; R106-E186 IonicContact NE-OE2 2.99Å; R106-E186 IonicContact NH2-OE1 2.67Å; R106-E186 PolarHBondContact NH2-OE1 3.03Å; R106-K188 WeakPolarHBondContact O-CG 3.37Å; R106-K188 PolarHBondContact O-NZ 3.36Å
107	G	97.3	Very high	96.1	Very high	12 Å²	12	52.5 Å²	52.5	12%	0.124	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	5.2	-173.3	0	0	0	0	0	115.8	F105 A159 L187 L189	F105-G107 VanDerWaalsContact CE1-N 3.28Å; G107-A159 WeakPolarHBondContact O-CB 3.49Å; G107-L187 WeakPolarHBondContact CA-O 3.44Å; G107-L189 PolarHBondContact O-N 3.48Å
108	V	98.2	Very high	95.9	Very high	4 Å²	4	57.5 Å²	57.5	2%	0.024	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-127.4	139.3	172.3	177.9	0	0	0	0	108.4	V101 F105 R106 K110 A159 L189 F192	V101-V108 HydrophobicContact CB-CG1 4.27Å; V101-V108 HydrophobicContact CG2-CG1 3.68Å; F105-V108 HydrophobicContact CD1-CB 4.42Å; F105-V108 HydrophobicContact CD1-CG2 4.05Å; F105-V108 HydrophobicContact CE1-CG2 4.05Å; R106-V108 PolarHBondContact O-N 3.48Å; V108-K110 PolarHBondContact O-N 2.71Å; V108-A159 HydrophobicContact CG2-CB 4.2Å; V108-L189 HydrophobicContact CG2-CB 4.31Å; V108-F192 HydrophobicContact CG1-CE2 3.64Å; V108-F192 HydrophobicContact CG1-CZ 3.62Å
109	I	97.4	Very high	95.7	Very high	4 Å²	4	60.8 Å²	60.8	2%	0.021	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-61.3	130.2	178.7	-155.8	71.1	0	0	0	111	L98 M125 E126 L179 K188 L189 I190	L98-I109 HydrophobicContact CD2-CG2 4.05Å; I109-M125 HydrophobicContact CG1-CB 4.15Å; I109-M125 HydrophobicContact CG2-SD 4.15Å; I109-E126 HydrophobicContact CD1-CG 3.46Å; I109-E126 VanDerWaalsContact CD1-CG 3.46Å; I109-E126 WeakPolarHBondContact CD1-O 3.46Å; I109-E126 HydrophobicContact CG1-CG 3.89Å; I109-L179 HydrophobicContact CD1-CD1 4.48Å; I109-K188 HydrophobicContact CD1-CD 4.03Å; I109-L189 PolarHBondContact N-O 3.42Å; I109-I190 HydrophobicContact CB-CG2 3.7Å; I109-I190 HydrophobicContact CD1-CG2 4.19Å; I109-I190 HydrophobicContact CG1-CG2 4Å; I109-I190 HydrophobicContact CG2-CB 4.32Å; I109-I190 HydrophobicContact CG2-CG2 3.9Å
110	K	97.3	Very high	95.7	Very high	96 Å²	96	56.8 Å²	56.8	42%	0.417	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-81.1	127.7	-178.1	-168.4	173.4	-177.4	175.4	0	111.8	V108 L112 M125 E126	V108-K110 PolarHBondContact O-N 2.71Å; K110-L112 HydrophobicContact CD-CD2 4.25Å; K110-L112 HydrophobicContact CG-CD2 4.28Å; K110-L112 PolarHBondContact O-N 2.92Å; K110-M125 CarbonylContact O-C 3.2Å; K110-M125 VanDerWaalsContact O-CA 3.24Å; K110-M125 WeakPolarHBondContact O-CA 3.43Å; K110-E126 HydrophobicContact CB-CB 4.32Å; K110-E126 HydrophobicContact CB-CG 3.95Å; K110-E126 PolarHBondContact N-OE1 3.19Å; K110-E126 PolarHBondContact O-N 3.33Å
111	L	98.1	Very high	95.8	Very high	20 Å²	20	53 Å²	53	11%	0.105	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	119.5	161.9	-176.6	69.1	0	0	0	109.2	I95 L98 K99 S102 D113 Y114 I123	I95-L111 HydrophobicContact CG2-CD2 4.36Å; L98-L111 HydrophobicContact CB-CB 4.07Å; L98-L111 HydrophobicContact CB-CD2 4.18Å; L98-L111 HydrophobicContact CD1-CD1 4.36Å; K99-L111 HydrophobicContact CB-CD2 4.12Å; S102-L111 WeakPolarHBondContact OG-CB 3.46Å; S102-L111 PolarHBondContact OG-N 2.83Å; L111-D113 VanDerWaalsContact CD1-O 3.31Å; L111-D113 WeakPolarHBondContact CD1-O 3.42Å; L111-Y114 HydrophobicContact CD2-CD1 4.44Å; L111-I123 HydrophobicContact CD1-CG2 3.45Å; L111-I123 VanDerWaalsContact CD1-CG2 3.45Å
112	L	97.3	Very high	95.8	Very high	59 Å²	59	53.5 Å²	53.5	31%	0.309	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-42.7	174.1	-58	-179.8	0	0	0	110.2	V67 K110 V124 E126	V67-L112 HydrophobicContact CG1-CD1 3.63Å; K110-L112 HydrophobicContact CD-CD2 4.25Å; K110-L112 HydrophobicContact CG-CD2 4.28Å; K110-L112 PolarHBondContact O-N 2.92Å; L112-V124 HydrophobicContact CB-CG1 4.39Å; L112-V124 PolarHBondContact N-O 3.38Å; L112-E126 HydrophobicContact CD1-CB 4.4Å; L112-E126 HydrophobicContact CD2-CB 4.47Å
113	D	96.9	Very high	96	Very high	33 Å²	33	52 Å²	52	18%	0.176	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.8	170.6	-175.5	-151.3	-3.3	0	0	0	113.1	K34 Y41 L111 Y115 V124	K34-D113 VanDerWaalsContact CE-CG 3.41Å; K34-D113 WeakPolarHBondContact CE-OD1 3.26Å; K34-D113 WeakPolarHBondContact CE-OD2 3.37Å; K34-D113 IonicContact NZ-OD1 2.67Å; K34-D113 PolarHBondContact NZ-OD1 3.2Å; K34-D113 IonicContact NZ-OD2 3.31Å; K34-D113 PolarHBondContact NZ-OD2 2.96Å; Y41-D113 HydrophobicContact CE2-CB 4.37Å; L111-D113 VanDerWaalsContact CD1-O 3.31Å; L111-D113 WeakPolarHBondContact CD1-O 3.42Å; D113-Y115 HydrophobicContact CB-CE2 4.21Å; D113-Y115 WeakPolarHBondContact OD2-CE2 3.38Å; D113-Y115 VanDerWaalsContact OD2-CZ 3.3Å; D113-Y115 PolarHBondContact OD2-OH 3.4Å; D113-Y115 VanDerWaalsContact OD2-OH 3.09Å; D113-V124 HydrophobicContact CB-CB 4.06Å; D113-V124 HydrophobicContact CB-CG2 4.34Å; D113-V124 PolarHBondContact N-O 3.3Å; D113-V124 WeakPolarHBondContact O-CA 3.17Å; D113-V124 WeakPolarHBondContact O-CB 3.25Å; D113-V124 PolarHBondContact O-N 3.38Å
114	Y	97.4	Very high	96.5	Very high	32 Å²	32	49.5 Å²	49.5	13%	0.125	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	153.6	168.3	66.6	-84	0	0	0	112.5	K34 I83 Q86 V91 I95 L111 W121 L122	K34-Y114 PolarHBondContact NZ-O 3.11Å; I83-Y114 HydrophobicContact CD1-CE1 4.28Å; I83-Y114 WeakPolarHBondContact CD1-OH 3.47Å; Q86-Y114 PolarHBondContact NE2-OH 3.36Å; Q86-Y114 PolarHBondContact OE1-OH 3.33Å; V91-Y114 HydrophobicContact CG1-CD2 4.49Å; V91-Y114 HydrophobicContact CG1-CE2 3.78Å; I95-Y114 HydrophobicContact CD1-CD2 3.94Å; I95-Y114 HydrophobicContact CD1-CG 3.97Å; I95-Y114 HydrophobicContact CG1-CG 4.37Å; I95-Y114 HydrophobicContact CG2-CD1 3.61Å; I95-Y114 HydrophobicContact CG2-CD2 4.15Å; I95-Y114 HydrophobicContact CG2-CE1 3.9Å; I95-Y114 HydrophobicContact CG2-CE2 4.41Å; I95-Y114 HydrophobicContact CG2-CG 3.76Å; L111-Y114 HydrophobicContact CD2-CD1 4.44Å; Y114-W121 HydrophobicContact CD2-CE3 4.12Å; Y114-W121 AromaticContact CD2-CZ3 3.93Å; Y114-W121 HydrophobicContact CD2-CZ3 3.93Å; Y114-W121 HydrophobicContact CE2-CZ3 4.07Å; Y114-L122 CarbonylContact C-O 3.6Å; Y114-L122 WeakPolarHBondContact CA-O 3.48Å; Y114-L122 WeakPolarHBondContact CB-O 3.46Å
115	Y	97.1	Very high	96.9	Very high	24 Å²	24	44.4 Å²	44.4	9%	0.094	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	135.9	-177.5	-63.2	-100.9	0	0	0	110.6	K34 E35 F37 Y41 D113 W121 L122 V124	K34-Y115 HydrophobicContact CD-CD1 4.34Å; K34-Y115 HydrophobicContact CD-CE1 3.94Å; K34-Y115 HydrophobicContact CG-CE1 4.37Å; E35-Y115 WeakPolarHBondContact O-CE1 3.35Å; F37-Y115 HydrophobicContact CB-CD1 3.87Å; F37-Y115 HydrophobicContact CB-CD2 4.21Å; F37-Y115 HydrophobicContact CB-CE1 3.89Å; F37-Y115 HydrophobicContact CB-CE2 4.26Å; F37-Y115 HydrophobicContact CB-CG 4.01Å; F37-Y115 AromaticContact CD2-CD2 3.71Å; F37-Y115 HydrophobicContact CD2-CD2 3.71Å; F37-Y115 AromaticContact CD2-CE2 3.68Å; F37-Y115 HydrophobicContact CD2-CE2 3.68Å; F37-Y115 HydrophobicContact CD2-CG 4.31Å; F37-Y115 HydrophobicContact CG-CD2 4.4Å; F37-Y115 HydrophobicContact CG-CE2 4.46Å; Y41-Y115 HydrophobicContact CD2-CE2 4.11Å; Y41-Y115 AromaticContact CE2-CE2 3.82Å; Y41-Y115 HydrophobicContact CE2-CE2 3.82Å; D113-Y115 HydrophobicContact CB-CE2 4.21Å; D113-Y115 WeakPolarHBondContact OD2-CE2 3.38Å; D113-Y115 VanDerWaalsContact OD2-CZ 3.3Å; D113-Y115 PolarHBondContact OD2-OH 3.4Å; D113-Y115 VanDerWaalsContact OD2-OH 3.09Å; Y115-W121 CarbonylContact O-C 3.36Å; Y115-W121 WeakPolarHBondContact O-CA 3.31Å; Y115-L122 PolarHBondContact N-O 2.75Å; Y115-L122 PolarHBondContact O-N 2.82Å; Y115-V124 HydrophobicContact CD2-CG2 4.3Å; Y115-V124 HydrophobicContact CE2-CG2 4.23Å
116	E	95.9	Very high	96.9	Very high	120 Å²	120	43.9 Å²	43.9	56%	0.561	22%	0.218	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-84.1	136.7	166.4	-170.8	176.3	-173.9	0	0	109.3	K74 W121	K74-E116 IonicContact NZ-OE1 2.85Å; E116-W121 HydrophobicContact CB-CD2 4.38Å; E116-W121 HydrophobicContact CB-CE3 4.02Å; E116-W121 HydrophobicContact CB-CH2 3.81Å; E116-W121 HydrophobicContact CB-CZ2 4.17Å; E116-W121 HydrophobicContact CB-CZ3 3.73Å; E116-W121 HydrophobicContact CG-CD2 4.39Å; E116-W121 HydrophobicContact CG-CE3 4.48Å; E116-W121 HydrophobicContact CG-CH2 3.9Å; E116-W121 HydrophobicContact CG-CZ2 3.77Å; E116-W121 HydrophobicContact CG-CZ3 4.27Å
117	R	94	Very high	96.9	Very high	100 Å²	100	39.1 Å²	39.1	38%	0.377	20%	0.199	S	C	.	.			trans	-126.1	170	173.1	-64.2	-177.7	73.4	-127.7	4.7	109.5	D119 G120 L122	R117-D119 WeakPolarHBondContact CB-OD1 3.27Å; R117-D119 IonicContact CZ-OD1 3.67Å; R117-D119 IonicContact CZ-OD2 3.63Å; R117-D119 IonicContact NE-OD1 3.71Å; R117-D119 VanDerWaalsContact NH1-CG 3.3Å; R117-D119 IonicContact NH1-OD1 3.77Å; R117-D119 PolarHBondContact NH1-OD1 3.35Å; R117-D119 IonicContact NH1-OD2 2.86Å; R117-D119 PolarHBondContact NH1-OD2 3.23Å; R117-D119 PolarHBondContact O-N 2.85Å; R117-G120 WeakPolarHBondContact CA-O 3.44Å; R117-G120 PolarHBondContact N-O 2.95Å; R117-G120 PolarHBondContact O-N 3.44Å; R117-G120 VanDerWaalsContact O-O 3.14Å; R117-L122 HydrophobicContact CG-CG 4.43Å
118	A	94.7	Very high	96.8	Very high	104 Å²	104	39.2 Å²	39.2	86%	0.86	20%	0.198	S	C	*	.	S	Bend	trans	-62.1	-34.1	177	0	0	0	0	0	112.5
119	D	94.3	Very high	96.2	Very high	70 Å²	70	45 Å²	45	37%	0.374	23%	0.225	S	C	.	.	S	Bend	trans	-95.4	-8.1	-176.1	56.8	-15.7	0	0	0	114.2	H71 A73 K74 R117	H71-D119 IonicContact NE2-OD1 3.5Å; H71-D119 IonicContact NE2-OD2 3.81Å; A73-D119 WeakPolarHBondContact CA-O 3.47Å; K74-D119 PolarHBondContact N-O 3.16Å; R117-D119 WeakPolarHBondContact CB-OD1 3.27Å; R117-D119 IonicContact CZ-OD1 3.67Å; R117-D119 IonicContact CZ-OD2 3.63Å; R117-D119 IonicContact NE-OD1 3.71Å; R117-D119 VanDerWaalsContact NH1-CG 3.3Å; R117-D119 IonicContact NH1-OD1 3.77Å; R117-D119 PolarHBondContact NH1-OD1 3.35Å; R117-D119 IonicContact NH1-OD2 2.86Å; R117-D119 PolarHBondContact NH1-OD2 3.23Å; R117-D119 PolarHBondContact O-N 2.85Å
120	G	96.3	Very high	96	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.3	-148.5	-175.7	0	0	0	0	0	114.2	V72 R117	V72-G120 CarbonylContact O-C 3.6Å; V72-G120 WeakPolarHBondContact O-CA 3.39Å; R117-G120 WeakPolarHBondContact CA-O 3.44Å; R117-G120 PolarHBondContact N-O 2.95Å; R117-G120 PolarHBondContact O-N 3.44Å; R117-G120 VanDerWaalsContact O-O 3.14Å
121	W	97.8	Very high	95.9	Very high	6 Å²	6	47.6 Å²	47.6	2%	0.023	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	138.7	-177.1	-65.4	81.8	0	0	0	110.4	H71 V72 W80 M90 V91 P92 I95 Y114 Y115 E116	H71-W121 WeakPolarHBondContact CA-O 3.5Å; H71-W121 PolarHBondContact CD2-O 2.9Å; V72-W121 PolarHBondContact N-O 3.19Å; V72-W121 PolarHBondContact O-N 2.9Å; W80-W121 HydrophobicContact CH2-CZ2 4.17Å; W80-W121 AromaticContact CH2-NE1 3.68Å; W80-W121 AromaticContact CZ3-CZ2 3.76Å; W80-W121 HydrophobicContact CZ3-CZ2 3.76Å; M90-W121 WeakPolarHBondContact O-CH2 3.35Å; V91-W121 HydrophobicContact CB-CH2 4.4Å; V91-W121 HydrophobicContact CB-CZ3 4.37Å; V91-W121 HydrophobicContact CG1-CH2 4Å; V91-W121 HydrophobicContact CG1-CZ3 3.9Å; P92-W121 VanDerWaalsContact CD-CD2 3.43Å; P92-W121 HydrophobicContact CG-CB 4.2Å; P92-W121 HydrophobicContact CG-CD2 3.68Å; P92-W121 HydrophobicContact CG-CE3 4.39Å; P92-W121 HydrophobicContact CG-CG 3.53Å; I95-W121 HydrophobicContact CD1-CB 4.45Å; I95-W121 HydrophobicContact CD1-CD2 4.29Å; I95-W121 HydrophobicContact CD1-CE3 3.73Å; I95-W121 HydrophobicContact CD1-CZ3 4.4Å; Y114-W121 HydrophobicContact CD2-CE3 4.12Å; Y114-W121 AromaticContact CD2-CZ3 3.93Å; Y114-W121 HydrophobicContact CD2-CZ3 3.93Å; Y114-W121 HydrophobicContact CE2-CZ3 4.07Å; Y115-W121 CarbonylContact O-C 3.36Å; Y115-W121 WeakPolarHBondContact O-CA 3.31Å; E116-W121 HydrophobicContact CB-CD2 4.38Å; E116-W121 HydrophobicContact CB-CE3 4.02Å; E116-W121 HydrophobicContact CB-CH2 3.81Å; E116-W121 HydrophobicContact CB-CZ2 4.17Å; E116-W121 HydrophobicContact CB-CZ3 3.73Å; E116-W121 HydrophobicContact CG-CD2 4.39Å; E116-W121 HydrophobicContact CG-CE3 4.48Å; E116-W121 HydrophobicContact CG-CH2 3.9Å; E116-W121 HydrophobicContact CG-CZ2 3.77Å; E116-W121 HydrophobicContact CG-CZ3 4.27Å
122	L	98.2	Very high	95.8	Very high	12 Å²	12	49 Å²	49	6%	0.063	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	125.7	165.8	-59	179.8	0	0	0	108.8	F37 V69 K70 H71 Y114 Y115 R117	F37-L122 HydrophobicContact CB-CD1 4.41Å; F37-L122 HydrophobicContact CD1-CD1 3.72Å; F37-L122 HydrophobicContact CD2-CD1 3.72Å; F37-L122 HydrophobicContact CE1-CD1 3.84Å; F37-L122 HydrophobicContact CE2-CD1 3.84Å; F37-L122 HydrophobicContact CG-CD1 3.66Å; F37-L122 HydrophobicContact CZ-CD1 3.9Å; V69-L122 HydrophobicContact CG1-CB 4.23Å; V69-L122 HydrophobicContact CG1-CD2 4.06Å; K70-L122 CarbonylContact O-C 3.6Å; K70-L122 WeakPolarHBondContact O-CA 3.4Å; H71-L122 HydrophobicContact CB-CD2 3.9Å; Y114-L122 CarbonylContact C-O 3.6Å; Y114-L122 WeakPolarHBondContact CA-O 3.48Å; Y114-L122 WeakPolarHBondContact CB-O 3.46Å; Y115-L122 PolarHBondContact N-O 2.75Å; Y115-L122 PolarHBondContact O-N 2.82Å; R117-L122 HydrophobicContact CG-CG 4.43Å
123	I	98.3	Very high	95.8	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	114.3	175.1	-49.4	178.7	0	0	0	106.8	V69 K70 V72 E94 I95 L98 L111 M125	V69-I123 WeakPolarHBondContact CA-O 3.39Å; K70-I123 HydrophobicContact CB-CB 4.27Å; K70-I123 PolarHBondContact N-O 2.91Å; K70-I123 PolarHBondContact O-N 2.78Å; V72-I123 HydrophobicContact CG2-CD1 4.01Å; E94-I123 HydrophobicContact CB-CD1 4.49Å; E94-I123 HydrophobicContact CG-CD1 4.11Å; I95-I123 HydrophobicContact CD1-CD1 4.31Å; I95-I123 HydrophobicContact CD1-CG1 3.98Å; I95-I123 HydrophobicContact CG1-CD1 3.79Å; I95-I123 HydrophobicContact CG1-CG1 3.77Å; I95-I123 HydrophobicContact CG1-CG2 4.41Å; L98-I123 HydrophobicContact CD1-CG2 3.83Å; L111-I123 HydrophobicContact CD1-CG2 3.45Å; L111-I123 VanDerWaalsContact CD1-CG2 3.45Å; I123-M125 HydrophobicContact CG2-CG 4.2Å; I123-M125 HydrophobicContact CG2-SD 4.37Å
124	V	98.5	Very high	95.9	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	119.2	-177.1	-171.5	0	0	0	0	109.1	F37 Y41 V67 A68 L112 D113 Y115	F37-V124 HydrophobicContact CD2-CG2 4.43Å; F37-V124 HydrophobicContact CE2-CG2 4Å; Y41-V124 HydrophobicContact CD1-CG1 4.06Å; Y41-V124 HydrophobicContact CD2-CG2 4.35Å; Y41-V124 HydrophobicContact CE1-CG1 3.66Å; Y41-V124 HydrophobicContact CE2-CG1 4.26Å; Y41-V124 HydrophobicContact CE2-CG2 4.2Å; V67-V124 HydrophobicContact CB-CG1 4Å; V67-V124 HydrophobicContact CG1-CG1 4.24Å; V67-V124 HydrophobicContact CG2-CG1 4.19Å; A68-V124 WeakPolarHBondContact O-CA 3.46Å; L112-V124 HydrophobicContact CB-CG1 4.39Å; L112-V124 PolarHBondContact N-O 3.38Å; D113-V124 HydrophobicContact CB-CB 4.06Å; D113-V124 HydrophobicContact CB-CG2 4.34Å; D113-V124 PolarHBondContact N-O 3.3Å; D113-V124 WeakPolarHBondContact O-CA 3.17Å; D113-V124 WeakPolarHBondContact O-CB 3.25Å; D113-V124 PolarHBondContact O-N 3.38Å; Y115-V124 HydrophobicContact CD2-CG2 4.3Å; Y115-V124 HydrophobicContact CE2-CG2 4.23Å
125	M	98.3	Very high	95.9	Very high	14 Å²	14	49.3 Å²	49.3	7%	0.069	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	157.6	-175.9	-62.9	167.2	-71.2	0	0	110.5	V67 A68 K70 L98 I109 K110 I123	V67-M125 CarbonylContact C-O 3.56Å; V67-M125 VanDerWaalsContact CA-O 3.32Å; V67-M125 WeakPolarHBondContact CA-O 3.16Å; V67-M125 WeakPolarHBondContact CB-O 3.5Å; A68-M125 HydrophobicContact CB-CB 4.5Å; A68-M125 HydrophobicContact CB-CE 4.43Å; A68-M125 PolarHBondContact N-O 3.18Å; A68-M125 PolarHBondContact O-N 2.74Å; K70-M125 HydrophobicContact CB-CE 3.73Å; K70-M125 HydrophobicContact CD-CE 4.47Å; L98-M125 HydrophobicContact CD1-SD 4.19Å; I109-M125 HydrophobicContact CG1-CB 4.15Å; I109-M125 HydrophobicContact CG2-SD 4.15Å; K110-M125 CarbonylContact O-C 3.2Å; K110-M125 VanDerWaalsContact O-CA 3.24Å; K110-M125 WeakPolarHBondContact O-CA 3.43Å; I123-M125 HydrophobicContact CG2-CG 4.2Å; I123-M125 HydrophobicContact CG2-SD 4.37Å
126	E	96.5	Very high	95.9	Very high	52 Å²	52	51.5 Å²	51.5	24%	0.243	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	153.2	166.9	74.2	-179.3	158.4	0	0	110.1	I109 K110 L112 K188	I109-E126 HydrophobicContact CD1-CG 3.46Å; I109-E126 VanDerWaalsContact CD1-CG 3.46Å; I109-E126 WeakPolarHBondContact CD1-O 3.46Å; I109-E126 HydrophobicContact CG1-CG 3.89Å; K110-E126 HydrophobicContact CB-CB 4.32Å; K110-E126 HydrophobicContact CB-CG 3.95Å; K110-E126 PolarHBondContact N-OE1 3.19Å; K110-E126 PolarHBondContact O-N 3.33Å; L112-E126 HydrophobicContact CD1-CB 4.4Å; L112-E126 HydrophobicContact CD2-CB 4.47Å; E126-K188 IonicContact OE1-NZ 3.67Å; E126-K188 PolarHBondContact OE1-NZ 2.89Å; E126-K188 IonicContact OE2-NZ 2.94Å
127	R	96.1	Very high	96	Very high	59 Å²	59	47.3 Å²	47.3	22%	0.223	24%	0.243	C	C	.	.			trans	-138.4	115.5	174.4	-178.9	172.8	58.2	76.5	-1.2	110	G58 P66 V67 A68	G58-R127 PolarHBondContact O-NH2 2.86Å; P66-R127 HydrophobicContact CB-CB 4.49Å; P66-R127 WeakPolarHBondContact CG-O 3.47Å; P66-R127 PolarHBondContact O-N 2.85Å; V67-R127 VanDerWaalsContact C-CB 3.48Å; V67-R127 PolarHBondContact O-NE 3.39Å; A68-R127 HydrophobicContact CB-CB 4.15Å
128	P	93.7	Very high	96.2	Very high	15 Å²	15	42.8 Å²	42.8	10%	0.097	23%	0.226	C	C	.	.			trans	-62.4	146.7	171.7	-13.4	26.6	0	0	0	110.6	V131 K188	P128-V131 HydrophobicContact CB-CB 4.05Å; P128-V131 HydrophobicContact CB-CG2 4.18Å; P128-V131 HydrophobicContact CG-CG2 4.14Å; P128-V131 WeakPolarHBondContact O-CG1 3.42Å; P128-K188 HydrophobicContact CG-CD 3.82Å
129	E	87.1	Confident	96.3	Very high	125 Å²	125	42.2 Å²	42.2	58%	0.584	21%	0.212	S	C	*	.	S	Bend	trans	-75.8	-49.6	-173.4	-71.9	-179.7	-180	0	0	112.9	P66	P66-E129 HydrophobicContact CB-CG 4.47Å; P66-E129 HydrophobicContact CG-CG 3.76Å
130	L	93	Very high	96.4	Very high	107 Å²	107	45.1 Å²	45.1	56%	0.56	22%	0.224	S	C	*	.	S	Bend	trans	-104.1	86.7	177.9	-66.4	178.7	0	0	0	108.3	L182	L130-L182 PolarHBondContact O-N 2.97Å
131	V	95.1	Very high	96.3	Very high	48 Å²	48	52.3 Å²	52.3	29%	0.291	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	148.6	-169.9	72.9	0	0	0	0	111.5	P128 L179 V180	P128-V131 HydrophobicContact CB-CB 4.05Å; P128-V131 HydrophobicContact CB-CG2 4.18Å; P128-V131 HydrophobicContact CG-CG2 4.14Å; P128-V131 WeakPolarHBondContact O-CG1 3.42Å; V131-L179 HydrophobicContact CG2-CB 3.66Å; V131-L179 HydrophobicContact CG2-CD1 4.02Å; V131-L179 HydrophobicContact CG2-CD2 4.14Å; V131-L179 HydrophobicContact CG2-CG 4.15Å; V131-V180 WeakPolarHBondContact CA-O 3.43Å
132	K	95.3	Very high	96.3	Very high	48 Å²	48	53.6 Å²	53.6	21%	0.209	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	144.4	171.8	-170.9	168.5	-70.4	-165.6	0	108.1	D136 F137 E140 L179 V180 L182	K132-D136 HydrophobicContact CD-CB 3.73Å; K132-D136 HydrophobicContact CG-CB 3.52Å; K132-F137 HydrophobicContact CD-CB 4.36Å; K132-E140 IonicContact NZ-OE1 3.45Å; K132-E140 PolarHBondContact NZ-OE1 3.4Å; K132-E140 IonicContact NZ-OE2 3.9Å; K132-E140 PolarHBondContact NZ-OE2 2.97Å; K132-L179 CarbonylContact O-C 3.56Å; K132-V180 PolarHBondContact N-O 2.76Å; K132-V180 PolarHBondContact O-N 3.05Å; K132-L182 HydrophobicContact CB-CD1 4.33Å; K132-L182 HydrophobicContact CB-CD2 4.4Å
133	D	97.3	Very high	96.2	Very high	42 Å²	42	53.7 Å²	53.7	23%	0.225	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	160	167.7	58	60.7	0	0	0	110.8	F135 D136 F137 L178 L179	D133-F135 PolarHBondContact O-N 3.27Å; D133-F135 WeakPolarHBondContact OD1-CB 3.49Å; D133-F135 PolarHBondContact OD1-N 3.15Å; D133-D136 PolarHBondContact O-N 2.85Å; D133-D136 WeakPolarHBondContact OD1-CB 3.44Å; D133-D136 PolarHBondContact OD1-N 2.91Å; D133-F137 WeakPolarHBondContact O-CB 3.28Å; D133-F137 PolarHBondContact O-N 3.18Å; D133-F137 VanDerWaalsContact O-N 3.08Å; D133-L178 CarbonylContact C-O 3.55Å; D133-L178 VanDerWaalsContact CA-O 3.26Å; D133-L178 WeakPolarHBondContact CA-O 3.41Å; D133-L179 HydrophobicContact CB-CD2 4Å
134	L	98.3	Very high	96.2	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-69.7	-26.2	-175.2	-176.3	66	0	0	0	111.3	F137 I138 F152 D175 L178 V180 L236 M240	L134-F137 HydrophobicContact CD1-CB 4.38Å; L134-F137 HydrophobicContact CD1-CD1 4.18Å; L134-F137 WeakPolarHBondContact O-CB 3.44Å; L134-F137 PolarHBondContact O-N 2.73Å; L134-I138 HydrophobicContact CD1-CD1 4.22Å; L134-I138 HydrophobicContact CD1-CG1 4.22Å; L134-I138 HydrophobicContact CD2-CD1 4.3Å; L134-I138 HydrophobicContact CG-CD1 3.81Å; L134-I138 HydrophobicContact CG-CG1 4.24Å; L134-I138 WeakPolarHBondContact O-CB 3.38Å; L134-I138 VanDerWaalsContact O-CG1 3.28Å; L134-I138 WeakPolarHBondContact O-CG1 3.45Å; L134-I138 PolarHBondContact O-N 2.74Å; L134-F152 HydrophobicContact CD1-CD2 3.79Å; L134-F152 HydrophobicContact CD1-CE2 3.83Å; L134-D175 HydrophobicContact CB-CB 4.09Å; L134-D175 WeakPolarHBondContact CB-O 3.31Å; L134-D175 HydrophobicContact CD2-CB 4.21Å; L134-D175 HydrophobicContact CG-CB 4.16Å; L134-D175 PolarHBondContact N-O 3.12Å; L134-L178 HydrophobicContact CB-CB 3.98Å; L134-L178 HydrophobicContact CD2-CB 4.42Å; L134-L178 HydrophobicContact CD2-CD1 3.93Å; L134-L178 PolarHBondContact N-O 3.48Å; L134-V180 HydrophobicContact CB-CG2 4.38Å; L134-V180 HydrophobicContact CD1-CG2 4.02Å; L134-L236 HydrophobicContact CD2-CD1 4.18Å; L134-M240 HydrophobicContact CD2-CE 3.4Å; L134-M240 HydrophobicContact CD2-CG 4.26Å
135	F	97.9	Very high	96.1	Very high	90 Å²	90	58.3 Å²	58.3	40%	0.395	30%	0.297	S	S	.	.	H	α-helix	trans	-61.5	-53.6	174.8	173.8	-88.4	0	0	0	111.1	D133 F137 I138 T139 D175 E176	D133-F135 PolarHBondContact O-N 3.27Å; D133-F135 WeakPolarHBondContact OD1-CB 3.49Å; D133-F135 PolarHBondContact OD1-N 3.15Å; F135-F137 VanDerWaalsContact C-N 3.27Å; F135-F137 PolarHBondContact O-N 3.13Å; F135-I138 PolarHBondContact O-N 3.07Å; F135-T139 VanDerWaalsContact O-CB 3.32Å; F135-T139 WeakPolarHBondContact O-CB 3.37Å; F135-T139 PolarHBondContact O-N 3.31Å; F135-T139 PolarHBondContact O-OG1 3.35Å; F135-D175 WeakPolarHBondContact CA-OD2 3.33Å; F135-D175 HydrophobicContact CB-CB 4.31Å; F135-D175 WeakPolarHBondContact CB-OD2 3.4Å; F135-D175 VanDerWaalsContact CD2-OD2 3.25Å; F135-D175 WeakPolarHBondContact CD2-OD2 3.45Å; F135-E176 HydrophobicContact CB-CG 3.92Å; F135-E176 HydrophobicContact CD2-CG 4.27Å; F135-E176 HydrophobicContact CG-CG 4.14Å
136	D	97.4	Very high	96.1	Very high	70 Å²	70	59.6 Å²	59.6	37%	0.374	30%	0.303	S	S	.	.	H	α-helix	trans	-63.7	-36.3	177	-83.7	-9.6	0	0	0	110.8	K132 D133 T139 E140	K132-D136 HydrophobicContact CD-CB 3.73Å; K132-D136 HydrophobicContact CG-CB 3.52Å; D133-D136 PolarHBondContact O-N 2.85Å; D133-D136 WeakPolarHBondContact OD1-CB 3.44Å; D133-D136 PolarHBondContact OD1-N 2.91Å; D136-T139 PolarHBondContact O-N 2.97Å; D136-E140 WeakPolarHBondContact O-CB 3.49Å; D136-E140 WeakPolarHBondContact O-CG 3.24Å; D136-E140 PolarHBondContact O-N 2.88Å
137	F	97.8	Very high	96.1	Very high	31 Å²	31	61.9 Å²	61.9	14%	0.136	32%	0.317	C	S	.	.	H	α-helix	trans	-61.7	-47.2	176	-172.8	-85	0	0	0	112	K132 D133 L134 F135 K141 L144 F152 L182	K132-F137 HydrophobicContact CD-CB 4.36Å; D133-F137 WeakPolarHBondContact O-CB 3.28Å; D133-F137 PolarHBondContact O-N 3.18Å; D133-F137 VanDerWaalsContact O-N 3.08Å; L134-F137 HydrophobicContact CD1-CB 4.38Å; L134-F137 HydrophobicContact CD1-CD1 4.18Å; L134-F137 WeakPolarHBondContact O-CB 3.44Å; L134-F137 PolarHBondContact O-N 2.73Å; F135-F137 VanDerWaalsContact C-N 3.27Å; F135-F137 PolarHBondContact O-N 3.13Å; F137-K141 HydrophobicContact CD1-CG 4.3Å; F137-K141 HydrophobicContact CE1-CG 4.06Å; F137-K141 HydrophobicContact CZ-CG 4.29Å; F137-K141 VanDerWaalsContact O-CB 3.29Å; F137-K141 WeakPolarHBondContact O-CB 3.4Å; F137-K141 VanDerWaalsContact O-CG 3.31Å; F137-K141 WeakPolarHBondContact O-CG 3.3Å; F137-K141 PolarHBondContact O-N 3.03Å; F137-L144 HydrophobicContact CD1-CD2 3.97Å; F137-L144 HydrophobicContact CE1-CD1 4.44Å; F137-L144 HydrophobicContact CE1-CD2 3.64Å; F137-F152 HydrophobicContact CD1-CE2 4.24Å; F137-F152 AromaticContact CE1-CE2 3.84Å; F137-F152 HydrophobicContact CE1-CE2 3.84Å; F137-F152 HydrophobicContact CE1-CZ 4.34Å; F137-F152 HydrophobicContact CZ-CE2 4.22Å; F137-F152 HydrophobicContact CZ-CZ 4.26Å; F137-L182 HydrophobicContact CD2-CD2 3.95Å; F137-L182 HydrophobicContact CE2-CD2 4.02Å
138	I	97.9	Very high	96.2	Very high	5 Å²	5	61.4 Å²	61.4	3%	0.026	32%	0.32	C	S	.	.	H	α-helix	trans	-68.9	-40.3	177.1	-69.1	168.8	0	0	0	110.5	L134 F135 E140 K141 G142 L144 D175 D239 M240	L134-I138 HydrophobicContact CD1-CD1 4.22Å; L134-I138 HydrophobicContact CD1-CG1 4.22Å; L134-I138 HydrophobicContact CD2-CD1 4.3Å; L134-I138 HydrophobicContact CG-CD1 3.81Å; L134-I138 HydrophobicContact CG-CG1 4.24Å; L134-I138 WeakPolarHBondContact O-CB 3.38Å; L134-I138 VanDerWaalsContact O-CG1 3.28Å; L134-I138 WeakPolarHBondContact O-CG1 3.45Å; L134-I138 PolarHBondContact O-N 2.74Å; F135-I138 PolarHBondContact O-N 3.07Å; I138-E140 VanDerWaalsContact C-N 3.29Å; I138-E140 PolarHBondContact O-N 3.47Å; I138-K141 PolarHBondContact O-N 2.86Å; I138-G142 CarbonylContact O-C 3.55Å; I138-G142 WeakPolarHBondContact O-CA 3.46Å; I138-G142 PolarHBondContact O-N 2.93Å; I138-L144 HydrophobicContact CG1-CD1 4.28Å; I138-L144 HydrophobicContact CG1-CD2 4.41Å; I138-L144 HydrophobicContact CG1-CG 4.29Å; I138-D175 HydrophobicContact CD1-CB 4.48Å; I138-D239 WeakPolarHBondContact CD1-OD2 3.46Å; I138-M240 HydrophobicContact CD1-CG 4.27Å
139	T	97.1	Very high	96.4	Very high	92 Å²	92	60.7 Å²	60.7	56%	0.564	32%	0.316	S	S	*	.	H	α-helix	trans	-58.1	-41.8	177.8	-64.9	0	0	0	0	111.6	F135 D136	F135-T139 VanDerWaalsContact O-CB 3.32Å; F135-T139 WeakPolarHBondContact O-CB 3.37Å; F135-T139 PolarHBondContact O-N 3.31Å; F135-T139 PolarHBondContact O-OG1 3.35Å; D136-T139 PolarHBondContact O-N 2.97Å
140	E	96.4	Very high	96.9	Very high	132 Å²	132	55.7 Å²	55.7	62%	0.617	29%	0.291	S	S	*	.	H	α-helix	trans	-78.6	-38.7	179.2	-72.9	178.8	-173.1	0	0	113.8	K132 D136 I138	K132-E140 IonicContact NZ-OE1 3.45Å; K132-E140 PolarHBondContact NZ-OE1 3.4Å; K132-E140 IonicContact NZ-OE2 3.9Å; K132-E140 PolarHBondContact NZ-OE2 2.97Å; D136-E140 WeakPolarHBondContact O-CB 3.49Å; D136-E140 WeakPolarHBondContact O-CG 3.24Å; D136-E140 PolarHBondContact O-N 2.88Å; I138-E140 VanDerWaalsContact C-N 3.29Å; I138-E140 PolarHBondContact O-N 3.47Å
141	K	95	Very high	97.1	Very high	151 Å²	151	52.2 Å²	52.2	66%	0.657	28%	0.281	S	S	*	.	H	α-helix	trans	-84.9	-21.6	-176.7	-69.6	-71.5	-175.8	174.9	0	113.2	F137 I138 L144	F137-K141 HydrophobicContact CD1-CG 4.3Å; F137-K141 HydrophobicContact CE1-CG 4.06Å; F137-K141 HydrophobicContact CZ-CG 4.29Å; F137-K141 VanDerWaalsContact O-CB 3.29Å; F137-K141 WeakPolarHBondContact O-CB 3.4Å; F137-K141 VanDerWaalsContact O-CG 3.31Å; F137-K141 WeakPolarHBondContact O-CG 3.3Å; F137-K141 PolarHBondContact O-N 3.03Å; I138-K141 PolarHBondContact O-N 2.86Å; K141-L144 HydrophobicContact CB-CD2 4.24Å
142	G	96.4	Very high	97.3	Very high	32 Å²	32	50.7 Å²	50.7	33%	0.33	27%	0.271	S	S	.	.			trans	69.1	-168.4	-158.1	0	0	0	0	0	111.2	I138 L144	I138-G142 CarbonylContact O-C 3.55Å; I138-G142 WeakPolarHBondContact O-CA 3.46Å; I138-G142 PolarHBondContact O-N 2.93Å; G142-L144 PolarHBondContact O-N 3.24Å
143	A	97.4	Very high	97.5	Very high	14 Å²	14	48.4 Å²	48.4	12%	0.116	26%	0.261	C	S	.	.	S	Bend	trans	-61.5	138.3	179.9	0	0	0	0	0	112.7	V241 R262	A143-V241 VanDerWaalsContact CB-C 3.42Å; A143-V241 VanDerWaalsContact CB-O 3.23Å; A143-V241 WeakPolarHBondContact CB-O 3.48Å; A143-R262 PolarHBondContact O-NH1 3.2Å
144	L	97.9	Very high	97.5	Very high	13 Å²	13	48.5 Å²	48.5	7%	0.068	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-74.1	151	-175.2	-49.9	-176.3	0	0	0	110.6	F137 I138 K141 G142 T148 A149 F152 M240	F137-L144 HydrophobicContact CD1-CD2 3.97Å; F137-L144 HydrophobicContact CE1-CD1 4.44Å; F137-L144 HydrophobicContact CE1-CD2 3.64Å; I138-L144 HydrophobicContact CG1-CD1 4.28Å; I138-L144 HydrophobicContact CG1-CD2 4.41Å; I138-L144 HydrophobicContact CG1-CG 4.29Å; K141-L144 HydrophobicContact CB-CD2 4.24Å; G142-L144 PolarHBondContact O-N 3.24Å; L144-T148 HydrophobicContact CB-CG2 4.49Å; L144-T148 HydrophobicContact CD1-CG2 4.26Å; L144-A149 HydrophobicContact CB-CB 4.31Å; L144-F152 HydrophobicContact CD1-CD2 3.9Å; L144-F152 HydrophobicContact CD1-CE2 4.14Å; L144-M240 WeakPolarHBondContact CB-O 3.4Å; L144-M240 HydrophobicContact CD1-CB 4.25Å; L144-M240 HydrophobicContact CD1-CG 4.39Å; L144-M240 WeakPolarHBondContact CG-O 2.94Å; L144-M240 PolarHBondContact N-O 2.81Å
145	D	97.3	Very high	97.5	Very high	85 Å²	85	50.8 Å²	50.8	46%	0.455	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-66.1	155.3	163.7	65.9	91.2	0	0	0	110.1	D147 T148 A149	D145-D147 PolarHBondContact O-N 2.9Å; D145-D147 WeakPolarHBondContact OD1-CB 3.38Å; D145-D147 PolarHBondContact OD1-N 2.89Å; D145-D147 VanDerWaalsContact OD1-N 3.16Å; D145-T148 VanDerWaalsContact CG-OG1 3.32Å; D145-T148 PolarHBondContact O-N 3.28Å; D145-T148 PolarHBondContact OD1-N 3.16Å; D145-T148 PolarHBondContact OD1-OG1 2.82Å; D145-T148 WeakPolarHBondContact OD2-CB 3.36Å; D145-T148 PolarHBondContact OD2-OG1 3.06Å; D145-A149 WeakPolarHBondContact O-CB 3.47Å; D145-A149 PolarHBondContact O-N 3.2Å
146	E	97.9	Very high	97.6	Very high	41 Å²	41	46.6 Å²	46.6	19%	0.192	26%	0.257	C	S	.	.	H	α-helix	trans	-66	-24.3	-173.5	-71.3	-175.6	-136.6	0	0	113.5	R150 I264 S265 C268 W294	E146-R150 WeakPolarHBondContact O-CB 3.39Å; E146-R150 PolarHBondContact O-N 2.9Å; E146-I264 VanDerWaalsContact OE1-CA 3.3Å; E146-I264 WeakPolarHBondContact OE1-CA 3.25Å; E146-I264 WeakPolarHBondContact OE1-CB 3.45Å; E146-S265 PolarHBondContact OE1-N 2.91Å; E146-S265 PolarHBondContact OE1-OG 3.25Å; E146-S265 VanDerWaalsContact OE2-CB 3.32Å; E146-S265 WeakPolarHBondContact OE2-CB 3.17Å; E146-S265 PolarHBondContact OE2-OG 2.66Å; E146-C268 WeakPolarHBondContact OE2-CB 3.42Å; E146-W294 HydrophobicContact CB-CZ2 4.18Å; E146-W294 HydrophobicContact CG-CZ2 4.46Å; E146-W294 PolarHBondContact OE2-NE1 3.33Å
147	D	96.6	Very high	97.7	Very high	100 Å²	100	43.3 Å²	43.3	54%	0.535	24%	0.239	S	C	.	.	H	α-helix	trans	-74.2	-45.6	178.6	-62.9	-25.5	0	0	0	110.6	D145 R150 G151	D145-D147 PolarHBondContact O-N 2.9Å; D145-D147 WeakPolarHBondContact OD1-CB 3.38Å; D145-D147 PolarHBondContact OD1-N 2.89Å; D145-D147 VanDerWaalsContact OD1-N 3.16Å; D147-R150 PolarHBondContact O-N 3.38Å; D147-R150 IonicContact OD1-CZ 3.61Å; D147-R150 IonicContact OD1-NH1 3.59Å; D147-R150 PolarHBondContact OD1-NH1 3.41Å; D147-R150 IonicContact OD1-NH2 2.74Å; D147-R150 PolarHBondContact OD1-NH2 3.35Å; D147-G151 PolarHBondContact O-N 2.91Å
148	T	96.7	Very high	97.7	Very high	48 Å²	48	47.1 Å²	47.1	29%	0.294	26%	0.258	S	S	.	.	H	α-helix	trans	-59.8	-49	171.1	-59.3	0	0	0	0	111	L144 D145 R150 G151 F152	L144-T148 HydrophobicContact CB-CG2 4.49Å; L144-T148 HydrophobicContact CD1-CG2 4.26Å; D145-T148 VanDerWaalsContact CG-OG1 3.32Å; D145-T148 PolarHBondContact O-N 3.28Å; D145-T148 PolarHBondContact OD1-N 3.16Å; D145-T148 PolarHBondContact OD1-OG1 2.82Å; D145-T148 WeakPolarHBondContact OD2-CB 3.36Å; D145-T148 PolarHBondContact OD2-OG1 3.06Å; T148-R150 VanDerWaalsContact C-N 3.32Å; T148-R150 PolarHBondContact O-N 3.3Å; T148-G151 PolarHBondContact O-N 3.06Å; T148-F152 HydrophobicContact CG2-CD2 4.24Å; T148-F152 HydrophobicContact CG2-CE2 3.97Å; T148-F152 HydrophobicContact CG2-CZ 4.3Å; T148-F152 PolarHBondContact O-N 2.87Å
149	A	98.3	Very high	97.7	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.5	-41	179.2	0	0	0	0	0	111.7	L144 D145 F152 F153 M240 V241 W294	L144-A149 HydrophobicContact CB-CB 4.31Å; D145-A149 WeakPolarHBondContact O-CB 3.47Å; D145-A149 PolarHBondContact O-N 3.2Å; A149-F152 PolarHBondContact O-N 2.78Å; A149-F153 WeakPolarHBondContact O-CB 3.26Å; A149-F153 PolarHBondContact O-N 2.89Å; A149-M240 HydrophobicContact CB-CB 4.08Å; A149-V241 HydrophobicContact CB-CG1 3.64Å; A149-W294 HydrophobicContact CB-CH2 4.35Å
150	R	98.3	Very high	97.8	Very high	21 Å²	21	42.8 Å²	42.8	8%	0.079	23%	0.231	C	C	.	.	H	α-helix	trans	-64.3	-45.8	176.2	-172.4	-172.3	-50.7	103.8	11.7	111.6	E146 D147 T148 F152 F153 C154 W294 M295	E146-R150 WeakPolarHBondContact O-CB 3.39Å; E146-R150 PolarHBondContact O-N 2.9Å; D147-R150 PolarHBondContact O-N 3.38Å; D147-R150 IonicContact OD1-CZ 3.61Å; D147-R150 IonicContact OD1-NH1 3.59Å; D147-R150 PolarHBondContact OD1-NH1 3.41Å; D147-R150 IonicContact OD1-NH2 2.74Å; D147-R150 PolarHBondContact OD1-NH2 3.35Å; T148-R150 VanDerWaalsContact C-N 3.32Å; T148-R150 PolarHBondContact O-N 3.3Å; R150-F152 VanDerWaalsContact C-N 3.31Å; R150-F152 PolarHBondContact O-N 3.15Å; R150-F153 PolarHBondContact O-N 3.13Å; R150-C154 WeakPolarHBondContact O-CB 3.47Å; R150-C154 PolarHBondContact O-N 3.5Å; R150-C154 PolarHBondContact O-SG 3.29Å; R150-W294 VanDerWaalsContact CA-CH2 3.49Å; R150-W294 HydrophobicContact CB-CH2 3.71Å; R150-W294 HydrophobicContact CB-CZ2 4.02Å; R150-W294 HydrophobicContact CB-CZ3 4.09Å; R150-W294 VanDerWaalsContact CD-O 3.28Å; R150-W294 WeakPolarHBondContact CD-O 3.39Å; R150-W294 HydrophobicContact CG-CE3 4.48Å; R150-W294 HydrophobicContact CG-CH2 4.3Å; R150-W294 HydrophobicContact CG-CZ3 4.18Å; R150-W294 PolarHBondContact NE-O 3.33Å; R150-M295 HydrophobicContact CG-SD 4.39Å
151	G	97.8	Very high	97.9	Very high	34 Å²	34	42 Å²	42	35%	0.351	22%	0.222	S	C	.	.	H	α-helix	trans	-58.2	-43	177.2	0	0	0	0	0	112.5	D147 T148 Q155	D147-G151 PolarHBondContact O-N 2.91Å; T148-G151 PolarHBondContact O-N 3.06Å; G151-Q155 WeakPolarHBondContact O-CG 3.48Å; G151-Q155 PolarHBondContact O-N 3.09Å; G151-Q155 PolarHBondContact O-NE2 3.45Å
152	F	98.6	Very high	98.1	Very high	16 Å²	16	35.9 Å²	35.9	7%	0.07	20%	0.196	C	C	.	.	H	α-helix	trans	-67.8	-48.4	173.6	-75.8	-9	0	0	0	112.4	L134 F137 L144 T148 A149 R150 C154 Q155 V156 V180 L187 M240	L134-F152 HydrophobicContact CD1-CD2 3.79Å; L134-F152 HydrophobicContact CD1-CE2 3.83Å; F137-F152 HydrophobicContact CD1-CE2 4.24Å; F137-F152 AromaticContact CE1-CE2 3.84Å; F137-F152 HydrophobicContact CE1-CE2 3.84Å; F137-F152 HydrophobicContact CE1-CZ 4.34Å; F137-F152 HydrophobicContact CZ-CE2 4.22Å; F137-F152 HydrophobicContact CZ-CZ 4.26Å; L144-F152 HydrophobicContact CD1-CD2 3.9Å; L144-F152 HydrophobicContact CD1-CE2 4.14Å; T148-F152 HydrophobicContact CG2-CD2 4.24Å; T148-F152 HydrophobicContact CG2-CE2 3.97Å; T148-F152 HydrophobicContact CG2-CZ 4.3Å; T148-F152 PolarHBondContact O-N 2.87Å; A149-F152 PolarHBondContact O-N 2.78Å; R150-F152 VanDerWaalsContact C-N 3.31Å; R150-F152 PolarHBondContact O-N 3.15Å; F152-C154 VanDerWaalsContact C-N 3.3Å; F152-C154 PolarHBondContact O-N 3.31Å; F152-Q155 PolarHBondContact O-N 3.04Å; F152-V156 WeakPolarHBondContact O-CG2 3.23Å; F152-V156 PolarHBondContact O-N 3.22Å; F152-V180 HydrophobicContact CE1-CG1 4.28Å; F152-V180 HydrophobicContact CE2-CG2 4.45Å; F152-V180 HydrophobicContact CZ-CG1 3.87Å; F152-V180 HydrophobicContact CZ-CG2 4.31Å; F152-L187 HydrophobicContact CB-CD1 3.62Å; F152-L187 HydrophobicContact CD1-CD1 3.95Å; F152-L187 HydrophobicContact CD1-CG 4.05Å; F152-L187 HydrophobicContact CG-CD1 3.85Å; F152-L187 HydrophobicContact CG-CG 4.37Å; F152-L187 WeakPolarHBondContact O-CD1 3.42Å; F152-M240 HydrophobicContact CB-CE 4.12Å; F152-M240 HydrophobicContact CB-SD 4.44Å
153	F	98.8	Very high	98.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.5	-36.4	-178.3	-163.8	-113.8	0	0	0	112.4	A149 R150 Q155 V156 L157 L233 L237 M240 L271 I289 W294 M295	A149-F153 WeakPolarHBondContact O-CB 3.26Å; A149-F153 PolarHBondContact O-N 2.89Å; R150-F153 PolarHBondContact O-N 3.13Å; F153-Q155 PolarHBondContact O-N 3.14Å; F153-V156 PolarHBondContact O-N 2.87Å; F153-L157 HydrophobicContact CD1-CD1 3.86Å; F153-L157 HydrophobicContact CD1-CG 4.31Å; F153-L157 HydrophobicContact CE1-CD1 3.88Å; F153-L157 HydrophobicContact CE1-CD2 4.3Å; F153-L157 HydrophobicContact CE1-CG 4.22Å; F153-L157 HydrophobicContact CZ-CD2 4.37Å; F153-L157 VanDerWaalsContact O-CG 3.26Å; F153-L157 WeakPolarHBondContact O-CG 3.2Å; F153-L157 PolarHBondContact O-N 2.96Å; F153-L233 HydrophobicContact CE2-CB 4.02Å; F153-L233 HydrophobicContact CE2-CD2 3.95Å; F153-L233 WeakPolarHBondContact CE2-O 3.31Å; F153-L233 HydrophobicContact CZ-CB 3.99Å; F153-L233 HydrophobicContact CZ-CD2 4.4Å; F153-L237 HydrophobicContact CB-CD1 4.41Å; F153-L237 HydrophobicContact CD1-CD1 4.46Å; F153-L237 HydrophobicContact CD1-CD2 4.33Å; F153-L237 HydrophobicContact CD2-CB 4.06Å; F153-L237 HydrophobicContact CD2-CD1 4.31Å; F153-L237 HydrophobicContact CE1-CD2 4.05Å; F153-L237 HydrophobicContact CE2-CB 3.77Å; F153-L237 HydrophobicContact CG-CD1 4.16Å; F153-L237 HydrophobicContact CZ-CB 4.08Å; F153-L237 HydrophobicContact CZ-CD2 4.2Å; F153-M240 HydrophobicContact CB-SD 4.38Å; F153-M240 HydrophobicContact CD2-SD 4.47Å; F153-L271 HydrophobicContact CE1-CD2 4.32Å; F153-I289 HydrophobicContact CE1-CG2 3.77Å; F153-W294 HydrophobicContact CB-CZ3 4.44Å; F153-W294 HydrophobicContact CD1-CZ3 4.13Å; F153-M295 HydrophobicContact CD1-CE 4.01Å; F153-M295 HydrophobicContact CD1-SD 3.73Å; F153-M295 HydrophobicContact CE1-SD 4.33Å
154	C	98.4	Very high	98.2	Very high	44 Å²	44	35.3 Å²	35.3	30%	0.297	18%	0.182	S	C	.	.	H	α-helix	trans	-53.5	-51.5	169.3	-77.2	0	0	0	0	111.9	R150 F152 V156 L157 E158 M295	R150-C154 WeakPolarHBondContact O-CB 3.47Å; R150-C154 PolarHBondContact O-N 3.5Å; R150-C154 PolarHBondContact O-SG 3.29Å; F152-C154 VanDerWaalsContact C-N 3.3Å; F152-C154 PolarHBondContact O-N 3.31Å; C154-V156 VanDerWaalsContact C-N 3.34Å; C154-V156 PolarHBondContact O-N 2.69Å; C154-L157 WeakPolarHBondContact O-CB 3.19Å; C154-L157 PolarHBondContact O-N 2.8Å; C154-E158 WeakPolarHBondContact O-CG 3.46Å; C154-E158 PolarHBondContact O-N 3.44Å; C154-M295 HydrophobicContact CB-CE 4.34Å; C154-M295 WeakPolarHBondContact SG-CE 3.42Å
155	Q	98.6	Very high	98.3	Very high	48 Å²	48	39 Å²	39	22%	0.224	21%	0.209	C	C	.	.	H	α-helix	trans	-65.2	-37.1	-179.3	-65.9	-179	63.1	0	0	112.1	G151 F152 F153 E158 A159 G185 E186 L187	G151-Q155 WeakPolarHBondContact O-CG 3.48Å; G151-Q155 PolarHBondContact O-N 3.09Å; G151-Q155 PolarHBondContact O-NE2 3.45Å; F152-Q155 PolarHBondContact O-N 3.04Å; F153-Q155 PolarHBondContact O-N 3.14Å; Q155-E158 PolarHBondContact O-N 2.8Å; Q155-A159 PolarHBondContact O-N 2.72Å; Q155-G185 PolarHBondContact NE2-O 3.21Å; Q155-E186 VanDerWaalsContact OE1-CA 3.27Å; Q155-L187 HydrophobicContact CB-CB 4.12Å; Q155-L187 HydrophobicContact CB-CD1 4.32Å
156	V	98.8	Very high	98.3	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.012	20%	0.196	C	C	.	.	H	α-helix	trans	-61.5	-46.3	173.7	178.8	0	0	0	0	110.5	F152 F153 C154 E158 A159 V160 I173 L178 L187 L233 L236 M240	F152-V156 WeakPolarHBondContact O-CG2 3.23Å; F152-V156 PolarHBondContact O-N 3.22Å; F153-V156 PolarHBondContact O-N 2.87Å; C154-V156 VanDerWaalsContact C-N 3.34Å; C154-V156 PolarHBondContact O-N 2.69Å; V156-E158 VanDerWaalsContact C-N 3.32Å; V156-E158 PolarHBondContact O-N 3.49Å; V156-A159 PolarHBondContact O-N 2.76Å; V156-A159 VanDerWaalsContact O-N 3.16Å; V156-V160 HydrophobicContact CG1-CG2 4.38Å; V156-V160 WeakPolarHBondContact O-CG2 3.36Å; V156-V160 PolarHBondContact O-N 2.69Å; V156-I173 HydrophobicContact CG1-CG2 4.27Å; V156-L178 HydrophobicContact CG2-CD1 3.66Å; V156-L178 HydrophobicContact CG2-CD2 3.91Å; V156-L178 HydrophobicContact CG2-CG 4.47Å; V156-L187 HydrophobicContact CG2-CD1 3.75Å; V156-L233 HydrophobicContact CG1-CD2 3.6Å; V156-L236 HydrophobicContact CG1-CD2 4.02Å; V156-L236 HydrophobicContact CG2-CD2 4.27Å; V156-M240 HydrophobicContact CG2-CE 4.35Å
157	L	98.7	Very high	98.3	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-60.5	-41.7	178	-68	167.2	0	0	0	111.7	F153 C154 V160 R161 L233 L286 I289 M295	F153-L157 HydrophobicContact CD1-CD1 3.86Å; F153-L157 HydrophobicContact CD1-CG 4.31Å; F153-L157 HydrophobicContact CE1-CD1 3.88Å; F153-L157 HydrophobicContact CE1-CD2 4.3Å; F153-L157 HydrophobicContact CE1-CG 4.22Å; F153-L157 HydrophobicContact CZ-CD2 4.37Å; F153-L157 VanDerWaalsContact O-CG 3.26Å; F153-L157 WeakPolarHBondContact O-CG 3.2Å; F153-L157 PolarHBondContact O-N 2.96Å; C154-L157 WeakPolarHBondContact O-CB 3.19Å; C154-L157 PolarHBondContact O-N 2.8Å; L157-V160 PolarHBondContact O-N 3.49Å; L157-R161 WeakPolarHBondContact O-CB 3.33Å; L157-R161 VanDerWaalsContact O-CG 3.25Å; L157-R161 WeakPolarHBondContact O-CG 3.41Å; L157-R161 PolarHBondContact O-N 3.49Å; L157-L233 HydrophobicContact CD2-CD1 3.84Å; L157-L233 HydrophobicContact CD2-CD2 4.46Å; L157-L286 HydrophobicContact CD2-CD2 4.01Å; L157-I289 HydrophobicContact CD1-CG2 3.59Å; L157-I289 HydrophobicContact CD2-CB 4.49Å; L157-I289 HydrophobicContact CD2-CD1 4.38Å; L157-I289 HydrophobicContact CD2-CG2 3.91Å; L157-I289 HydrophobicContact CG-CG2 4.4Å; L157-M295 HydrophobicContact CD1-CE 3.53Å
158	E	98.6	Very high	98.4	Very high	111 Å²	111	30.6 Å²	30.6	52%	0.519	17%	0.172	S	C	.	.	H	α-helix	trans	-60.9	-43.4	174.4	-70.1	176.1	173.8	0	0	111.9	F105 C154 Q155 V156 R161 H162	F105-E158 HydrophobicContact CE2-CB 4.3Å; F105-E158 HydrophobicContact CZ-CB 4.01Å; C154-E158 WeakPolarHBondContact O-CG 3.46Å; C154-E158 PolarHBondContact O-N 3.44Å; Q155-E158 PolarHBondContact O-N 2.8Å; V156-E158 VanDerWaalsContact C-N 3.32Å; V156-E158 PolarHBondContact O-N 3.49Å; E158-R161 PolarHBondContact O-N 2.83Å; E158-H162 WeakPolarHBondContact O-CB 3.3Å; E158-H162 PolarHBondContact O-N 3.28Å
159	A	98.7	Very high	98.5	Very high	2 Å²	2	28.4 Å²	28.4	2%	0.017	16%	0.159	C	C	.	.	H	α-helix	trans	-64.1	-41.2	177	0	0	0	0	0	112.8	F105 G107 V108 Q155 V156 H162 C163 L189	F105-A159 HydrophobicContact CE1-CB 3.99Å; F105-A159 HydrophobicContact CZ-CB 4.34Å; G107-A159 WeakPolarHBondContact O-CB 3.49Å; V108-A159 HydrophobicContact CG2-CB 4.2Å; Q155-A159 PolarHBondContact O-N 2.72Å; V156-A159 PolarHBondContact O-N 2.76Å; V156-A159 VanDerWaalsContact O-N 3.16Å; A159-H162 PolarHBondContact O-N 3.24Å; A159-C163 PolarHBondContact O-N 3.26Å; A159-C163 PolarHBondContact O-SG 3.48Å; A159-L189 HydrophobicContact CB-CB 4.3Å
160	V	98.8	Very high	98.5	Very high	3 Å²	3	28.5 Å²	28.5	2%	0.018	16%	0.159	C	C	.	.	H	α-helix	trans	-65.4	-44.5	175.5	176.7	0	0	0	0	111	V156 L157 H162 C163 Y164 I173 T229 L233 L286	V156-V160 HydrophobicContact CG1-CG2 4.38Å; V156-V160 WeakPolarHBondContact O-CG2 3.36Å; V156-V160 PolarHBondContact O-N 2.69Å; L157-V160 PolarHBondContact O-N 3.49Å; V160-H162 VanDerWaalsContact C-N 3.3Å; V160-H162 PolarHBondContact O-N 2.92Å; V160-C163 WeakPolarHBondContact O-CB 3.16Å; V160-C163 PolarHBondContact O-N 3.26Å; V160-Y164 HydrophobicContact CG1-CD1 4.44Å; V160-Y164 HydrophobicContact CG1-CD2 4.37Å; V160-Y164 HydrophobicContact CG1-CE1 4.03Å; V160-Y164 HydrophobicContact CG1-CE2 3.97Å; V160-Y164 PolarHBondContact O-N 3.5Å; V160-I173 HydrophobicContact CG2-CD1 3.5Å; V160-I173 HydrophobicContact CG2-CG1 4.42Å; V160-T229 HydrophobicContact CG1-CG2 3.72Å; V160-L233 HydrophobicContact CG2-CD2 4.45Å; V160-L286 HydrophobicContact CB-CD1 4.45Å; V160-L286 HydrophobicContact CG1-CD1 3.77Å
161	R	98.5	Very high	98.5	Very high	115 Å²	115	28.3 Å²	28.3	43%	0.434	16%	0.158	S	C	.	.	H	α-helix	trans	-59.5	-42.7	175.8	-74.7	175.4	67.8	150.7	3.1	111.4	L157 E158 Y164 S165 L286	L157-R161 WeakPolarHBondContact O-CB 3.33Å; L157-R161 VanDerWaalsContact O-CG 3.25Å; L157-R161 WeakPolarHBondContact O-CG 3.41Å; L157-R161 PolarHBondContact O-N 3.49Å; E158-R161 PolarHBondContact O-N 2.83Å; R161-Y164 PolarHBondContact O-N 3.48Å; R161-S165 PolarHBondContact O-N 2.98Å; R161-L286 HydrophobicContact CG-CB 4.39Å; R161-L286 HydrophobicContact CG-CD1 3.75Å
162	H	98.7	Very high	98.6	Very high	23 Å²	23	26.8 Å²	26.8	11%	0.106	14%	0.142	C	C	.	.	H	α-helix	trans	-59.2	-50.1	174.2	175.3	59.2	0	0	0	111.3	V101 S103 F105 E158 A159 V160 Y164 S165 C166	V101-H162 PolarHBondContact O-NE2 3.4Å; S103-H162 PolarHBondContact OG-CE1 3.41Å; F105-H162 HydrophobicContact CD1-CB 3.76Å; F105-H162 AromaticContact CD1-CD2 3.34Å; F105-H162 WeakPolarHBondContact CD1-CD2 3.5Å; F105-H162 AromaticContact CD1-CG 3.48Å; F105-H162 VanDerWaalsContact CD1-CG 3.48Å; F105-H162 HydrophobicContact CD2-CB 4.27Å; F105-H162 HydrophobicContact CE1-CB 3.83Å; F105-H162 HydrophobicContact CE2-CB 4.34Å; F105-H162 HydrophobicContact CG-CB 3.99Å; F105-H162 AromaticContact CG-CD2 3.78Å; F105-H162 AromaticContact CG-CG 3.58Å; F105-H162 AromaticContact CG-ND1 3.95Å; F105-H162 HydrophobicContact CZ-CB 4.13Å; E158-H162 WeakPolarHBondContact O-CB 3.3Å; E158-H162 PolarHBondContact O-N 3.28Å; A159-H162 PolarHBondContact O-N 3.24Å; V160-H162 VanDerWaalsContact C-N 3.3Å; V160-H162 PolarHBondContact O-N 2.92Å; H162-Y164 VanDerWaalsContact C-N 3.32Å; H162-Y164 PolarHBondContact O-N 2.97Å; H162-S165 WeakPolarHBondContact O-CB 3.07Å; H162-S165 PolarHBondContact O-N 3.41Å; H162-S165 VanDerWaalsContact O-N 3.1Å; H162-S165 PolarHBondContact O-OG 3.05Å; H162-C166 PolarHBondContact CE1-SG 3.24Å; H162-C166 PolarHBondContact O-N 3.05Å; H162-C166 VanDerWaalsContact O-N 3.1Å; H162-C166 PolarHBondContact O-SG 3.34Å
163	C	98.8	Very high	98.6	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.014	14%	0.139	C	C	.	.	H	α-helix	trans	-55	-46.3	176.3	-67.3	0	0	0	0	112.3	V101 A159 V160 S165 C166 G167 V168	V101-C163 HydrophobicContact CG1-CB 4.41Å; A159-C163 PolarHBondContact O-N 3.26Å; A159-C163 PolarHBondContact O-SG 3.48Å; V160-C163 WeakPolarHBondContact O-CB 3.16Å; V160-C163 PolarHBondContact O-N 3.26Å; C163-S165 VanDerWaalsContact C-N 3.35Å; C163-S165 PolarHBondContact O-N 2.88Å; C163-C166 CarbonylContact O-C 3.58Å; C163-C166 WeakPolarHBondContact O-CB 3.47Å; C163-C166 PolarHBondContact O-N 2.82Å; C163-C166 VanDerWaalsContact O-N 3.12Å; C163-G167 PolarHBondContact O-N 3.34Å; C163-V168 CarbonylContact C-O 3.41Å; C163-V168 HydrophobicContact CB-CB 4.48Å; C163-V168 PolarHBondContact O-N 3.23Å; C163-V168 VanDerWaalsContact O-O 3.09Å
164	Y	98.5	Very high	98.5	Very high	32 Å²	32	26.8 Å²	26.8	13%	0.125	14%	0.142	C	C	.	.	H	α-helix	trans	-62.8	-40.7	177.7	-72.5	-1.6	0	0	0	112.4	V160 R161 H162 C166 G167 V168 V169 L198 R226 T229 L286	V160-Y164 HydrophobicContact CG1-CD1 4.44Å; V160-Y164 HydrophobicContact CG1-CD2 4.37Å; V160-Y164 HydrophobicContact CG1-CE1 4.03Å; V160-Y164 HydrophobicContact CG1-CE2 3.97Å; V160-Y164 PolarHBondContact O-N 3.5Å; R161-Y164 PolarHBondContact O-N 3.48Å; H162-Y164 VanDerWaalsContact C-N 3.32Å; H162-Y164 PolarHBondContact O-N 2.97Å; Y164-C166 PolarHBondContact O-N 2.9Å; Y164-G167 WeakPolarHBondContact O-CA 3.11Å; Y164-G167 PolarHBondContact O-N 3.36Å; Y164-V168 WeakPolarHBondContact CD1-O 3.23Å; Y164-V168 PolarHBondContact N-O 3.31Å; Y164-V169 HydrophobicContact CE1-CB 4.37Å; Y164-V169 HydrophobicContact CE1-CG2 4.15Å; Y164-L198 HydrophobicContact CD1-CD1 4.49Å; Y164-L198 HydrophobicContact CD1-CD2 4.07Å; Y164-L198 HydrophobicContact CE1-CD1 4.48Å; Y164-L198 HydrophobicContact CG-CD2 4.11Å; Y164-R226 HydrophobicContact CE2-CG 3.92Å; Y164-R226 WeakPolarHBondContact OH-CA 3.25Å; Y164-T229 WeakPolarHBondContact OH-CB 3.48Å; Y164-T229 WeakPolarHBondContact OH-CG2 3.22Å; Y164-T229 PolarHBondContact OH-OG1 2.93Å; Y164-L286 HydrophobicContact CD2-CD1 3.75Å; Y164-L286 HydrophobicContact CE2-CD1 3.6Å; Y164-L286 HydrophobicContact CE2-CG 4.39Å
165	S	98.2	Very high	98.5	Very high	92 Å²	92	25 Å²	25	64%	0.643	13%	0.13	S	C	*	.	H	α-helix	trans	-61.8	-28.6	176.1	82.5	0	0	0	0	112.5	R161 H162 C163 G167	R161-S165 PolarHBondContact O-N 2.98Å; H162-S165 WeakPolarHBondContact O-CB 3.07Å; H162-S165 PolarHBondContact O-N 3.41Å; H162-S165 VanDerWaalsContact O-N 3.1Å; H162-S165 PolarHBondContact O-OG 3.05Å; C163-S165 VanDerWaalsContact C-N 3.35Å; C163-S165 PolarHBondContact O-N 2.88Å; S165-G167 VanDerWaalsContact C-N 3.31Å
166	C	98.3	Very high	98.5	Very high	27 Å²	27	27 Å²	27	18%	0.182	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-0.1	174.1	-62.4	0	0	0	0	113.4	K100 V101 H162 C163 Y164 V168	K100-C166 WeakPolarHBondContact CE-O 3.19Å; K100-C166 PolarHBondContact NZ-O 3.46Å; K100-C166 PolarHBondContact O-SG 2.91Å; K100-C166 VanDerWaalsContact O-SG 3.4Å; V101-C166 HydrophobicContact CG1-CB 4Å; H162-C166 PolarHBondContact CE1-SG 3.24Å; H162-C166 PolarHBondContact O-N 3.05Å; H162-C166 VanDerWaalsContact O-N 3.1Å; H162-C166 PolarHBondContact O-SG 3.34Å; C163-C166 CarbonylContact O-C 3.58Å; C163-C166 WeakPolarHBondContact O-CB 3.47Å; C163-C166 PolarHBondContact O-N 2.82Å; C163-C166 VanDerWaalsContact O-N 3.12Å; Y164-C166 PolarHBondContact O-N 2.9Å; C166-V168 HydrophobicContact CB-CG2 4.48Å
167	G	98.3	Very high	98.5	Very high	22 Å²	22	27.4 Å²	27.4	23%	0.227	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.8	33.2	-176.4	0	0	0	0	0	113.3	C163 Y164 S165 L198	C163-G167 PolarHBondContact O-N 3.34Å; Y164-G167 WeakPolarHBondContact O-CA 3.11Å; Y164-G167 PolarHBondContact O-N 3.36Å; S165-G167 VanDerWaalsContact C-N 3.31Å; G167-L198 PolarHBondContact O-N 2.87Å
168	V	98.8	Very high	98.5	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	136.1	-179.9	176.2	0	0	0	0	109.9	L97 K100 V101 C163 Y164 C166 F192	L97-V168 HydrophobicContact CB-CG1 4.17Å; L97-V168 HydrophobicContact CD1-CG1 4.45Å; L97-V168 HydrophobicContact CD2-CG1 4.12Å; L97-V168 HydrophobicContact CD2-CG2 3.99Å; L97-V168 HydrophobicContact CG-CG1 4.46Å; K100-V168 HydrophobicContact CB-CG2 3.92Å; K100-V168 HydrophobicContact CD-CG2 4.17Å; V101-V168 HydrophobicContact CG1-CB 3.86Å; V101-V168 HydrophobicContact CG1-CG1 4.14Å; V101-V168 HydrophobicContact CG1-CG2 3.8Å; C163-V168 CarbonylContact C-O 3.41Å; C163-V168 HydrophobicContact CB-CB 4.48Å; C163-V168 PolarHBondContact O-N 3.23Å; C163-V168 VanDerWaalsContact O-O 3.09Å; Y164-V168 WeakPolarHBondContact CD1-O 3.23Å; Y164-V168 PolarHBondContact N-O 3.31Å; C166-V168 HydrophobicContact CB-CG2 4.48Å; V168-F192 HydrophobicContact CG1-CD1 3.82Å; V168-F192 HydrophobicContact CG1-CE1 3.77Å
169	V	98.6	Very high	98.4	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.006	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	128.8	167.7	59.5	0	0	0	0	108.8	Y164 R171 G195 A196 L198 Y203	Y164-V169 HydrophobicContact CE1-CB 4.37Å; Y164-V169 HydrophobicContact CE1-CG2 4.15Å; V169-R171 HydrophobicContact CG1-CG 4.02Å; V169-R171 HydrophobicContact CG2-CG 4.07Å; V169-G195 CarbonylContact O-C 3.51Å; V169-G195 VanDerWaalsContact O-CA 3.31Å; V169-G195 WeakPolarHBondContact O-CA 3.19Å; V169-A196 HydrophobicContact CG1-CB 3.9Å; V169-A196 WeakPolarHBondContact CG1-O 3.43Å; V169-A196 PolarHBondContact N-O 2.67Å; V169-A196 PolarHBondContact O-N 2.96Å; V169-L198 HydrophobicContact CB-CD1 4.09Å; V169-Y203 HydrophobicContact CG1-CE1 4.4Å; V169-Y203 WeakPolarHBondContact CG1-OH 3.39Å
170	H	98.7	Very high	98.4	Very high	3 Å²	3	23.5 Å²	23.5	1%	0.014	12%	0.123	C	C	.	.			trans	-72.9	-38.6	-174.2	-165	-87.7	0	0	0	113.6	D172 I173 L189 I190 D191 F192 G195	H170-D172 PolarHBondContact CE1-O 3.47Å; H170-D172 VanDerWaalsContact ND1-C 3.3Å; H170-D172 PolarHBondContact ND1-N 3.01Å; H170-D172 PolarHBondContact ND1-O 3.47Å; H170-D172 PolarHBondContact O-N 3.45Å; H170-I173 HydrophobicContact CB-CD1 4.19Å; H170-I173 HydrophobicContact CB-CG1 3.95Å; H170-L189 HydrophobicContact CB-CD2 4.49Å; H170-I190 PolarHBondContact CE1-O 3.12Å; H170-I190 VanDerWaalsContact CE1-O 3.31Å; H170-I190 PolarHBondContact NE2-O 3.45Å; H170-D191 PolarHBondContact CE1-O 3.28Å; H170-D191 PolarHBondContact NE2-O 2.97Å; H170-F192 AromaticContact CD2-CD1 3.86Å; H170-F192 AromaticContact CD2-CE1 3.67Å; H170-F192 AromaticContact CD2-CE2 3.92Å; H170-F192 AromaticContact CD2-CZ 3.69Å; H170-G195 VanDerWaalsContact O-CA 3.31Å; H170-G195 WeakPolarHBondContact O-CA 3.47Å; H170-G195 PolarHBondContact O-N 3.34Å
171	R	98.3	Very high	98.3	Very high	16 Å²	16	24 Å²	24	6%	0.06	13%	0.126	C	C	.	.	S	Bend	trans	61.3	-11	-178	-54.1	-163.4	-73.6	178.7	-0.1	117.3	E79 V169 S194 G195 D205 F206 Y223	E79-R171 IonicContact OE1-NH2 3.89Å; E79-R171 PolarHBondContact OE1-NH2 3.41Å; V169-R171 HydrophobicContact CG1-CG 4.02Å; V169-R171 HydrophobicContact CG2-CG 4.07Å; R171-S194 WeakPolarHBondContact CB-O 3.1Å; R171-S194 PolarHBondContact NE-O 2.73Å; R171-S194 PolarHBondContact NH2-O 3.06Å; R171-S194 VanDerWaalsContact NH2-O 3.08Å; R171-G195 PolarHBondContact NH2-O 2.91Å; R171-D205 IonicContact CZ-OD2 3.92Å; R171-D205 PolarHBondContact NH1-O 2.9Å; R171-D205 IonicContact NH1-OD2 2.63Å; R171-D205 PolarHBondContact NH1-OD2 3.39Å; R171-D205 IonicContact NH2-OD2 2.63Å; R171-F206 WeakPolarHBondContact O-CE2 3.42Å; R171-Y223 WeakPolarHBondContact CD-OH 3.46Å; R171-Y223 PolarHBondContact NH1-OH 2.86Å
172	D	98.2	Very high	98.1	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.011	13%	0.127	C	C	.	.			trans	-131.9	53.7	177	-161.8	35.5	0	0	0	112.6	H170 K174 N177 T209	H170-D172 PolarHBondContact CE1-O 3.47Å; H170-D172 VanDerWaalsContact ND1-C 3.3Å; H170-D172 PolarHBondContact ND1-N 3.01Å; H170-D172 PolarHBondContact ND1-O 3.47Å; H170-D172 PolarHBondContact O-N 3.45Å; D172-K174 PolarHBondContact O-N 3.27Å; D172-K174 VanDerWaalsContact OD2-CE 3.3Å; D172-K174 WeakPolarHBondContact OD2-CE 3.45Å; D172-K174 IonicContact OD2-NZ 3.9Å; D172-N177 PolarHBondContact O-ND2 3.31Å; D172-N177 PolarHBondContact OD2-ND2 3.44Å; D172-T209 WeakPolarHBondContact OD1-CB 3.09Å; D172-T209 PolarHBondContact OD1-N 3.25Å; D172-T209 PolarHBondContact OD1-OG1 2.94Å; D172-T209 PolarHBondContact OD2-OG1 2.66Å
173	I	98.7	Very high	97.8	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.01	15%	0.152	C	C	.	.			trans	-79.6	116.5	176.3	-67.7	155	0	0	0	108.5	V156 V160 H170 Y212 T229 L233 L236	V156-I173 HydrophobicContact CG1-CG2 4.27Å; V160-I173 HydrophobicContact CG2-CD1 3.5Å; V160-I173 HydrophobicContact CG2-CG1 4.42Å; H170-I173 HydrophobicContact CB-CD1 4.19Å; H170-I173 HydrophobicContact CB-CG1 3.95Å; I173-Y212 WeakPolarHBondContact O-CD1 3.32Å; I173-T229 HydrophobicContact CD1-CG2 3.48Å; I173-T229 VanDerWaalsContact CD1-CG2 3.48Å; I173-L233 HydrophobicContact CG2-CD2 4.17Å; I173-L236 HydrophobicContact CG2-CD2 3.95Å
174	K	98.5	Very high	97.5	Very high	15 Å²	15	32.8 Å²	32.8	7%	0.065	17%	0.172	C	C	.	.	S	Bend	trans	-158.4	167.6	179.3	56.5	175.6	179.7	169.5	0	109.5	D172 E176 N177 L178 T209 Y212	D172-K174 PolarHBondContact O-N 3.27Å; D172-K174 VanDerWaalsContact OD2-CE 3.3Å; D172-K174 WeakPolarHBondContact OD2-CE 3.45Å; D172-K174 IonicContact OD2-NZ 3.9Å; K174-E176 HydrophobicContact CD-CB 4.11Å; K174-E176 HydrophobicContact CD-CG 4.47Å; K174-E176 WeakPolarHBondContact CD-OE1 3.12Å; K174-E176 WeakPolarHBondContact CE-OE1 3.46Å; K174-E176 HydrophobicContact CG-CB 4.28Å; K174-E176 IonicContact NZ-OE1 3.39Å; K174-E176 PolarHBondContact NZ-OE1 3.39Å; K174-E176 IonicContact NZ-OE2 2.78Å; K174-E176 PolarHBondContact O-N 3.28Å; K174-N177 WeakPolarHBondContact CE-ND2 3.41Å; K174-N177 HydrophobicContact CG-CB 4.13Å; K174-N177 PolarHBondContact O-N 2.8Å; K174-N177 VanDerWaalsContact O-N 3.12Å; K174-L178 WeakPolarHBondContact O-CG 3.35Å; K174-T209 HydrophobicContact CD-CG2 4.25Å; K174-T209 WeakPolarHBondContact CD-OG1 3.49Å; K174-T209 WeakPolarHBondContact CE-OG1 3.3Å; K174-T209 PolarHBondContact NZ-OG1 3.08Å; K174-Y212 HydrophobicContact CB-CD1 4.05Å; K174-Y212 HydrophobicContact CB-CD2 3.89Å; K174-Y212 HydrophobicContact CB-CE1 3.75Å; K174-Y212 HydrophobicContact CB-CE2 3.56Å; K174-Y212 HydrophobicContact CB-CG 4.13Å; K174-Y212 VanDerWaalsContact CB-CZ 3.48Å; K174-Y212 HydrophobicContact CD-CE2 4.48Å
175	D	98.4	Very high	97.3	Very high	7 Å²	7	32.7 Å²	32.7	4%	0.037	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-56.6	-42.1	177.1	56.8	-25.2	0	0	0	113.6	L134 F135 I138 N177 L178 Y212 L236	L134-D175 HydrophobicContact CB-CB 4.09Å; L134-D175 WeakPolarHBondContact CB-O 3.31Å; L134-D175 HydrophobicContact CD2-CB 4.21Å; L134-D175 HydrophobicContact CG-CB 4.16Å; L134-D175 PolarHBondContact N-O 3.12Å; F135-D175 WeakPolarHBondContact CA-OD2 3.33Å; F135-D175 HydrophobicContact CB-CB 4.31Å; F135-D175 WeakPolarHBondContact CB-OD2 3.4Å; F135-D175 VanDerWaalsContact CD2-OD2 3.25Å; F135-D175 WeakPolarHBondContact CD2-OD2 3.45Å; I138-D175 HydrophobicContact CD1-CB 4.48Å; D175-N177 PolarHBondContact O-N 2.98Å; D175-N177 VanDerWaalsContact O-N 3.15Å; D175-L178 PolarHBondContact O-N 2.86Å; D175-L178 VanDerWaalsContact O-N 3.13Å; D175-Y212 PolarHBondContact OD1-OH 2.72Å; D175-L236 HydrophobicContact CB-CD1 4.03Å
176	E	97.6	Very high	97.2	Very high	90 Å²	90	30.8 Å²	30.8	42%	0.421	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-59.2	-27.4	175.2	-64.1	173.3	-91.7	0	0	113.4	F135 K174	F135-E176 HydrophobicContact CB-CG 3.92Å; F135-E176 HydrophobicContact CD2-CG 4.27Å; F135-E176 HydrophobicContact CG-CG 4.14Å; K174-E176 HydrophobicContact CD-CB 4.11Å; K174-E176 HydrophobicContact CD-CG 4.47Å; K174-E176 WeakPolarHBondContact CD-OE1 3.12Å; K174-E176 WeakPolarHBondContact CE-OE1 3.46Å; K174-E176 HydrophobicContact CG-CB 4.28Å; K174-E176 IonicContact NZ-OE1 3.39Å; K174-E176 PolarHBondContact NZ-OE1 3.39Å; K174-E176 IonicContact NZ-OE2 2.78Å; K174-E176 PolarHBondContact O-N 3.28Å
177	N	98.3	Very high	97.1	Very high	10 Å²	10	29.7 Å²	29.7	5%	0.053	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-98	17.4	-177.8	-72.1	-20.7	0	0	0	112.9	D172 K174 D175 I190	D172-N177 PolarHBondContact O-ND2 3.31Å; D172-N177 PolarHBondContact OD2-ND2 3.44Å; K174-N177 WeakPolarHBondContact CE-ND2 3.41Å; K174-N177 HydrophobicContact CG-CB 4.13Å; K174-N177 PolarHBondContact O-N 2.8Å; K174-N177 VanDerWaalsContact O-N 3.12Å; D175-N177 PolarHBondContact O-N 2.98Å; D175-N177 VanDerWaalsContact O-N 3.15Å; N177-I190 VanDerWaalsContact C-CG1 3.45Å; N177-I190 HydrophobicContact CB-CG1 4.3Å; N177-I190 VanDerWaalsContact O-CG1 3.24Å; N177-I190 WeakPolarHBondContact O-CG1 3.26Å; N177-I190 PolarHBondContact O-N 3.4Å
178	L	98.6	Very high	97.1	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	113	178.8	-72.7	169.1	0	0	0	109.9	D133 L134 V156 K174 D175 L187 L189 L236	D133-L178 CarbonylContact C-O 3.55Å; D133-L178 VanDerWaalsContact CA-O 3.26Å; D133-L178 WeakPolarHBondContact CA-O 3.41Å; L134-L178 HydrophobicContact CB-CB 3.98Å; L134-L178 HydrophobicContact CD2-CB 4.42Å; L134-L178 HydrophobicContact CD2-CD1 3.93Å; L134-L178 PolarHBondContact N-O 3.48Å; V156-L178 HydrophobicContact CG2-CD1 3.66Å; V156-L178 HydrophobicContact CG2-CD2 3.91Å; V156-L178 HydrophobicContact CG2-CG 4.47Å; K174-L178 WeakPolarHBondContact O-CG 3.35Å; D175-L178 PolarHBondContact O-N 2.86Å; D175-L178 VanDerWaalsContact O-N 3.13Å; L178-L187 HydrophobicContact CB-CD2 4.23Å; L178-L189 HydrophobicContact CD2-CB 4.34Å; L178-L189 HydrophobicContact CD2-CD1 4.01Å; L178-L236 HydrophobicContact CD1-CD1 4.16Å; L178-L236 HydrophobicContact CD1-CD2 3.61Å
179	L	98.3	Very high	97.1	Very high	28 Å²	28	29.7 Å²	29.7	15%	0.147	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	130.3	175	-65	-175.3	0	0	0	111	I109 V131 K132 D133 L187 K188 I190	I109-L179 HydrophobicContact CD1-CD1 4.48Å; V131-L179 HydrophobicContact CG2-CB 3.66Å; V131-L179 HydrophobicContact CG2-CD1 4.02Å; V131-L179 HydrophobicContact CG2-CD2 4.14Å; V131-L179 HydrophobicContact CG2-CG 4.15Å; K132-L179 CarbonylContact O-C 3.56Å; D133-L179 HydrophobicContact CB-CD2 4Å; L179-L187 CarbonylContact O-C 3.43Å; L179-L187 VanDerWaalsContact O-CA 3.27Å; L179-L187 WeakPolarHBondContact O-CA 3.41Å; L179-L187 WeakPolarHBondContact O-CD2 3.34Å; L179-K188 HydrophobicContact CB-CB 4.31Å; L179-K188 PolarHBondContact N-O 2.89Å; L179-K188 PolarHBondContact O-N 3.32Å; L179-I190 HydrophobicContact CD1-CD1 4.42Å; L179-I190 HydrophobicContact CD1-CG2 3.61Å; L179-I190 HydrophobicContact CD2-CD1 4.06Å; L179-I190 HydrophobicContact CG-CD1 4Å; L179-I190 HydrophobicContact CG-CG1 4.32Å; L179-I190 HydrophobicContact CG-CG2 3.79Å
180	V	97.8	Very high	97.1	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.012	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	116.5	171.8	-171.4	0	0	0	0	108.9	V131 K132 L134 F152 L182 L187	V131-V180 WeakPolarHBondContact CA-O 3.43Å; K132-V180 PolarHBondContact N-O 2.76Å; K132-V180 PolarHBondContact O-N 3.05Å; L134-V180 HydrophobicContact CB-CG2 4.38Å; L134-V180 HydrophobicContact CD1-CG2 4.02Å; F152-V180 HydrophobicContact CE1-CG1 4.28Å; F152-V180 HydrophobicContact CE2-CG2 4.45Å; F152-V180 HydrophobicContact CZ-CG1 3.87Å; F152-V180 HydrophobicContact CZ-CG2 4.31Å; V180-L182 HydrophobicContact CB-CD2 4.38Å; V180-L182 HydrophobicContact CG1-CD2 4.06Å; V180-L182 PolarHBondContact O-N 3.4Å; V180-L187 HydrophobicContact CB-CD2 4.32Å; V180-L187 HydrophobicContact CG2-CD2 3.58Å
181	D	95.6	Very high	96.9	Very high	14 Å²	14	32.5 Å²	32.5	8%	0.075	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	109.3	164.1	-177	-40.4	0	0	0	108.4	R183 T184 G185 E186	D181-R183 PolarHBondContact O-N 2.97Å; D181-R183 WeakPolarHBondContact OD1-CA 3.34Å; D181-R183 WeakPolarHBondContact OD1-CB 3.43Å; D181-R183 PolarHBondContact OD1-N 3.39Å; D181-T184 WeakPolarHBondContact CB-OG1 3.18Å; D181-T184 VanDerWaalsContact CG-OG1 3.31Å; D181-T184 PolarHBondContact O-N 3.16Å; D181-T184 PolarHBondContact OD1-N 3.36Å; D181-T184 VanDerWaalsContact OD1-N 3.16Å; D181-G185 WeakPolarHBondContact O-CA 3.45Å; D181-G185 PolarHBondContact O-N 2.92Å; D181-E186 PolarHBondContact N-O 3.05Å
182	L	94.8	Very high	96.9	Very high	87 Å²	87	31.8 Å²	31.8	46%	0.455	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-13.2	-172.8	-60.5	179.2	0	0	0	113.3	L130 K132 F137 V180	L130-L182 PolarHBondContact O-N 2.97Å; K132-L182 HydrophobicContact CB-CD1 4.33Å; K132-L182 HydrophobicContact CB-CD2 4.4Å; F137-L182 HydrophobicContact CD2-CD2 3.95Å; F137-L182 HydrophobicContact CE2-CD2 4.02Å; V180-L182 HydrophobicContact CB-CD2 4.38Å; V180-L182 HydrophobicContact CG1-CD2 4.06Å; V180-L182 PolarHBondContact O-N 3.4Å
183	R	92.4	Very high	96.8	Very high	166 Å²	166	32.9 Å²	32.9	63%	0.626	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-38.3	176.9	178	-179.4	58.3	-164.6	-6.9	111.3	D181	D181-R183 PolarHBondContact O-N 2.97Å; D181-R183 WeakPolarHBondContact OD1-CA 3.34Å; D181-R183 WeakPolarHBondContact OD1-CB 3.43Å; D181-R183 PolarHBondContact OD1-N 3.39Å
184	T	93.3	Very high	96.7	Very high	72 Å²	72	32.8 Å²	32.8	44%	0.442	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-21.3	-174.3	63.9	0	0	0	0	113.6	D181 E186	D181-T184 WeakPolarHBondContact CB-OG1 3.18Å; D181-T184 VanDerWaalsContact CG-OG1 3.31Å; D181-T184 PolarHBondContact O-N 3.16Å; D181-T184 PolarHBondContact OD1-N 3.36Å; D181-T184 VanDerWaalsContact OD1-N 3.16Å; T184-E186 PolarHBondContact O-N 3.01Å; T184-E186 WeakPolarHBondContact OG1-CB 3.36Å; T184-E186 WeakPolarHBondContact OG1-CG 3.41Å; T184-E186 PolarHBondContact OG1-N 3.04Å
185	G	93	Very high	96.6	Very high	30 Å²	30	32.1 Å²	32.1	31%	0.309	17%	0.169	S	C	.	.			trans	73	11.1	-169.1	0	0	0	0	0	113.5	Q155 D181	Q155-G185 PolarHBondContact NE2-O 3.21Å; D181-G185 WeakPolarHBondContact O-CA 3.45Å; D181-G185 PolarHBondContact O-N 2.92Å
186	E	96.1	Very high	96.6	Very high	52 Å²	52	32.1 Å²	32.1	24%	0.243	17%	0.17	C	C	.	.			trans	-78.1	135.3	177.3	-68.3	-172.9	145.6	0	0	111.1	R106 Q155 D181 T184	R106-E186 IonicContact CZ-OE1 3.81Å; R106-E186 IonicContact NE-OE1 3.48Å; R106-E186 PolarHBondContact NE-OE1 3.45Å; R106-E186 IonicContact NE-OE2 2.99Å; R106-E186 IonicContact NH2-OE1 2.67Å; R106-E186 PolarHBondContact NH2-OE1 3.03Å; Q155-E186 VanDerWaalsContact OE1-CA 3.27Å; D181-E186 PolarHBondContact N-O 3.05Å; T184-E186 PolarHBondContact O-N 3.01Å; T184-E186 WeakPolarHBondContact OG1-CB 3.36Å; T184-E186 WeakPolarHBondContact OG1-CG 3.41Å; T184-E186 PolarHBondContact OG1-N 3.04Å
187	L	97.6	Very high	96.6	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.021	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	144.6	171.9	-81.6	177.5	0	0	0	111.6	G107 F152 Q155 V156 L178 L179 V180	G107-L187 WeakPolarHBondContact CA-O 3.44Å; F152-L187 HydrophobicContact CB-CD1 3.62Å; F152-L187 HydrophobicContact CD1-CD1 3.95Å; F152-L187 HydrophobicContact CD1-CG 4.05Å; F152-L187 HydrophobicContact CG-CD1 3.85Å; F152-L187 HydrophobicContact CG-CG 4.37Å; F152-L187 WeakPolarHBondContact O-CD1 3.42Å; Q155-L187 HydrophobicContact CB-CB 4.12Å; Q155-L187 HydrophobicContact CB-CD1 4.32Å; V156-L187 HydrophobicContact CG2-CD1 3.75Å; L178-L187 HydrophobicContact CB-CD2 4.23Å; L179-L187 CarbonylContact O-C 3.43Å; L179-L187 VanDerWaalsContact O-CA 3.27Å; L179-L187 WeakPolarHBondContact O-CA 3.41Å; L179-L187 WeakPolarHBondContact O-CD2 3.34Å; V180-L187 HydrophobicContact CB-CD2 4.32Å; V180-L187 HydrophobicContact CG2-CD2 3.58Å
188	K	98.1	Very high	96.6	Very high	18 Å²	18	32.4 Å²	32.4	8%	0.078	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	119.2	172.8	-72.1	178	172.2	-73.9	0	110.6	R106 I109 E126 P128 L179	R106-K188 WeakPolarHBondContact O-CG 3.37Å; R106-K188 PolarHBondContact O-NZ 3.36Å; I109-K188 HydrophobicContact CD1-CD 4.03Å; E126-K188 IonicContact OE1-NZ 3.67Å; E126-K188 PolarHBondContact OE1-NZ 2.89Å; E126-K188 IonicContact OE2-NZ 2.94Å; P128-K188 HydrophobicContact CG-CD 3.82Å; L179-K188 HydrophobicContact CB-CB 4.31Å; L179-K188 PolarHBondContact N-O 2.89Å; L179-K188 PolarHBondContact O-N 3.32Å
189	L	98.6	Very high	96.6	Very high	3 Å²	3	36 Å²	36	2%	0.016	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	129.7	170	-176.1	63.3	0	0	0	110.3	G107 V108 I109 A159 H170 L178 F192	G107-L189 PolarHBondContact O-N 3.48Å; V108-L189 HydrophobicContact CG2-CB 4.31Å; I109-L189 PolarHBondContact N-O 3.42Å; A159-L189 HydrophobicContact CB-CB 4.3Å; H170-L189 HydrophobicContact CB-CD2 4.49Å; L178-L189 HydrophobicContact CD2-CB 4.34Å; L178-L189 HydrophobicContact CD2-CD1 4.01Å; L189-F192 HydrophobicContact CD2-CZ 4.25Å
190	I	97.9	Very high	96.5	Very high	35 Å²	35	40.4 Å²	40.4	18%	0.179	21%	0.213	C	C	.	.			trans	-123.9	171.4	179.3	58.6	160.4	0	0	0	111.1	I109 H170 N177 L179	I109-I190 HydrophobicContact CB-CG2 3.7Å; I109-I190 HydrophobicContact CD1-CG2 4.19Å; I109-I190 HydrophobicContact CG1-CG2 4Å; I109-I190 HydrophobicContact CG2-CB 4.32Å; I109-I190 HydrophobicContact CG2-CG2 3.9Å; H170-I190 PolarHBondContact CE1-O 3.12Å; H170-I190 VanDerWaalsContact CE1-O 3.31Å; H170-I190 PolarHBondContact NE2-O 3.45Å; N177-I190 VanDerWaalsContact C-CG1 3.45Å; N177-I190 HydrophobicContact CB-CG1 4.3Å; N177-I190 VanDerWaalsContact O-CG1 3.24Å; N177-I190 WeakPolarHBondContact O-CG1 3.26Å; N177-I190 PolarHBondContact O-N 3.4Å; L179-I190 HydrophobicContact CD1-CD1 4.42Å; L179-I190 HydrophobicContact CD1-CG2 3.61Å; L179-I190 HydrophobicContact CD2-CD1 4.06Å; L179-I190 HydrophobicContact CG-CD1 4Å; L179-I190 HydrophobicContact CG-CG1 4.32Å; L179-I190 HydrophobicContact CG-CG2 3.79Å
191	D	95.8	Very high	96.5	Very high	28 Å²	28	44.7 Å²	44.7	15%	0.15	24%	0.239	C	C	.	.			trans	60.1	85.8	173	-152.2	-25.9	0	0	0	116.2	F52 K70 H170 G193	F52-D191 WeakPolarHBondContact CD2-OD2 3.48Å; K70-D191 VanDerWaalsContact NZ-CG 3.25Å; K70-D191 IonicContact NZ-OD1 3.46Å; K70-D191 PolarHBondContact NZ-OD1 3.27Å; K70-D191 IonicContact NZ-OD2 2.68Å; K70-D191 PolarHBondContact NZ-OD2 3.36Å; K70-D191 VanDerWaalsContact NZ-OD2 3.07Å; H170-D191 PolarHBondContact CE1-O 3.28Å; H170-D191 PolarHBondContact NE2-O 2.97Å; D191-G193 PolarHBondContact O-N 3.26Å; D191-G193 WeakPolarHBondContact OD1-CA 3.22Å; D191-G193 PolarHBondContact OD1-N 2.64Å
192	F	97.2	Very high	96.6	Very high	1 Å²	1	45.9 Å²	45.9	0%	0.004	25%	0.246	C	C	.	.			trans	-90.5	18	174.2	-72.1	-106.7	0	0	0	112.2	E94 L97 L98 V101 V108 V168 H170 L189 S194 G195	E94-F192 HydrophobicContact CG-CB 4.18Å; L97-F192 HydrophobicContact CB-CB 4.21Å; L97-F192 HydrophobicContact CB-CD1 4.14Å; L97-F192 HydrophobicContact CD1-CB 4.48Å; L98-F192 HydrophobicContact CD2-CD2 3.48Å; L98-F192 VanDerWaalsContact CD2-CD2 3.48Å; L98-F192 HydrophobicContact CD2-CE2 3.95Å; L98-F192 HydrophobicContact CD2-CG 4.17Å; L98-F192 HydrophobicContact CG-CB 4.25Å; L98-F192 HydrophobicContact CG-CD2 4.11Å; L98-F192 HydrophobicContact CG-CG 4.35Å; V101-F192 HydrophobicContact CG1-CE1 4.09Å; V101-F192 HydrophobicContact CG1-CZ 4.44Å; V101-F192 HydrophobicContact CG2-CE1 4.04Å; V101-F192 HydrophobicContact CG2-CE2 4.27Å; V101-F192 HydrophobicContact CG2-CZ 3.81Å; V108-F192 HydrophobicContact CG1-CE2 3.64Å; V108-F192 HydrophobicContact CG1-CZ 3.62Å; V168-F192 HydrophobicContact CG1-CD1 3.82Å; V168-F192 HydrophobicContact CG1-CE1 3.77Å; H170-F192 AromaticContact CD2-CD1 3.86Å; H170-F192 AromaticContact CD2-CE1 3.67Å; H170-F192 AromaticContact CD2-CE2 3.92Å; H170-F192 AromaticContact CD2-CZ 3.69Å; L189-F192 HydrophobicContact CD2-CZ 4.25Å; F192-S194 VanDerWaalsContact C-N 3.28Å; F192-S194 PolarHBondContact O-N 3.17Å; F192-G195 PolarHBondContact O-N 3.39Å
193	G	95.9	Very high	96.8	Very high	25 Å²	25	41.9 Å²	41.9	26%	0.258	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-36.4	-177.9	0	0	0	0	0	113.3	D191	D191-G193 PolarHBondContact O-N 3.26Å; D191-G193 WeakPolarHBondContact OD1-CA 3.22Å; D191-G193 PolarHBondContact OD1-N 2.64Å
194	S	96.4	Very high	97.1	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.007	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	2.9	173.5	-50.2	0	0	0	0	113.2	F52 R171 F192 D207	F52-S194 WeakPolarHBondContact CE1-OG 3.17Å; F52-S194 WeakPolarHBondContact CZ-OG 3.46Å; R171-S194 WeakPolarHBondContact CB-O 3.1Å; R171-S194 PolarHBondContact NE-O 2.73Å; R171-S194 PolarHBondContact NH2-O 3.06Å; R171-S194 VanDerWaalsContact NH2-O 3.08Å; F192-S194 VanDerWaalsContact C-N 3.28Å; F192-S194 PolarHBondContact O-N 3.17Å; S194-D207 WeakPolarHBondContact CB-O 3.13Å; S194-D207 PolarHBondContact OG-O 3.32Å
195	G	97.4	Very high	97.2	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.01	22%	0.215	C	C	.	.			trans	-68.4	171	-174.2	0	0	0	0	0	113.6	V169 H170 R171 F192	V169-G195 CarbonylContact O-C 3.51Å; V169-G195 VanDerWaalsContact O-CA 3.31Å; V169-G195 WeakPolarHBondContact O-CA 3.19Å; H170-G195 VanDerWaalsContact O-CA 3.31Å; H170-G195 WeakPolarHBondContact O-CA 3.47Å; H170-G195 PolarHBondContact O-N 3.34Å; R171-G195 PolarHBondContact NH2-O 2.91Å; F192-G195 PolarHBondContact O-N 3.39Å
196	A	98.1	Very high	97.3	Very high	7 Å²	7	37.4 Å²	37.4	6%	0.058	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	167.9	171.3	0	0	0	0	0	112.1	V169 L198 Y203	V169-A196 HydrophobicContact CG1-CB 3.9Å; V169-A196 WeakPolarHBondContact CG1-O 3.43Å; V169-A196 PolarHBondContact N-O 2.67Å; V169-A196 PolarHBondContact O-N 2.96Å; A196-L198 PolarHBondContact O-N 3.09Å; A196-Y203 HydrophobicContact CB-CE1 3.85Å
197	I	98.1	Very high	97	Very high	78 Å²	78	38.9 Å²	38.9	40%	0.4	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	129.3	164.5	-58.2	-61.8	0	0	0	108.4	L97 K100 K199 Y203	L97-I197 HydrophobicContact CD2-CD1 3.65Å; L97-I197 HydrophobicContact CD2-CG1 4.38Å; K100-I197 HydrophobicContact CD-CD1 3.92Å; I197-K199 PolarHBondContact O-N 3.27Å; I197-Y203 PolarHBondContact O-OH 2.9Å
198	L	98.3	Very high	96.9	Very high	27 Å²	27	39.4 Å²	39.4	14%	0.141	22%	0.223	C	C	.	.			trans	-65.4	127.2	177.8	-179.9	64.2	0	0	0	109.8	Y164 G167 V169 A196 Y203	Y164-L198 HydrophobicContact CD1-CD1 4.49Å; Y164-L198 HydrophobicContact CD1-CD2 4.07Å; Y164-L198 HydrophobicContact CE1-CD1 4.48Å; Y164-L198 HydrophobicContact CG-CD2 4.11Å; G167-L198 PolarHBondContact O-N 2.87Å; V169-L198 HydrophobicContact CB-CD1 4.09Å; A196-L198 PolarHBondContact O-N 3.09Å; L198-Y203 WeakPolarHBondContact CA-OH 3.49Å
199	K	97.9	Very high	96.9	Very high	77 Å²	77	40 Å²	40	34%	0.335	23%	0.228	S	C	.	.			trans	-137	155.3	174.5	77.3	-161.4	-176.2	-177.4	0	110.2	I197 T201 V202 Y203	I197-K199 PolarHBondContact O-N 3.27Å; K199-T201 VanDerWaalsContact C-N 3.33Å; K199-T201 WeakPolarHBondContact CD-OG1 3.49Å; K199-T201 WeakPolarHBondContact CE-O 3.49Å; K199-T201 WeakPolarHBondContact CE-OG1 3.47Å; K199-T201 WeakPolarHBondContact CG-O 3.43Å; K199-T201 WeakPolarHBondContact CG-OG1 3.39Å; K199-V202 WeakPolarHBondContact CE-O 3.38Å; K199-V202 PolarHBondContact NZ-O 3.47Å; K199-V202 VanDerWaalsContact NZ-O 3.11Å; K199-Y203 HydrophobicContact CD-CD1 4.49Å; K199-Y203 HydrophobicContact CD-CE1 3.99Å; K199-Y203 HydrophobicContact CD-CE2 4.22Å; K199-Y203 HydrophobicContact CG-CD2 4.48Å; K199-Y203 HydrophobicContact CG-CE1 4.25Å; K199-Y203 HydrophobicContact CG-CE2 3.71Å; K199-Y203 PolarHBondContact N-OH 3.49Å
200	D	96.7	Very high	96.9	Very high	121 Å²	121	45 Å²	45	65%	0.647	25%	0.246	S	C	*	.	S	Bend	trans	-85	-11.6	177.5	-60.6	-38.3	0	0	0	112.7	H224 R226	D200-H224 PolarHBondContact O-CD2 3.48Å; D200-R226 IonicContact OD1-CZ 3.66Å; D200-R226 IonicContact OD1-NH1 2.71Å; D200-R226 PolarHBondContact OD1-NH1 3.12Å; D200-R226 IonicContact OD1-NH2 3.1Å
201	T	98	Very high	96.9	Very high	92 Å²	92	45.1 Å²	45.1	56%	0.564	25%	0.249	S	C	*	.	S	Bend	trans	-83.5	164.9	175.8	59.5	0	0	0	0	112	K199	K199-T201 VanDerWaalsContact C-N 3.33Å; K199-T201 WeakPolarHBondContact CD-OG1 3.49Å; K199-T201 WeakPolarHBondContact CE-O 3.49Å; K199-T201 WeakPolarHBondContact CE-OG1 3.47Å; K199-T201 WeakPolarHBondContact CG-O 3.43Å; K199-T201 WeakPolarHBondContact CG-OG1 3.39Å
202	V	98	Very high	97	Very high	38 Å²	38	44.3 Å²	44.3	23%	0.23	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-62.2	141.7	-179.5	71.7	0	0	0	0	112.3	K199 T204 R222	K199-V202 WeakPolarHBondContact CE-O 3.38Å; K199-V202 PolarHBondContact NZ-O 3.47Å; K199-V202 VanDerWaalsContact NZ-O 3.11Å; V202-T204 HydrophobicContact CG1-CG2 4.42Å; V202-R222 HydrophobicContact CG2-CB 3.83Å; V202-R222 HydrophobicContact CG2-CG 4.16Å
203	Y	98.5	Very high	97.1	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.016	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-96.3	141.2	164.7	-66.2	-98.3	0	0	0	109.3	V169 A196 I197 L198 K199 R222 Y223	V169-Y203 HydrophobicContact CG1-CE1 4.4Å; V169-Y203 WeakPolarHBondContact CG1-OH 3.39Å; A196-Y203 HydrophobicContact CB-CE1 3.85Å; I197-Y203 PolarHBondContact O-OH 2.9Å; L198-Y203 WeakPolarHBondContact CA-OH 3.49Å; K199-Y203 HydrophobicContact CD-CD1 4.49Å; K199-Y203 HydrophobicContact CD-CE1 3.99Å; K199-Y203 HydrophobicContact CD-CE2 4.22Å; K199-Y203 HydrophobicContact CG-CD2 4.48Å; K199-Y203 HydrophobicContact CG-CE1 4.25Å; K199-Y203 HydrophobicContact CG-CE2 3.71Å; K199-Y203 PolarHBondContact N-OH 3.49Å; Y203-R222 WeakPolarHBondContact O-CA 3Å; Y203-Y223 WeakPolarHBondContact CB-OH 3.28Å; Y203-Y223 HydrophobicContact CD2-CD2 4.38Å; Y203-Y223 AromaticContact CD2-CE2 3.98Å; Y203-Y223 HydrophobicContact CD2-CE2 3.98Å; Y203-Y223 AromaticContact CG-CE2 3.85Å; Y203-Y223 HydrophobicContact CG-CE2 3.85Å; Y203-Y223 AromaticContact CG-CZ 3.84Å; Y203-Y223 PolarHBondContact N-O 3.38Å; Y203-Y223 PolarHBondContact O-N 2.95Å
204	T	98.1	Very high	97.2	Very high	90 Å²	90	43.1 Å²	43.1	55%	0.552	23%	0.231	S	C	*	.			trans	-123.4	9.3	-177.1	51.4	0	0	0	0	112.3	V202 H221 R222	V202-T204 HydrophobicContact CG1-CG2 4.42Å; T204-H221 WeakPolarHBondContact CA-O 3.5Å; T204-R222 HydrophobicContact CG2-CG 4.22Å
205	D	96.2	Very high	97.4	Very high	57 Å²	57	43.5 Å²	43.5	31%	0.305	23%	0.234	S	C	.	.			trans	-136.8	144.6	-173.6	59.9	-67.2	0	0	0	108	R171 Y223	R171-D205 IonicContact CZ-OD2 3.92Å; R171-D205 PolarHBondContact NH1-O 2.9Å; R171-D205 IonicContact NH1-OD2 2.63Å; R171-D205 PolarHBondContact NH1-OD2 3.39Å; R171-D205 IonicContact NH2-OD2 2.63Å; D205-Y223 WeakPolarHBondContact O-CE1 3.34Å; D205-Y223 PolarHBondContact O-OH 2.86Å
206	F	93.9	Very high	97.4	Very high	26 Å²	26	44.3 Å²	44.3	11%	0.114	24%	0.237	C	C	.	.			trans	-161	117.6	-178	-177.3	-97.6	0	0	0	110.1	R171 G208 W217 Y223	R171-F206 WeakPolarHBondContact O-CE2 3.42Å; F206-G208 WeakPolarHBondContact CE1-O 3.31Å; F206-W217 HydrophobicContact CB-CD2 3.75Å; F206-W217 VanDerWaalsContact CB-CE2 3.48Å; F206-W217 HydrophobicContact CB-CE3 3.87Å; F206-W217 HydrophobicContact CB-CH2 3.54Å; F206-W217 HydrophobicContact CB-CZ2 3.42Å; F206-W217 VanDerWaalsContact CB-CZ2 3.42Å; F206-W217 HydrophobicContact CB-CZ3 3.77Å; F206-W217 HydrophobicContact CD1-CD2 4.4Å; F206-W217 AromaticContact CD1-CE2 3.87Å; F206-W217 HydrophobicContact CD1-CZ2 4.35Å; F206-W217 AromaticContact CD1-NE1 3.54Å; F206-W217 HydrophobicContact CG-CD2 4.13Å; F206-W217 AromaticContact CG-CE2 3.92Å; F206-W217 HydrophobicContact CG-CG 4.47Å; F206-W217 HydrophobicContact CG-CZ2 4.29Å; F206-Y223 HydrophobicContact CB-CE1 4.02Å; F206-Y223 HydrophobicContact CD2-CE1 4.05Å; F206-Y223 AromaticContact CD2-CZ 3.93Å; F206-Y223 HydrophobicContact CG-CE1 4.47Å
207	D	91.3	Very high	97.4	Very high	83 Å²	83	45.1 Å²	45.1	44%	0.444	24%	0.239	S	C	.	.			trans	-113.5	19.1	176.3	-64.4	-32.6	0	0	0	111.5	S194	S194-D207 WeakPolarHBondContact CB-O 3.13Å; S194-D207 PolarHBondContact OG-O 3.32Å
208	G	95.2	Very high	97.5	Very high	16 Å²	16	42 Å²	42	17%	0.165	22%	0.223	C	C	.	.	S	Bend	trans	-83.6	179.9	175.3	0	0	0	0	0	112.9	F206 R210	F206-G208 WeakPolarHBondContact CE1-O 3.31Å; G208-R210 PolarHBondContact O-N 2.99Å
209	T	97.4	Very high	97.5	Very high	30 Å²	30	49.1 Å²	49.1	18%	0.184	25%	0.248	C	C	.	.			trans	-72.6	119.8	-178.6	-58.5	0	0	0	0	111.1	D172 K174 V211 Y212 S213	D172-T209 WeakPolarHBondContact OD1-CB 3.09Å; D172-T209 PolarHBondContact OD1-N 3.25Å; D172-T209 PolarHBondContact OD1-OG1 2.94Å; D172-T209 PolarHBondContact OD2-OG1 2.66Å; K174-T209 HydrophobicContact CD-CG2 4.25Å; K174-T209 WeakPolarHBondContact CD-OG1 3.49Å; K174-T209 WeakPolarHBondContact CE-OG1 3.3Å; K174-T209 PolarHBondContact NZ-OG1 3.08Å; T209-V211 HydrophobicContact CG2-CG2 3.87Å; T209-V211 PolarHBondContact O-N 3.47Å; T209-Y212 HydrophobicContact CG2-CD2 3.94Å; T209-Y212 PolarHBondContact O-N 2.7Å; T209-S213 PolarHBondContact O-N 3.4Å
210	R	98	Very high	97.5	Very high	109 Å²	109	51.4 Å²	51.4	41%	0.411	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-58	-41.2	-170.6	-170.6	178.6	-172.9	82.6	-0.6	113.9	G208 Y212 S213 I218 D250	G208-R210 PolarHBondContact O-N 2.99Å; R210-Y212 PolarHBondContact O-N 2.99Å; R210-S213 VanDerWaalsContact O-CB 3.26Å; R210-S213 WeakPolarHBondContact O-CB 3.49Å; R210-S213 PolarHBondContact O-N 2.67Å; R210-S213 PolarHBondContact O-OG 3.28Å; R210-I218 HydrophobicContact CG-CD1 4.01Å; R210-D250 IonicContact CZ-OD1 3.53Å; R210-D250 IonicContact CZ-OD2 3.71Å; R210-D250 IonicContact NE-OD1 3.43Å; R210-D250 PolarHBondContact NE-OD1 3.36Å; R210-D250 IonicContact NE-OD2 2.69Å; R210-D250 PolarHBondContact NE-OD2 3.07Å; R210-D250 IonicContact NH2-OD1 2.75Å; R210-D250 PolarHBondContact NH2-OD1 3.04Å; R210-D250 IonicContact NH2-OD2 3.65Å; R210-D250 PolarHBondContact NH2-OD2 3.28Å
211	V	98.5	Very high	97.6	Very high	37 Å²	37	50.5 Å²	50.5	22%	0.224	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-69.2	-17.6	-179	-63.9	0	0	0	0	113.5	T209 I245	T209-V211 HydrophobicContact CG2-CG2 3.87Å; T209-V211 PolarHBondContact O-N 3.47Å; V211-I245 HydrophobicContact CB-CD1 3.84Å; V211-I245 HydrophobicContact CG1-CD1 4.29Å; V211-I245 HydrophobicContact CG2-CD1 3.65Å
212	Y	98.8	Very high	97.6	Very high	10 Å²	10	52.9 Å²	52.9	4%	0.039	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-93	-3.7	171	-78.1	-96.9	0	0	0	113	I173 K174 D175 T209 R210 W231 V235 L236 I245	I173-Y212 WeakPolarHBondContact O-CD1 3.32Å; K174-Y212 HydrophobicContact CB-CD1 4.05Å; K174-Y212 HydrophobicContact CB-CD2 3.89Å; K174-Y212 HydrophobicContact CB-CE1 3.75Å; K174-Y212 HydrophobicContact CB-CE2 3.56Å; K174-Y212 HydrophobicContact CB-CG 4.13Å; K174-Y212 VanDerWaalsContact CB-CZ 3.48Å; K174-Y212 HydrophobicContact CD-CE2 4.48Å; D175-Y212 PolarHBondContact OD1-OH 2.72Å; T209-Y212 HydrophobicContact CG2-CD2 3.94Å; T209-Y212 PolarHBondContact O-N 2.7Å; R210-Y212 PolarHBondContact O-N 2.99Å; Y212-W231 VanDerWaalsContact O-CD1 3.31Å; Y212-V235 HydrophobicContact CD1-CB 3.67Å; Y212-V235 HydrophobicContact CD1-CG1 3.41Å; Y212-V235 VanDerWaalsContact CD1-CG1 3.41Å; Y212-V235 HydrophobicContact CD2-CG1 4.37Å; Y212-V235 HydrophobicContact CE1-CB 3.87Å; Y212-V235 HydrophobicContact CE1-CG1 3.38Å; Y212-V235 HydrophobicContact CE2-CG1 4.36Å; Y212-V235 HydrophobicContact CG-CB 4.45Å; Y212-V235 HydrophobicContact CG-CG1 3.92Å; Y212-L236 HydrophobicContact CE1-CB 4.19Å; Y212-I245 HydrophobicContact CE2-CG2 4.02Å
213	S	98.5	Very high	97.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.238	C	C	.	.	S	Bend	trans	-80.8	147.4	-176.6	77.4	0	0	0	0	112.1	T209 R210 I218 W231	T209-S213 PolarHBondContact O-N 3.4Å; R210-S213 VanDerWaalsContact O-CB 3.26Å; R210-S213 WeakPolarHBondContact O-CB 3.49Å; R210-S213 PolarHBondContact O-N 2.67Å; R210-S213 PolarHBondContact O-OG 3.28Å; S213-I218 WeakPolarHBondContact OG-CD1 3.26Å; S213-W231 PolarHBondContact O-NE1 3.39Å; S213-W231 VanDerWaalsContact O-NE1 3.09Å
214	P	98.8	Very high	97.7	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.006	26%	0.259	C	S	.	.			trans	-79.4	159.7	-174.1	36.6	-40.7	0	0	0	112.4	E216 W217 I218 A228 W231	P214-E216 VanDerWaalsContact C-N 3.26Å; P214-E216 HydrophobicContact CB-CG 4.5Å; P214-E216 WeakPolarHBondContact CB-OE1 3.26Å; P214-E216 WeakPolarHBondContact CB-OE2 3.45Å; P214-E216 HydrophobicContact CG-CG 4.24Å; P214-E216 PolarHBondContact O-N 2.59Å; P214-W217 HydrophobicContact CG-CB 4.12Å; P214-W217 WeakPolarHBondContact O-CB 3.45Å; P214-W217 PolarHBondContact O-N 2.91Å; P214-I218 PolarHBondContact O-N 3.44Å; P214-A228 HydrophobicContact CG-CB 3.83Å; P214-W231 HydrophobicContact CB-CB 3.84Å; P214-W231 HydrophobicContact CB-CD2 4.08Å; P214-W231 HydrophobicContact CB-CG 3.67Å
215	P	98.8	Very high	97.7	Very high	9 Å²	9	51.5 Å²	51.5	6%	0.058	23%	0.233	C	C	.	.	H	α-helix	trans	-60.8	-30.6	-175.3	23.3	-35.1	0	0	0	113.7	W217 I218 R219 W231 I253 L254 L278	P215-W217 VanDerWaalsContact C-N 3.3Å; P215-W217 PolarHBondContact O-N 2.88Å; P215-I218 PolarHBondContact O-N 2.71Å; P215-R219 VanDerWaalsContact O-CB 3.26Å; P215-R219 WeakPolarHBondContact O-CB 3.5Å; P215-R219 PolarHBondContact O-N 3.47Å; P215-W231 VanDerWaalsContact CD-CZ3 3.45Å; P215-W231 HydrophobicContact CG-CE3 4.24Å; P215-W231 HydrophobicContact CG-CH2 3.98Å; P215-W231 HydrophobicContact CG-CZ3 3.8Å; P215-I253 HydrophobicContact CB-CG2 4.27Å; P215-L254 HydrophobicContact CB-CD2 4.24Å; P215-L278 HydrophobicContact CB-CD2 4.28Å; P215-L278 HydrophobicContact CG-CD2 4.02Å
216	E	98.8	Very high	97.8	Very high	19 Å²	19	54.4 Å²	54.4	9%	0.089	24%	0.24	C	C	.	.	H	α-helix	trans	-66.6	-29.6	175	64.3	-86.7	-158.8	0	0	113.3	P214 F220 R222 P280 R283	P214-E216 VanDerWaalsContact C-N 3.26Å; P214-E216 HydrophobicContact CB-CG 4.5Å; P214-E216 WeakPolarHBondContact CB-OE1 3.26Å; P214-E216 WeakPolarHBondContact CB-OE2 3.45Å; P214-E216 HydrophobicContact CG-CG 4.24Å; P214-E216 PolarHBondContact O-N 2.59Å; E216-F220 HydrophobicContact CB-CD2 4.33Å; E216-F220 WeakPolarHBondContact O-CA 3.47Å; E216-F220 WeakPolarHBondContact O-CB 3.39Å; E216-F220 PolarHBondContact O-N 3.22Å; E216-R222 CarbonylContact C-O 3.43Å; E216-R222 VanDerWaalsContact CG-O 3.25Å; E216-R222 WeakPolarHBondContact CG-O 3.33Å; E216-P280 HydrophobicContact CB-CG 4.44Å; E216-P280 VanDerWaalsContact CD-CG 3.46Å; E216-P280 HydrophobicContact CG-CG 4.07Å; E216-P280 WeakPolarHBondContact OE1-CG 3.47Å; E216-R283 IonicContact OE1-CZ 2.63Å; E216-R283 IonicContact OE1-NH1 2.78Å; E216-R283 PolarHBondContact OE1-NH1 3.4Å; E216-R283 IonicContact OE1-NH2 3.75Å; E216-R283 PolarHBondContact OE1-NH2 2.96Å; E216-R283 IonicContact OE2-CZ 3.57Å; E216-R283 IonicContact OE2-NH1 3.8Å; E216-R283 IonicContact OE2-NH2 2.79Å; E216-R283 PolarHBondContact OE2-NH2 3.44Å
217	W	98.8	Very high	98	Very high	23 Å²	23	54.1 Å²	54.1	9%	0.087	24%	0.241	C	C	.	.	H	α-helix	trans	-70.3	-51.7	171.6	170.1	-107	0	0	0	110.1	F206 P214 P215 R219 F220 H221 Y223	F206-W217 HydrophobicContact CB-CD2 3.75Å; F206-W217 VanDerWaalsContact CB-CE2 3.48Å; F206-W217 HydrophobicContact CB-CE3 3.87Å; F206-W217 HydrophobicContact CB-CH2 3.54Å; F206-W217 HydrophobicContact CB-CZ2 3.42Å; F206-W217 VanDerWaalsContact CB-CZ2 3.42Å; F206-W217 HydrophobicContact CB-CZ3 3.77Å; F206-W217 HydrophobicContact CD1-CD2 4.4Å; F206-W217 AromaticContact CD1-CE2 3.87Å; F206-W217 HydrophobicContact CD1-CZ2 4.35Å; F206-W217 AromaticContact CD1-NE1 3.54Å; F206-W217 HydrophobicContact CG-CD2 4.13Å; F206-W217 AromaticContact CG-CE2 3.92Å; F206-W217 HydrophobicContact CG-CG 4.47Å; F206-W217 HydrophobicContact CG-CZ2 4.29Å; P214-W217 HydrophobicContact CG-CB 4.12Å; P214-W217 WeakPolarHBondContact O-CB 3.45Å; P214-W217 PolarHBondContact O-N 2.91Å; P215-W217 VanDerWaalsContact C-N 3.3Å; P215-W217 PolarHBondContact O-N 2.88Å; W217-R219 PolarHBondContact O-N 2.95Å; W217-F220 PolarHBondContact O-N 2.89Å; W217-H221 VanDerWaalsContact CE3-CA 3.45Å; W217-H221 HydrophobicContact CE3-CB 4.22Å; W217-H221 HydrophobicContact CH2-CB 4.18Å; W217-H221 AromaticContact CH2-CD2 3.95Å; W217-H221 AromaticContact CZ2-CD2 3.93Å; W217-H221 VanDerWaalsContact CZ3-C 3.48Å; W217-H221 HydrophobicContact CZ3-CB 3.85Å; W217-H221 WeakPolarHBondContact CZ3-O 3.28Å; W217-H221 VanDerWaalsContact O-CA 3.28Å; W217-H221 WeakPolarHBondContact O-CA 3.48Å; W217-H221 PolarHBondContact O-N 3.42Å; W217-Y223 HydrophobicContact CB-CD1 4.49Å; W217-Y223 HydrophobicContact CD2-CD1 4.47Å; W217-Y223 AromaticContact CE3-CD1 3.76Å; W217-Y223 HydrophobicContact CE3-CD1 3.76Å; W217-Y223 AromaticContact CE3-CE1 3.87Å; W217-Y223 HydrophobicContact CE3-CE1 3.87Å; W217-Y223 HydrophobicContact CZ3-CD1 4.49Å; W217-Y223 HydrophobicContact CZ3-CE1 4.26Å
218	I	98.6	Very high	98.4	Very high	14 Å²	14	50.6 Å²	50.6	7%	0.072	22%	0.224	C	C	.	.	H	α-helix	trans	-54.5	-41.9	178.9	-58	-57.8	0	0	0	111.2	R210 S213 P214 P215 D250 I253 L254	R210-I218 HydrophobicContact CG-CD1 4.01Å; S213-I218 WeakPolarHBondContact OG-CD1 3.26Å; P214-I218 PolarHBondContact O-N 3.44Å; P215-I218 PolarHBondContact O-N 2.71Å; I218-D250 HydrophobicContact CG2-CB 3.8Å; I218-I253 HydrophobicContact CD1-CD1 4.36Å; I218-I253 HydrophobicContact CG1-CD1 4.34Å; I218-I253 HydrophobicContact CG1-CG2 3.92Å; I218-L254 HydrophobicContact CB-CD2 4.09Å; I218-L254 HydrophobicContact CB-CG 4.47Å; I218-L254 HydrophobicContact CG2-CD1 3.99Å; I218-L254 HydrophobicContact CG2-CD2 3.94Å; I218-L254 HydrophobicContact CG2-CG 3.88Å
219	R	98.4	Very high	98.6	Very high	176 Å²	176	50 Å²	50	66%	0.664	22%	0.217	S	C	*	.	H	α-helix	trans	-85.5	-38.8	-174	-164.7	168.9	176.6	166.7	1.6	114.4	P215 W217 L254	P215-R219 VanDerWaalsContact O-CB 3.26Å; P215-R219 WeakPolarHBondContact O-CB 3.5Å; P215-R219 PolarHBondContact O-N 3.47Å; W217-R219 PolarHBondContact O-N 2.95Å; R219-L254 HydrophobicContact CB-CD2 3.87Å; R219-L254 HydrophobicContact CG-CD2 4.5Å
220	F	98.4	Very high	98.6	Very high	124 Å²	124	48.9 Å²	48.9	54%	0.544	21%	0.21	S	C	.	.	H	α-helix	trans	-126.6	-2.7	-166.2	-52.1	-62.9	0	0	0	113.9	E216 W217 R222	E216-F220 HydrophobicContact CB-CD2 4.33Å; E216-F220 WeakPolarHBondContact O-CA 3.47Å; E216-F220 WeakPolarHBondContact O-CB 3.39Å; E216-F220 PolarHBondContact O-N 3.22Å; W217-F220 PolarHBondContact O-N 2.89Å; F220-R222 HydrophobicContact CB-CB 4.38Å; F220-R222 WeakPolarHBondContact O-CG 3.37Å; F220-R222 PolarHBondContact O-N 3.22Å
221	H	98.5	Very high	98.7	Very high	103 Å²	103	43.7 Å²	43.7	48%	0.477	19%	0.19	S	C	.	.	S	Bend	trans	53.3	36.1	-173.4	-59.3	77.8	0	0	0	112.3	T204 W217	T204-H221 WeakPolarHBondContact CA-O 3.5Å; W217-H221 VanDerWaalsContact CE3-CA 3.45Å; W217-H221 HydrophobicContact CE3-CB 4.22Å; W217-H221 HydrophobicContact CH2-CB 4.18Å; W217-H221 AromaticContact CH2-CD2 3.95Å; W217-H221 AromaticContact CZ2-CD2 3.93Å; W217-H221 VanDerWaalsContact CZ3-C 3.48Å; W217-H221 HydrophobicContact CZ3-CB 3.85Å; W217-H221 WeakPolarHBondContact CZ3-O 3.28Å; W217-H221 VanDerWaalsContact O-CA 3.28Å; W217-H221 WeakPolarHBondContact O-CA 3.48Å; W217-H221 PolarHBondContact O-N 3.42Å
222	R	98.6	Very high	98.7	Very high	142 Å²	142	42.3 Å²	42.3	54%	0.536	18%	0.183	S	C	.	.			trans	-144.5	134.8	-174.9	-70.4	176.8	76.9	144.5	3.3	111	V202 Y203 T204 E216 F220	V202-R222 HydrophobicContact CG2-CB 3.83Å; V202-R222 HydrophobicContact CG2-CG 4.16Å; Y203-R222 WeakPolarHBondContact O-CA 3Å; T204-R222 HydrophobicContact CG2-CG 4.22Å; E216-R222 CarbonylContact C-O 3.43Å; E216-R222 VanDerWaalsContact CG-O 3.25Å; E216-R222 WeakPolarHBondContact CG-O 3.33Å; F220-R222 HydrophobicContact CB-CB 4.38Å; F220-R222 WeakPolarHBondContact O-CG 3.37Å; F220-R222 PolarHBondContact O-N 3.22Å
223	Y	98.8	Very high	98.7	Very high	5 Å²	5	41.9 Å²	41.9	2%	0.02	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-154.1	165.9	176.2	63.9	-79.9	0	0	0	111.9	R171 Y203 D205 F206 W217 A228	R171-Y223 WeakPolarHBondContact CD-OH 3.46Å; R171-Y223 PolarHBondContact NH1-OH 2.86Å; Y203-Y223 WeakPolarHBondContact CB-OH 3.28Å; Y203-Y223 HydrophobicContact CD2-CD2 4.38Å; Y203-Y223 AromaticContact CD2-CE2 3.98Å; Y203-Y223 HydrophobicContact CD2-CE2 3.98Å; Y203-Y223 AromaticContact CG-CE2 3.85Å; Y203-Y223 HydrophobicContact CG-CE2 3.85Å; Y203-Y223 AromaticContact CG-CZ 3.84Å; Y203-Y223 PolarHBondContact N-O 3.38Å; Y203-Y223 PolarHBondContact O-N 2.95Å; D205-Y223 WeakPolarHBondContact O-CE1 3.34Å; D205-Y223 PolarHBondContact O-OH 2.86Å; F206-Y223 HydrophobicContact CB-CE1 4.02Å; F206-Y223 HydrophobicContact CD2-CE1 4.05Å; F206-Y223 AromaticContact CD2-CZ 3.93Å; F206-Y223 HydrophobicContact CG-CE1 4.47Å; W217-Y223 HydrophobicContact CB-CD1 4.49Å; W217-Y223 HydrophobicContact CD2-CD1 4.47Å; W217-Y223 AromaticContact CE3-CD1 3.76Å; W217-Y223 HydrophobicContact CE3-CD1 3.76Å; W217-Y223 AromaticContact CE3-CE1 3.87Å; W217-Y223 HydrophobicContact CE3-CE1 3.87Å; W217-Y223 HydrophobicContact CZ3-CD1 4.49Å; W217-Y223 HydrophobicContact CZ3-CE1 4.26Å; Y223-A228 HydrophobicContact CD2-CB 3.54Å; Y223-A228 HydrophobicContact CE2-CB 4.34Å; Y223-A228 HydrophobicContact CG-CB 4.15Å
224	H	98.8	Very high	98.7	Very high	95 Å²	95	41.9 Å²	41.9	44%	0.44	18%	0.181	S	C	.	.			trans	-106.9	139	166.1	-67	85.7	0	0	0	108.7	D200 R226 S227 A228	D200-H224 PolarHBondContact O-CD2 3.48Å; H224-R226 PolarHBondContact O-N 3.32Å; H224-S227 PolarHBondContact O-N 3.46Å; H224-S227 PolarHBondContact O-OG 3.26Å; H224-A228 VanDerWaalsContact O-CB 3.3Å; H224-A228 WeakPolarHBondContact O-CB 3.42Å; H224-A228 PolarHBondContact O-N 2.91Å
225	G	98.4	Very high	98.7	Very high	2 Å²	2	41.8 Å²	41.8	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-57.2	-43.4	-169.6	0	0	0	0	0	114	T229	G225-T229 WeakPolarHBondContact O-CB 3.39Å; G225-T229 PolarHBondContact O-N 3.3Å; G225-T229 PolarHBondContact O-OG1 3.27Å
226	R	98.7	Very high	98.8	Very high	118 Å²	118	41.4 Å²	41.4	45%	0.445	18%	0.178	S	C	.	.	H	α-helix	trans	-66.9	-51.3	-177.4	-64.9	-171.7	-179.1	86.1	-4.4	112.8	Y164 D200 H224 A228 T229 V230	Y164-R226 HydrophobicContact CE2-CG 3.92Å; Y164-R226 WeakPolarHBondContact OH-CA 3.25Å; D200-R226 IonicContact OD1-CZ 3.66Å; D200-R226 IonicContact OD1-NH1 2.71Å; D200-R226 PolarHBondContact OD1-NH1 3.12Å; D200-R226 IonicContact OD1-NH2 3.1Å; H224-R226 PolarHBondContact O-N 3.32Å; R226-A228 VanDerWaalsContact C-N 3.32Å; R226-A228 PolarHBondContact O-N 3.36Å; R226-T229 PolarHBondContact O-N 2.91Å; R226-V230 WeakPolarHBondContact O-CG2 3.39Å; R226-V230 PolarHBondContact O-N 3.1Å
227	S	98.8	Very high	98.8	Very high	20 Å²	20	40.5 Å²	40.5	14%	0.14	17%	0.173	C	C	.	.	H	α-helix	trans	-68.2	-31.7	-179.9	59.2	0	0	0	0	112.6	H224 W231 R283	H224-S227 PolarHBondContact O-N 3.46Å; H224-S227 PolarHBondContact O-OG 3.26Å; S227-W231 PolarHBondContact O-N 2.7Å; S227-R283 WeakPolarHBondContact O-CD 3.49Å; S227-R283 PolarHBondContact O-NH1 3.45Å
228	A	98.9	Very high	98.8	Very high	9 Å²	9	39.6 Å²	39.6	7%	0.074	17%	0.17	C	C	.	.	H	α-helix	trans	-67.7	-40.8	173.6	0	0	0	0	0	112	P214 Y223 H224 R226 V230 W231 S232	P214-A228 HydrophobicContact CG-CB 3.83Å; Y223-A228 HydrophobicContact CD2-CB 3.54Å; Y223-A228 HydrophobicContact CE2-CB 4.34Å; Y223-A228 HydrophobicContact CG-CB 4.15Å; H224-A228 VanDerWaalsContact O-CB 3.3Å; H224-A228 WeakPolarHBondContact O-CB 3.42Å; H224-A228 PolarHBondContact O-N 2.91Å; R226-A228 VanDerWaalsContact C-N 3.32Å; R226-A228 PolarHBondContact O-N 3.36Å; A228-V230 VanDerWaalsContact C-N 3.32Å; A228-V230 PolarHBondContact O-N 2.89Å; A228-W231 WeakPolarHBondContact O-CB 3.22Å; A228-W231 PolarHBondContact O-N 3.1Å; A228-S232 PolarHBondContact O-N 3.3Å; A228-S232 VanDerWaalsContact O-N 3.1Å
229	T	98.9	Very high	98.8	Very high	5 Å²	5	39.2 Å²	39.2	3%	0.031	17%	0.168	C	C	.	.	H	α-helix	trans	-63.4	-39	174.8	-60.1	0	0	0	0	111.7	V160 Y164 I173 G225 R226 W231 S232 L233	V160-T229 HydrophobicContact CG1-CG2 3.72Å; Y164-T229 WeakPolarHBondContact OH-CB 3.48Å; Y164-T229 WeakPolarHBondContact OH-CG2 3.22Å; Y164-T229 PolarHBondContact OH-OG1 2.93Å; I173-T229 HydrophobicContact CD1-CG2 3.48Å; I173-T229 VanDerWaalsContact CD1-CG2 3.48Å; G225-T229 WeakPolarHBondContact O-CB 3.39Å; G225-T229 PolarHBondContact O-N 3.3Å; G225-T229 PolarHBondContact O-OG1 3.27Å; R226-T229 PolarHBondContact O-N 2.91Å; T229-W231 VanDerWaalsContact C-N 3.28Å; T229-W231 PolarHBondContact O-N 2.91Å; T229-S232 WeakPolarHBondContact CA-OG 3.38Å; T229-S232 PolarHBondContact O-N 3.03Å; T229-S232 PolarHBondContact O-OG 3.03Å; T229-L233 HydrophobicContact CG2-CD1 4.03Å; T229-L233 HydrophobicContact CG2-CG 4.35Å; T229-L233 WeakPolarHBondContact O-CB 3.36Å; T229-L233 VanDerWaalsContact O-CG 3.26Å; T229-L233 WeakPolarHBondContact O-CG 3.43Å; T229-L233 PolarHBondContact O-N 3.04Å
230	V	98.9	Very high	98.8	Very high	5 Å²	5	30.8 Å²	30.8	3%	0.03	14%	0.137	C	C	.	.	H	α-helix	trans	-62.9	-37.1	175.8	171.5	0	0	0	0	111.6	R226 A228 L233 G234 C275 R283 P284 L286 I289	R226-V230 WeakPolarHBondContact O-CG2 3.39Å; R226-V230 PolarHBondContact O-N 3.1Å; A228-V230 VanDerWaalsContact C-N 3.32Å; A228-V230 PolarHBondContact O-N 2.89Å; V230-L233 PolarHBondContact O-N 2.82Å; V230-G234 PolarHBondContact O-N 2.78Å; V230-C275 HydrophobicContact CG1-CB 4.1Å; V230-R283 HydrophobicContact CB-CB 4.48Å; V230-R283 HydrophobicContact CG1-CB 3.84Å; V230-R283 HydrophobicContact CG1-CG 4.5Å; V230-P284 HydrophobicContact CG1-CG 4.01Å; V230-P284 WeakPolarHBondContact CG2-O 3.43Å; V230-L286 HydrophobicContact CG2-CD2 4.29Å; V230-I289 HydrophobicContact CG1-CD1 4.15Å; V230-I289 HydrophobicContact CG2-CD1 4.33Å
231	W	98.9	Very high	98.8	Very high	0 Å²	0	25 Å²	25	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-61.8	-50.4	172.7	177.5	-82.3	0	0	0	111.6	Y212 S213 P214 P215 S227 A228 T229 L233 G234 V235 F247 I253 L276 L278	Y212-W231 VanDerWaalsContact O-CD1 3.31Å; S213-W231 PolarHBondContact O-NE1 3.39Å; S213-W231 VanDerWaalsContact O-NE1 3.09Å; P214-W231 HydrophobicContact CB-CB 3.84Å; P214-W231 HydrophobicContact CB-CD2 4.08Å; P214-W231 HydrophobicContact CB-CG 3.67Å; P215-W231 VanDerWaalsContact CD-CZ3 3.45Å; P215-W231 HydrophobicContact CG-CE3 4.24Å; P215-W231 HydrophobicContact CG-CH2 3.98Å; P215-W231 HydrophobicContact CG-CZ3 3.8Å; S227-W231 PolarHBondContact O-N 2.7Å; A228-W231 WeakPolarHBondContact O-CB 3.22Å; A228-W231 PolarHBondContact O-N 3.1Å; T229-W231 VanDerWaalsContact C-N 3.28Å; T229-W231 PolarHBondContact O-N 2.91Å; W231-L233 VanDerWaalsContact C-N 3.26Å; W231-L233 PolarHBondContact O-N 2.82Å; W231-G234 WeakPolarHBondContact O-CA 3.39Å; W231-G234 PolarHBondContact O-N 3.01Å; W231-V235 PolarHBondContact O-N 3.39Å; W231-F247 HydrophobicContact CH2-CE2 4.09Å; W231-F247 HydrophobicContact CZ2-CD2 4.12Å; W231-F247 AromaticContact CZ2-CE2 3.74Å; W231-F247 HydrophobicContact CZ2-CE2 3.74Å; W231-I253 HydrophobicContact CZ2-CG2 3.86Å; W231-L276 HydrophobicContact CD2-CD2 3.65Å; W231-L276 HydrophobicContact CE3-CB 4.37Å; W231-L276 HydrophobicContact CE3-CD2 3.88Å; W231-L276 HydrophobicContact CG-CD2 4.06Å; W231-L276 HydrophobicContact CH2-CB 4.46Å; W231-L276 HydrophobicContact CH2-CD2 4.35Å; W231-L276 HydrophobicContact CZ2-CD2 4.13Å; W231-L276 HydrophobicContact CZ3-CB 4.14Å; W231-L276 HydrophobicContact CZ3-CD2 4.24Å; W231-L276 VanDerWaalsContact CZ3-O 3.25Å; W231-L276 WeakPolarHBondContact CZ3-O 3.41Å; W231-L276 VanDerWaalsContact O-CD2 3.31Å; W231-L276 WeakPolarHBondContact O-CD2 3.12Å; W231-L278 HydrophobicContact CH2-CD2 4.39Å; W231-L278 HydrophobicContact CZ3-CD2 4.48Å
232	S	98.9	Very high	98.8	Very high	9 Å²	9	20.7 Å²	20.7	6%	0.063	9%	0.093	C	C	.	.	H	α-helix	trans	-61.9	-34.6	179.3	64.2	0	0	0	0	112.3	A228 T229 G234 V235 L236	A228-S232 PolarHBondContact O-N 3.3Å; A228-S232 VanDerWaalsContact O-N 3.1Å; T229-S232 WeakPolarHBondContact CA-OG 3.38Å; T229-S232 PolarHBondContact O-N 3.03Å; T229-S232 PolarHBondContact O-OG 3.03Å; S232-G234 VanDerWaalsContact C-N 3.34Å; S232-V235 PolarHBondContact O-N 3.04Å; S232-L236 WeakPolarHBondContact O-CB 3.3Å; S232-L236 PolarHBondContact O-N 2.68Å
233	L	98.9	Very high	98.7	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-63.6	-37.5	171.5	-72.8	168.7	0	0	0	112.4	F153 V156 L157 V160 I173 T229 V230 W231 L236 L237 L286	F153-L233 HydrophobicContact CE2-CB 4.02Å; F153-L233 HydrophobicContact CE2-CD2 3.95Å; F153-L233 WeakPolarHBondContact CE2-O 3.31Å; F153-L233 HydrophobicContact CZ-CB 3.99Å; F153-L233 HydrophobicContact CZ-CD2 4.4Å; V156-L233 HydrophobicContact CG1-CD2 3.6Å; L157-L233 HydrophobicContact CD2-CD1 3.84Å; L157-L233 HydrophobicContact CD2-CD2 4.46Å; V160-L233 HydrophobicContact CG2-CD2 4.45Å; I173-L233 HydrophobicContact CG2-CD2 4.17Å; T229-L233 HydrophobicContact CG2-CD1 4.03Å; T229-L233 HydrophobicContact CG2-CG 4.35Å; T229-L233 WeakPolarHBondContact O-CB 3.36Å; T229-L233 VanDerWaalsContact O-CG 3.26Å; T229-L233 WeakPolarHBondContact O-CG 3.43Å; T229-L233 PolarHBondContact O-N 3.04Å; V230-L233 PolarHBondContact O-N 2.82Å; W231-L233 VanDerWaalsContact C-N 3.26Å; W231-L233 PolarHBondContact O-N 2.82Å; L233-L236 PolarHBondContact O-N 3.43Å; L233-L237 WeakPolarHBondContact O-CB 3.25Å; L233-L237 PolarHBondContact O-N 3.09Å; L233-L286 HydrophobicContact CD1-CD2 3.66Å
234	G	98.9	Very high	98.7	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-65.3	-40.1	173.5	0	0	0	0	0	113.1	V230 W231 S232 Y238	V230-G234 PolarHBondContact O-N 2.78Å; W231-G234 WeakPolarHBondContact O-CA 3.39Å; W231-G234 PolarHBondContact O-N 3.01Å; S232-G234 VanDerWaalsContact C-N 3.34Å; G234-Y238 WeakPolarHBondContact O-CB 3.35Å; G234-Y238 PolarHBondContact O-N 2.68Å; G234-Y238 VanDerWaalsContact O-N 3.09Å
235	V	98.9	Very high	98.6	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62.9	-49	174	177.8	0	0	0	0	109.9	Y212 W231 S232 L237 Y238 D239 I245 P246 L276	Y212-V235 HydrophobicContact CD1-CB 3.67Å; Y212-V235 HydrophobicContact CD1-CG1 3.41Å; Y212-V235 VanDerWaalsContact CD1-CG1 3.41Å; Y212-V235 HydrophobicContact CD2-CG1 4.37Å; Y212-V235 HydrophobicContact CE1-CB 3.87Å; Y212-V235 HydrophobicContact CE1-CG1 3.38Å; Y212-V235 HydrophobicContact CE2-CG1 4.36Å; Y212-V235 HydrophobicContact CG-CB 4.45Å; Y212-V235 HydrophobicContact CG-CG1 3.92Å; W231-V235 PolarHBondContact O-N 3.39Å; S232-V235 PolarHBondContact O-N 3.04Å; V235-L237 PolarHBondContact O-N 3.38Å; V235-Y238 WeakPolarHBondContact O-CB 3.34Å; V235-Y238 PolarHBondContact O-N 3.03Å; V235-D239 WeakPolarHBondContact O-CB 3.41Å; V235-D239 PolarHBondContact O-N 2.97Å; V235-I245 HydrophobicContact CG1-CB 4.41Å; V235-I245 HydrophobicContact CG1-CG2 4.1Å; V235-P246 HydrophobicContact CG1-CG 4.38Å; V235-L276 HydrophobicContact CG2-CD2 3.81Å
236	L	98.9	Very high	98.6	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-60.6	-44	178.6	178.2	64.1	0	0	0	112.7	L134 V156 I173 D175 L178 Y212 S232 L233 Y238 D239 M240	L134-L236 HydrophobicContact CD2-CD1 4.18Å; V156-L236 HydrophobicContact CG1-CD2 4.02Å; V156-L236 HydrophobicContact CG2-CD2 4.27Å; I173-L236 HydrophobicContact CG2-CD2 3.95Å; D175-L236 HydrophobicContact CB-CD1 4.03Å; L178-L236 HydrophobicContact CD1-CD1 4.16Å; L178-L236 HydrophobicContact CD1-CD2 3.61Å; Y212-L236 HydrophobicContact CE1-CB 4.19Å; S232-L236 WeakPolarHBondContact O-CB 3.3Å; S232-L236 PolarHBondContact O-N 2.68Å; L233-L236 PolarHBondContact O-N 3.43Å; L236-Y238 VanDerWaalsContact C-N 3.34Å; L236-Y238 PolarHBondContact O-N 3.17Å; L236-D239 WeakPolarHBondContact O-CB 3.22Å; L236-D239 PolarHBondContact O-N 3.3Å; L236-M240 HydrophobicContact CD1-CE 4Å; L236-M240 HydrophobicContact CD2-CE 3.94Å; L236-M240 HydrophobicContact CG-CE 3.76Å; L236-M240 WeakPolarHBondContact O-CG 3.44Å; L236-M240 PolarHBondContact O-N 3.37Å
237	L	98.9	Very high	98.6	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-65.4	-40.1	178.4	178	57.9	0	0	0	111.4	F153 L233 V235 D239 M240 V241 L271 I272 W294	F153-L237 HydrophobicContact CB-CD1 4.41Å; F153-L237 HydrophobicContact CD1-CD1 4.46Å; F153-L237 HydrophobicContact CD1-CD2 4.33Å; F153-L237 HydrophobicContact CD2-CB 4.06Å; F153-L237 HydrophobicContact CD2-CD1 4.31Å; F153-L237 HydrophobicContact CE1-CD2 4.05Å; F153-L237 HydrophobicContact CE2-CB 3.77Å; F153-L237 HydrophobicContact CG-CD1 4.16Å; F153-L237 HydrophobicContact CZ-CB 4.08Å; F153-L237 HydrophobicContact CZ-CD2 4.2Å; L233-L237 WeakPolarHBondContact O-CB 3.25Å; L233-L237 PolarHBondContact O-N 3.09Å; V235-L237 PolarHBondContact O-N 3.38Å; L237-D239 VanDerWaalsContact C-N 3.33Å; L237-M240 PolarHBondContact O-N 3.02Å; L237-V241 HydrophobicContact CD1-CG1 4.3Å; L237-V241 WeakPolarHBondContact O-CG2 3.39Å; L237-V241 PolarHBondContact O-N 3.1Å; L237-L271 HydrophobicContact CD2-CD2 3.81Å; L237-L271 HydrophobicContact CD2-CG 4.03Å; L237-I272 HydrophobicContact CB-CG1 4.25Å; L237-I272 HydrophobicContact CD2-CD1 4.46Å; L237-I272 HydrophobicContact CD2-CG1 3.69Å; L237-I272 HydrophobicContact CG-CD1 4.12Å; L237-I272 HydrophobicContact CG-CG1 3.73Å; L237-W294 HydrophobicContact CD1-CH2 3.39Å; L237-W294 HydrophobicContact CD1-CZ2 4.18Å; L237-W294 HydrophobicContact CD1-CZ3 3.69Å; L237-W294 HydrophobicContact CD2-CE3 4.38Å; L237-W294 HydrophobicContact CD2-CH2 4.46Å; L237-W294 HydrophobicContact CD2-CZ3 4.03Å
238	Y	98.8	Very high	98.6	Very high	4 Å²	4	13.9 Å²	13.9	2%	0.016	8%	0.082	C	C	.	.	H	α-helix	trans	-59.8	-47	172.9	179.5	-78.1	0	0	0	110.7	G234 V235 L236 M240 V241 C242 D244 P246 L258 Y259 F260 I272	G234-Y238 WeakPolarHBondContact O-CB 3.35Å; G234-Y238 PolarHBondContact O-N 2.68Å; G234-Y238 VanDerWaalsContact O-N 3.09Å; V235-Y238 WeakPolarHBondContact O-CB 3.34Å; V235-Y238 PolarHBondContact O-N 3.03Å; L236-Y238 VanDerWaalsContact C-N 3.34Å; L236-Y238 PolarHBondContact O-N 3.17Å; Y238-M240 PolarHBondContact O-N 3.27Å; Y238-V241 PolarHBondContact O-N 3.31Å; Y238-C242 HydrophobicContact CD1-CB 3.9Å; Y238-C242 HydrophobicContact CE1-CB 3.5Å; Y238-C242 HydrophobicContact CE2-CB 4.38Å; Y238-C242 HydrophobicContact CG-CB 4.48Å; Y238-C242 VanDerWaalsContact CZ-SG 3.58Å; Y238-C242 WeakPolarHBondContact O-CB 3.36Å; Y238-C242 PolarHBondContact O-N 3.22Å; Y238-D244 WeakPolarHBondContact CD1-O 3.38Å; Y238-D244 WeakPolarHBondContact CE1-O 3.39Å; Y238-P246 HydrophobicContact CD1-CB 3.65Å; Y238-P246 VanDerWaalsContact CD1-CD 3.41Å; Y238-P246 HydrophobicContact CD1-CG 3.89Å; Y238-P246 HydrophobicContact CD2-CB 3.98Å; Y238-P246 VanDerWaalsContact CE1-CA 3.47Å; Y238-P246 HydrophobicContact CE1-CB 3.7Å; Y238-P246 HydrophobicContact CE1-CG 4.4Å; Y238-P246 HydrophobicContact CE2-CB 4.03Å; Y238-P246 HydrophobicContact CG-CB 3.79Å; Y238-P246 HydrophobicContact CG-CG 3.97Å; Y238-L258 HydrophobicContact CD2-CD2 4.27Å; Y238-L258 HydrophobicContact CE2-CD2 4.42Å; Y238-Y259 PolarHBondContact OH-O 3.33Å; Y238-F260 HydrophobicContact CD2-CD1 4.08Å; Y238-F260 AromaticContact CD2-CE1 3.81Å; Y238-F260 HydrophobicContact CD2-CE1 3.81Å; Y238-F260 AromaticContact CE2-CD1 3.82Å; Y238-F260 HydrophobicContact CE2-CD1 3.82Å; Y238-F260 AromaticContact CE2-CE1 3.96Å; Y238-F260 HydrophobicContact CE2-CE1 3.96Å; Y238-I272 HydrophobicContact CD2-CG2 4.19Å
239	D	98.7	Very high	98.5	Very high	6 Å²	6	19.1 Å²	19.1	3%	0.032	10%	0.104	C	C	.	.	H	α-helix	trans	-57.9	-47.5	178.7	175.9	53.7	0	0	0	112.1	I138 V235 L236 L237 V241 C242 G243 D244 I245	I138-D239 WeakPolarHBondContact CD1-OD2 3.46Å; V235-D239 WeakPolarHBondContact O-CB 3.41Å; V235-D239 PolarHBondContact O-N 2.97Å; L236-D239 WeakPolarHBondContact O-CB 3.22Å; L236-D239 PolarHBondContact O-N 3.3Å; L237-D239 VanDerWaalsContact C-N 3.33Å; D239-V241 VanDerWaalsContact C-N 3.35Å; D239-V241 PolarHBondContact O-N 2.97Å; D239-C242 PolarHBondContact O-N 3.41Å; D239-G243 WeakPolarHBondContact O-CA 3.12Å; D239-G243 PolarHBondContact O-N 3.22Å; D239-D244 WeakPolarHBondContact CA-O 3.44Å; D239-D244 VanDerWaalsContact OD1-C 3.26Å; D239-D244 VanDerWaalsContact OD1-CA 3.23Å; D239-D244 WeakPolarHBondContact OD1-CA 3.12Å; D239-D244 PolarHBondContact OD1-N 3.47Å; D239-I245 HydrophobicContact CB-CG2 4.21Å
240	M	98.7	Very high	98.5	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-53.8	-46.9	174.8	-71.1	172.3	178.7	0	0	113	L134 I138 L144 A149 F152 F153 V156 L236 L237 Y238	L134-M240 HydrophobicContact CD2-CE 3.4Å; L134-M240 HydrophobicContact CD2-CG 4.26Å; I138-M240 HydrophobicContact CD1-CG 4.27Å; L144-M240 WeakPolarHBondContact CB-O 3.4Å; L144-M240 HydrophobicContact CD1-CB 4.25Å; L144-M240 HydrophobicContact CD1-CG 4.39Å; L144-M240 WeakPolarHBondContact CG-O 2.94Å; L144-M240 PolarHBondContact N-O 2.81Å; A149-M240 HydrophobicContact CB-CB 4.08Å; F152-M240 HydrophobicContact CB-CE 4.12Å; F152-M240 HydrophobicContact CB-SD 4.44Å; F153-M240 HydrophobicContact CB-SD 4.38Å; F153-M240 HydrophobicContact CD2-SD 4.47Å; V156-M240 HydrophobicContact CG2-CE 4.35Å; L236-M240 HydrophobicContact CD1-CE 4Å; L236-M240 HydrophobicContact CD2-CE 3.94Å; L236-M240 HydrophobicContact CG-CE 3.76Å; L236-M240 WeakPolarHBondContact O-CG 3.44Å; L236-M240 PolarHBondContact O-N 3.37Å; L237-M240 PolarHBondContact O-N 3.02Å; Y238-M240 PolarHBondContact O-N 3.27Å
241	V	98.5	Very high	98.5	Very high	1 Å²	1	26 Å²	26	1%	0.006	14%	0.141	C	C	.	.	H	α-helix	trans	-92.9	-15.8	-171.9	-55.1	0	0	0	0	114.3	A143 A149 L237 Y238 D239 I264 I272	A143-V241 VanDerWaalsContact CB-C 3.42Å; A143-V241 VanDerWaalsContact CB-O 3.23Å; A143-V241 WeakPolarHBondContact CB-O 3.48Å; A149-V241 HydrophobicContact CB-CG1 3.64Å; L237-V241 HydrophobicContact CD1-CG1 4.3Å; L237-V241 WeakPolarHBondContact O-CG2 3.39Å; L237-V241 PolarHBondContact O-N 3.1Å; Y238-V241 PolarHBondContact O-N 3.31Å; D239-V241 VanDerWaalsContact C-N 3.35Å; D239-V241 PolarHBondContact O-N 2.97Å; V241-I264 HydrophobicContact CB-CG2 4.1Å; V241-I264 HydrophobicContact CG2-CD1 3.74Å; V241-I264 HydrophobicContact CG2-CG2 4.14Å; V241-I272 HydrophobicContact CG2-CD1 3.88Å
242	C	98.1	Very high	98.4	Very high	14 Å²	14	30 Å²	30	10%	0.095	16%	0.159	C	C	.	.	H	α-helix	trans	-107.6	-18.4	176.8	-64.3	0	0	0	0	113.6	Y238 D239 D244	Y238-C242 HydrophobicContact CD1-CB 3.9Å; Y238-C242 HydrophobicContact CE1-CB 3.5Å; Y238-C242 HydrophobicContact CE2-CB 4.38Å; Y238-C242 HydrophobicContact CG-CB 4.48Å; Y238-C242 VanDerWaalsContact CZ-SG 3.58Å; Y238-C242 WeakPolarHBondContact O-CB 3.36Å; Y238-C242 PolarHBondContact O-N 3.22Å; D239-C242 PolarHBondContact O-N 3.41Å; C242-D244 VanDerWaalsContact C-N 3.31Å
243	G	97.6	Very high	98.4	Very high	29 Å²	29	29.6 Å²	29.6	30%	0.299	16%	0.157	S	C	.	.	S	Bend	trans	82.3	12.6	175.3	0	0	0	0	0	113.3	D239	D239-G243 WeakPolarHBondContact O-CA 3.12Å; D239-G243 PolarHBondContact O-N 3.22Å
244	D	97.8	Very high	98.4	Very high	57 Å²	57	32.5 Å²	32.5	31%	0.305	17%	0.172	S	C	.	.	S	Bend	trans	-167.8	157.2	-179.9	-166.6	8.9	0	0	0	108.7	Y238 D239 C242 R261	Y238-D244 WeakPolarHBondContact CD1-O 3.38Å; Y238-D244 WeakPolarHBondContact CE1-O 3.39Å; D239-D244 WeakPolarHBondContact CA-O 3.44Å; D239-D244 VanDerWaalsContact OD1-C 3.26Å; D239-D244 VanDerWaalsContact OD1-CA 3.23Å; D239-D244 WeakPolarHBondContact OD1-CA 3.12Å; D239-D244 PolarHBondContact OD1-N 3.47Å; C242-D244 VanDerWaalsContact C-N 3.31Å; D244-R261 IonicContact OD2-CZ 3.37Å; D244-R261 IonicContact OD2-NH1 3.33Å; D244-R261 PolarHBondContact OD2-NH1 2.65Å; D244-R261 IonicContact OD2-NH2 3.43Å
245	I	98.3	Very high	98.4	Very high	25 Å²	25	37.9 Å²	37.9	13%	0.128	20%	0.195	C	C	.	.			trans	-69.4	154	-178.9	57.7	174.8	0	0	0	112.4	V211 Y212 V235 D239 F247	V211-I245 HydrophobicContact CB-CD1 3.84Å; V211-I245 HydrophobicContact CG1-CD1 4.29Å; V211-I245 HydrophobicContact CG2-CD1 3.65Å; Y212-I245 HydrophobicContact CE2-CG2 4.02Å; V235-I245 HydrophobicContact CG1-CB 4.41Å; V235-I245 HydrophobicContact CG1-CG2 4.1Å; D239-I245 HydrophobicContact CB-CG2 4.21Å; I245-F247 WeakPolarHBondContact CD1-O 3.49Å
246	P	98.1	Very high	98.2	Very high	20 Å²	20	39 Å²	39	13%	0.13	21%	0.206	C	C	.	.	S	Bend	trans	-77.7	-22.7	-177.6	28.1	-31.1	0	0	0	114.3	V235 Y238 L258 L276	V235-P246 HydrophobicContact CG1-CG 4.38Å; Y238-P246 HydrophobicContact CD1-CB 3.65Å; Y238-P246 VanDerWaalsContact CD1-CD 3.41Å; Y238-P246 HydrophobicContact CD1-CG 3.89Å; Y238-P246 HydrophobicContact CD2-CB 3.98Å; Y238-P246 VanDerWaalsContact CE1-CA 3.47Å; Y238-P246 HydrophobicContact CE1-CB 3.7Å; Y238-P246 HydrophobicContact CE1-CG 4.4Å; Y238-P246 HydrophobicContact CE2-CB 4.03Å; Y238-P246 HydrophobicContact CG-CB 3.79Å; Y238-P246 HydrophobicContact CG-CG 3.97Å; P246-L258 HydrophobicContact CB-CD2 3.58Å; P246-L258 HydrophobicContact CG-CD2 4.29Å; P246-L276 HydrophobicContact CG-CD1 4.33Å
247	F	98.4	Very high	98.1	Very high	3 Å²	3	48.7 Å²	48.7	1%	0.013	24%	0.243	C	C	.	.			trans	-140.2	131.6	-172.5	-45.6	-57.2	0	0	0	110.4	W231 I245 E252 I253 L258 L276	W231-F247 HydrophobicContact CH2-CE2 4.09Å; W231-F247 HydrophobicContact CZ2-CD2 4.12Å; W231-F247 AromaticContact CZ2-CE2 3.74Å; W231-F247 HydrophobicContact CZ2-CE2 3.74Å; I245-F247 WeakPolarHBondContact CD1-O 3.49Å; F247-E252 HydrophobicContact CB-CB 4.01Å; F247-E252 HydrophobicContact CD1-CB 3.9Å; F247-E252 HydrophobicContact CG-CB 4.32Å; F247-I253 HydrophobicContact CB-CG1 3.66Å; F247-I253 HydrophobicContact CD2-CG1 4.19Å; F247-I253 HydrophobicContact CG-CG1 4.16Å; F247-L258 HydrophobicContact CE1-CD2 3.94Å; F247-L258 HydrophobicContact CE2-CD2 4.24Å; F247-L258 HydrophobicContact CZ-CD2 3.48Å; F247-L258 VanDerWaalsContact CZ-CD2 3.48Å; F247-L258 HydrophobicContact CZ-CG 4.13Å; F247-L276 HydrophobicContact CE2-CD1 4.21Å
248	E	97.4	Very high	98	Very high	105 Å²	105	50.7 Å²	50.7	49%	0.491	25%	0.253	S	S	.	.	S	Bend	trans	-109	-26	177.3	-66.8	177.2	-161.6	0	0	111.8	E252	E248-E252 PolarHBondContact N-OE2 3.18Å
249	Q	98.1	Very high	97.8	Very high	119 Å²	119	58.7 Å²	58.7	56%	0.556	29%	0.285	S	S	*	.	S	Bend	trans	-118.8	150.2	-174.4	-54.8	-58.8	-38.9	0	0	112.4	D251 E252 I253	Q249-D251 PolarHBondContact O-N 3.45Å; Q249-D251 VanDerWaalsContact O-N 3.16Å; Q249-E252 HydrophobicContact CB-CG 4.28Å; Q249-E252 PolarHBondContact N-OE2 3.01Å; Q249-E252 WeakPolarHBondContact O-CB 3.13Å; Q249-E252 PolarHBondContact O-N 3.25Å; Q249-I253 PolarHBondContact O-N 3.16Å
250	D	98.4	Very high	97.7	Very high	56 Å²	56	60 Å²	60	30%	0.299	29%	0.29	S	S	.	.	H	α-helix	trans	-50.8	-42.6	177.3	-75.2	1.3	0	0	0	112.5	R210 I218 E252 I253 L254	R210-D250 IonicContact CZ-OD1 3.53Å; R210-D250 IonicContact CZ-OD2 3.71Å; R210-D250 IonicContact NE-OD1 3.43Å; R210-D250 PolarHBondContact NE-OD1 3.36Å; R210-D250 IonicContact NE-OD2 2.69Å; R210-D250 PolarHBondContact NE-OD2 3.07Å; R210-D250 IonicContact NH2-OD1 2.75Å; R210-D250 PolarHBondContact NH2-OD1 3.04Å; R210-D250 IonicContact NH2-OD2 3.65Å; R210-D250 PolarHBondContact NH2-OD2 3.28Å; I218-D250 HydrophobicContact CG2-CB 3.8Å; D250-E252 VanDerWaalsContact C-N 3.25Å; D250-E252 PolarHBondContact O-N 2.99Å; D250-I253 PolarHBondContact O-N 2.95Å; D250-L254 WeakPolarHBondContact O-CB 3.37Å; D250-L254 WeakPolarHBondContact O-CG 3.2Å; D250-L254 PolarHBondContact O-N 3.45Å
251	D	98.3	Very high	97.1	Very high	98 Å²	98	66.2 Å²	66.2	52%	0.524	31%	0.314	S	S	.	.	H	α-helix	trans	-61.3	-32.2	179.1	-102.7	18	0	0	0	113.2	Q249 K255	Q249-D251 PolarHBondContact O-N 3.45Å; Q249-D251 VanDerWaalsContact O-N 3.16Å; D251-K255 WeakPolarHBondContact O-CB 3.23Å; D251-K255 VanDerWaalsContact O-CD 3.23Å; D251-K255 WeakPolarHBondContact O-CD 3.28Å; D251-K255 WeakPolarHBondContact O-CG 3.42Å; D251-K255 PolarHBondContact O-N 3.33Å; D251-K255 VanDerWaalsContact O-N 3.15Å; D251-K255 IonicContact OD2-NZ 2.79Å; D251-K255 PolarHBondContact OD2-NZ 2.78Å
252	E	98.4	Very high	96.8	Very high	83 Å²	83	72.1 Å²	72.1	39%	0.388	34%	0.336	S	S	.	.	H	α-helix	trans	-76.2	-44.6	178.5	-60.6	178.3	133.8	0	0	110.4	F247 E248 Q249 D250 L254 K255 G256	F247-E252 HydrophobicContact CB-CB 4.01Å; F247-E252 HydrophobicContact CD1-CB 3.9Å; F247-E252 HydrophobicContact CG-CB 4.32Å; E248-E252 PolarHBondContact N-OE2 3.18Å; Q249-E252 HydrophobicContact CB-CG 4.28Å; Q249-E252 PolarHBondContact N-OE2 3.01Å; Q249-E252 WeakPolarHBondContact O-CB 3.13Å; Q249-E252 PolarHBondContact O-N 3.25Å; D250-E252 VanDerWaalsContact C-N 3.25Å; D250-E252 PolarHBondContact O-N 2.99Å; E252-L254 VanDerWaalsContact C-N 3.3Å; E252-L254 PolarHBondContact O-N 3.3Å; E252-K255 PolarHBondContact O-N 3.02Å; E252-K255 VanDerWaalsContact O-N 3.16Å; E252-G256 PolarHBondContact O-N 2.78Å
253	I	98.7	Very high	96.5	Very high	1 Å²	1	83.5 Å²	83.5	1%	0.005	38%	0.377	C	S	.	.	H	α-helix	trans	-55.6	-47.5	173.3	-62.3	170.7	0	0	0	110	P215 I218 W231 F247 Q249 D250 K255 G256	P215-I253 HydrophobicContact CB-CG2 4.27Å; I218-I253 HydrophobicContact CD1-CD1 4.36Å; I218-I253 HydrophobicContact CG1-CD1 4.34Å; I218-I253 HydrophobicContact CG1-CG2 3.92Å; W231-I253 HydrophobicContact CZ2-CG2 3.86Å; F247-I253 HydrophobicContact CB-CG1 3.66Å; F247-I253 HydrophobicContact CD2-CG1 4.19Å; F247-I253 HydrophobicContact CG-CG1 4.16Å; Q249-I253 PolarHBondContact O-N 3.16Å; D250-I253 PolarHBondContact O-N 2.95Å; I253-K255 VanDerWaalsContact C-N 3.33Å; I253-K255 PolarHBondContact O-N 3.05Å; I253-G256 PolarHBondContact O-N 3.27Å
254	L	98.6	Very high	96.5	Very high	62 Å²	62	83 Å²	83	33%	0.325	37%	0.367	S	S	.	.	H	α-helix	trans	-67.5	-30.7	-179.8	-69.2	173.8	0	0	0	113.3	P215 I218 R219 D250 E252	P215-L254 HydrophobicContact CB-CD2 4.24Å; I218-L254 HydrophobicContact CB-CD2 4.09Å; I218-L254 HydrophobicContact CB-CG 4.47Å; I218-L254 HydrophobicContact CG2-CD1 3.99Å; I218-L254 HydrophobicContact CG2-CD2 3.94Å; I218-L254 HydrophobicContact CG2-CG 3.88Å; R219-L254 HydrophobicContact CB-CD2 3.87Å; R219-L254 HydrophobicContact CG-CD2 4.5Å; D250-L254 WeakPolarHBondContact O-CB 3.37Å; D250-L254 WeakPolarHBondContact O-CG 3.2Å; D250-L254 PolarHBondContact O-N 3.45Å; E252-L254 VanDerWaalsContact C-N 3.3Å; E252-L254 PolarHBondContact O-N 3.3Å
255	K	98.1	Very high	96.5	Very high	113 Å²	113	81.9 Å²	81.9	49%	0.491	36%	0.364	S	S	.	.	H	α-helix	trans	-81.6	-28.1	176.5	-73.5	165.3	-165.5	154	0	112.3	D251 E252 I253 R257	D251-K255 WeakPolarHBondContact O-CB 3.23Å; D251-K255 VanDerWaalsContact O-CD 3.23Å; D251-K255 WeakPolarHBondContact O-CD 3.28Å; D251-K255 WeakPolarHBondContact O-CG 3.42Å; D251-K255 PolarHBondContact O-N 3.33Å; D251-K255 VanDerWaalsContact O-N 3.15Å; D251-K255 IonicContact OD2-NZ 2.79Å; D251-K255 PolarHBondContact OD2-NZ 2.78Å; E252-K255 PolarHBondContact O-N 3.02Å; E252-K255 VanDerWaalsContact O-N 3.16Å; I253-K255 VanDerWaalsContact C-N 3.33Å; I253-K255 PolarHBondContact O-N 3.05Å; K255-R257 HydrophobicContact CB-CG 4.31Å; K255-R257 PolarHBondContact O-N 2.99Å
256	G	96	Very high	96.5	Very high	22 Å²	22	84 Å²	84	23%	0.227	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.3	26.4	179.2	0	0	0	0	0	114.3	E252 I253 L258	E252-G256 PolarHBondContact O-N 2.78Å; I253-G256 PolarHBondContact O-N 3.27Å; G256-L258 PolarHBondContact O-N 3.43Å
257	R	96.4	Very high	96.5	Very high	204 Å²	204	87.3 Å²	87.3	77%	0.77	40%	0.399	S	S	*	.			trans	-86.8	105.2	-177.4	-71.1	-177	-178.3	178.1	0.1	110.2	K255	K255-R257 HydrophobicContact CB-CG 4.31Å; K255-R257 PolarHBondContact O-N 2.99Å
258	L	95.9	Very high	96.5	Very high	42 Å²	42	87.2 Å²	87.2	22%	0.22	40%	0.398	C	S	.	.			trans	-83.6	134.5	178.9	-67.6	169.6	0	0	0	112.1	Y238 P246 F247 G256 F260 I272 K273 L276	Y238-L258 HydrophobicContact CD2-CD2 4.27Å; Y238-L258 HydrophobicContact CE2-CD2 4.42Å; P246-L258 HydrophobicContact CB-CD2 3.58Å; P246-L258 HydrophobicContact CG-CD2 4.29Å; F247-L258 HydrophobicContact CE1-CD2 3.94Å; F247-L258 HydrophobicContact CE2-CD2 4.24Å; F247-L258 HydrophobicContact CZ-CD2 3.48Å; F247-L258 VanDerWaalsContact CZ-CD2 3.48Å; F247-L258 HydrophobicContact CZ-CG 4.13Å; G256-L258 PolarHBondContact O-N 3.43Å; L258-F260 HydrophobicContact CB-CE2 4.08Å; L258-F260 HydrophobicContact CB-CZ 4.33Å; L258-F260 HydrophobicContact CD1-CZ 4.22Å; L258-I272 HydrophobicContact CD1-CG2 4.02Å; L258-K273 HydrophobicContact CD1-CG 3.78Å; L258-L276 HydrophobicContact CD1-CB 4.42Å; L258-L276 HydrophobicContact CD1-CD1 4.03Å; L258-L276 HydrophobicContact CD2-CD1 3.71Å; L258-L276 HydrophobicContact CG-CD1 4.41Å
259	Y	95	Very high	96.6	Very high	173 Å²	173	84.6 Å²	84.6	68%	0.678	39%	0.386	S	S	*	.			trans	-123.2	106.7	171	176.3	-101.5	0	0	0	109.8	Y238 R261	Y238-Y259 PolarHBondContact OH-O 3.33Å; Y259-R261 HydrophobicContact CD1-CG 3.79Å; Y259-R261 HydrophobicContact CE1-CB 4.42Å; Y259-R261 HydrophobicContact CE1-CG 3.86Å; Y259-R261 PolarHBondContact O-N 3.28Å
260	F	96.3	Very high	96.6	Very high	34 Å²	34	84.2 Å²	84.2	15%	0.149	38%	0.384	C	S	.	.			trans	-76.5	107.5	178.5	-62.5	-83.9	0	0	0	110	Y238 L258 R262 I264 Q269 I272 K273	Y238-F260 HydrophobicContact CD2-CD1 4.08Å; Y238-F260 AromaticContact CD2-CE1 3.81Å; Y238-F260 HydrophobicContact CD2-CE1 3.81Å; Y238-F260 AromaticContact CE2-CD1 3.82Å; Y238-F260 HydrophobicContact CE2-CD1 3.82Å; Y238-F260 AromaticContact CE2-CE1 3.96Å; Y238-F260 HydrophobicContact CE2-CE1 3.96Å; L258-F260 HydrophobicContact CB-CE2 4.08Å; L258-F260 HydrophobicContact CB-CZ 4.33Å; L258-F260 HydrophobicContact CD1-CZ 4.22Å; F260-R262 PolarHBondContact O-N 2.97Å; F260-I264 HydrophobicContact CD1-CD1 3.4Å; F260-I264 VanDerWaalsContact CD1-CD1 3.4Å; F260-I264 HydrophobicContact CD1-CG1 4.07Å; F260-I264 HydrophobicContact CE1-CD1 3.61Å; F260-I264 HydrophobicContact CG-CD1 4.35Å; F260-Q269 HydrophobicContact CD1-CG 4.16Å; F260-Q269 HydrophobicContact CD2-CG 4.09Å; F260-Q269 HydrophobicContact CE1-CB 4.43Å; F260-Q269 HydrophobicContact CE1-CG 4Å; F260-Q269 HydrophobicContact CE2-CB 4.17Å; F260-Q269 HydrophobicContact CE2-CG 3.97Å; F260-Q269 HydrophobicContact CG-CG 4.18Å; F260-Q269 HydrophobicContact CZ-CB 3.98Å; F260-Q269 HydrophobicContact CZ-CG 3.91Å; F260-I272 HydrophobicContact CE1-CB 4.43Å; F260-I272 HydrophobicContact CE1-CD1 3.91Å; F260-I272 HydrophobicContact CE1-CG2 4.2Å; F260-I272 HydrophobicContact CZ-CB 4.46Å; F260-I272 HydrophobicContact CZ-CG2 4.22Å; F260-K273 VanDerWaalsContact CE2-CE 3.49Å; F260-K273 HydrophobicContact CZ-CG 4.5Å
261	R	87.5	Confident	96.6	Very high	130 Å²	130	81.6 Å²	81.6	49%	0.491	37%	0.37	S	S	.	.	S	Bend	trans	-68.4	-14.6	179.9	-59.7	-179.7	-175.8	173.1	3.5	112.8	D244 Y259	D244-R261 IonicContact OD2-CZ 3.37Å; D244-R261 IonicContact OD2-NH1 3.33Å; D244-R261 PolarHBondContact OD2-NH1 2.65Å; D244-R261 IonicContact OD2-NH2 3.43Å; Y259-R261 HydrophobicContact CD1-CG 3.79Å; Y259-R261 HydrophobicContact CE1-CB 4.42Å; Y259-R261 HydrophobicContact CE1-CG 3.86Å; Y259-R261 PolarHBondContact O-N 3.28Å
262	R	90.5	Very high	96.6	Very high	124 Å²	124	76.9 Å²	76.9	47%	0.468	35%	0.345	S	S	.	.	S	Bend	trans	-129	160.2	-179.8	-64.3	-175.2	64	173.8	-9.4	111.2	A143 F260 I264	A143-R262 PolarHBondContact O-NH1 3.2Å; F260-R262 PolarHBondContact O-N 2.97Å; R262-I264 PolarHBondContact O-N 3.4Å
263	R	93.6	Very high	96.7	Very high	253 Å²	253	77.9 Å²	77.9	96%	0.955	35%	0.348	S	S	*	.			trans	-77.1	114.5	168.3	-68.9	-174.7	-178.9	-174.1	0.7	108.8
264	I	96.7	Very high	96.7	Very high	19 Å²	19	82 Å²	82	10%	0.097	36%	0.364	C	S	.	.			trans	-127.1	158.7	170.5	62.8	170.2	0	0	0	108.4	E146 V241 F260 R262 C268 Q269 I272	E146-I264 VanDerWaalsContact OE1-CA 3.3Å; E146-I264 WeakPolarHBondContact OE1-CA 3.25Å; E146-I264 WeakPolarHBondContact OE1-CB 3.45Å; V241-I264 HydrophobicContact CB-CG2 4.1Å; V241-I264 HydrophobicContact CG2-CD1 3.74Å; V241-I264 HydrophobicContact CG2-CG2 4.14Å; F260-I264 HydrophobicContact CD1-CD1 3.4Å; F260-I264 VanDerWaalsContact CD1-CD1 3.4Å; F260-I264 HydrophobicContact CD1-CG1 4.07Å; F260-I264 HydrophobicContact CE1-CD1 3.61Å; F260-I264 HydrophobicContact CG-CD1 4.35Å; R262-I264 PolarHBondContact O-N 3.4Å; I264-C268 HydrophobicContact CB-CB 4.48Å; I264-C268 HydrophobicContact CD1-CB 4.15Å; I264-Q269 HydrophobicContact CD1-CG 3.76Å; I264-Q269 HydrophobicContact CG1-CG 3.59Å; I264-Q269 PolarHBondContact O-NE2 2.98Å; I264-I272 HydrophobicContact CD1-CD1 3.96Å
265	S	97.8	Very high	96.7	Very high	33 Å²	33	79 Å²	79	23%	0.231	35%	0.348	C	S	.	.			trans	-56.9	153.7	-176.5	69.6	0	0	0	0	112.3	E146 E267 C268 Q269	E146-S265 PolarHBondContact OE1-N 2.91Å; E146-S265 PolarHBondContact OE1-OG 3.25Å; E146-S265 VanDerWaalsContact OE2-CB 3.32Å; E146-S265 WeakPolarHBondContact OE2-CB 3.17Å; E146-S265 PolarHBondContact OE2-OG 2.66Å; S265-E267 PolarHBondContact O-N 3.22Å; S265-C268 PolarHBondContact O-N 3.11Å; S265-C268 VanDerWaalsContact OG-CB 3.25Å; S265-C268 WeakPolarHBondContact OG-CB 3.25Å; S265-C268 PolarHBondContact OG-N 3.13Å; S265-Q269 WeakPolarHBondContact O-CG 3.36Å; S265-Q269 PolarHBondContact O-N 3.12Å
266	A	97.9	Very high	96.7	Very high	70 Å²	70	74 Å²	74	58%	0.579	33%	0.327	S	S	*	.	H	α-helix	trans	-62.5	-36.1	178.3	0	0	0	0	0	110.8	Q269 Q270	A266-Q269 PolarHBondContact O-N 3.17Å; A266-Q270 VanDerWaalsContact O-CB 3.32Å; A266-Q270 WeakPolarHBondContact O-CB 3.45Å; A266-Q270 PolarHBondContact O-N 3.43Å
267	E	98.3	Very high	96.9	Very high	90 Å²	90	74 Å²	74	42%	0.421	32%	0.324	S	S	.	.	H	α-helix	trans	-65.3	-43.7	177.1	-61.8	80.6	179.2	0	0	111.3	S265 Q270 L271 H292 P293 W294	S265-E267 PolarHBondContact O-N 3.22Å; E267-Q270 PolarHBondContact O-N 2.84Å; E267-L271 PolarHBondContact O-N 3.2Å; E267-H292 PolarHBondContact O-CE1 3Å; E267-P293 HydrophobicContact CG-CB 4.43Å; E267-W294 HydrophobicContact CB-CB 3.86Å; E267-W294 HydrophobicContact CB-CG 4.41Å
268	C	98.6	Very high	97	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-62.3	-47.6	175.5	-166.1	0	0	0	0	111	E146 I264 S265 Q270 L271 I272 W294	E146-C268 WeakPolarHBondContact OE2-CB 3.42Å; I264-C268 HydrophobicContact CB-CB 4.48Å; I264-C268 HydrophobicContact CD1-CB 4.15Å; S265-C268 PolarHBondContact O-N 3.11Å; S265-C268 VanDerWaalsContact OG-CB 3.25Å; S265-C268 WeakPolarHBondContact OG-CB 3.25Å; S265-C268 PolarHBondContact OG-N 3.13Å; C268-Q270 VanDerWaalsContact C-N 3.27Å; C268-Q270 PolarHBondContact O-N 3.24Å; C268-L271 PolarHBondContact O-N 2.96Å; C268-I272 WeakPolarHBondContact O-CG1 3.36Å; C268-I272 PolarHBondContact O-N 3.31Å; C268-W294 HydrophobicContact CB-CD2 4.38Å; C268-W294 HydrophobicContact CB-CG 4.17Å; C268-W294 VanDerWaalsContact CB-NE1 3.34Å
269	Q	98.7	Very high	97.1	Very high	50 Å²	50	73.2 Å²	73.2	23%	0.234	32%	0.324	C	S	.	.	H	α-helix	trans	-60	-39.4	177	-66.2	-178.9	43.1	0	0	112	F260 I264 S265 A266 K273	F260-Q269 HydrophobicContact CD1-CG 4.16Å; F260-Q269 HydrophobicContact CD2-CG 4.09Å; F260-Q269 HydrophobicContact CE1-CB 4.43Å; F260-Q269 HydrophobicContact CE1-CG 4Å; F260-Q269 HydrophobicContact CE2-CB 4.17Å; F260-Q269 HydrophobicContact CE2-CG 3.97Å; F260-Q269 HydrophobicContact CG-CG 4.18Å; F260-Q269 HydrophobicContact CZ-CB 3.98Å; F260-Q269 HydrophobicContact CZ-CG 3.91Å; I264-Q269 HydrophobicContact CD1-CG 3.76Å; I264-Q269 HydrophobicContact CG1-CG 3.59Å; I264-Q269 PolarHBondContact O-NE2 2.98Å; S265-Q269 WeakPolarHBondContact O-CG 3.36Å; S265-Q269 PolarHBondContact O-N 3.12Å; A266-Q269 PolarHBondContact O-N 3.17Å; Q269-K273 VanDerWaalsContact O-CB 3.31Å; Q269-K273 WeakPolarHBondContact O-CB 3.31Å; Q269-K273 WeakPolarHBondContact O-CD 3.33Å; Q269-K273 WeakPolarHBondContact O-CG 3.43Å; Q269-K273 PolarHBondContact O-N 3.34Å
270	Q	98.6	Very high	97.3	Very high	112 Å²	112	67.2 Å²	67.2	52%	0.523	31%	0.306	S	S	.	.	H	α-helix	trans	-62.6	-47.5	178.2	-177.6	-179.8	19.1	0	0	110.9	A266 E267 C268 K273 W274	A266-Q270 VanDerWaalsContact O-CB 3.32Å; A266-Q270 WeakPolarHBondContact O-CB 3.45Å; A266-Q270 PolarHBondContact O-N 3.43Å; E267-Q270 PolarHBondContact O-N 2.84Å; C268-Q270 VanDerWaalsContact C-N 3.27Å; C268-Q270 PolarHBondContact O-N 3.24Å; Q270-K273 PolarHBondContact O-N 2.85Å; Q270-W274 WeakPolarHBondContact O-CB 3.36Å; Q270-W274 PolarHBondContact O-N 2.9Å
271	L	98.9	Very high	97.4	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-62	-47.8	178.7	-177.6	55	0	0	0	111.7	F153 L237 E267 C268 K273 W274 C275 I289 H292 W294 M295	F153-L271 HydrophobicContact CE1-CD2 4.32Å; L237-L271 HydrophobicContact CD2-CD2 3.81Å; L237-L271 HydrophobicContact CD2-CG 4.03Å; E267-L271 PolarHBondContact O-N 3.2Å; C268-L271 PolarHBondContact O-N 2.96Å; L271-K273 PolarHBondContact O-N 3.43Å; L271-W274 PolarHBondContact O-N 3.37Å; L271-W274 VanDerWaalsContact O-N 3.16Å; L271-C275 PolarHBondContact O-N 2.93Å; L271-C275 PolarHBondContact O-SG 3.3Å; L271-I289 HydrophobicContact CD1-CG1 4.26Å; L271-I289 HydrophobicContact CD1-CG2 4.17Å; L271-I289 HydrophobicContact CD2-CG2 4.4Å; L271-H292 HydrophobicContact CD1-CB 4.06Å; L271-H292 HydrophobicContact CD2-CB 4.48Å; L271-W294 HydrophobicContact CD2-CB 4.46Å; L271-W294 HydrophobicContact CD2-CD2 4.41Å; L271-W294 HydrophobicContact CD2-CE3 3.62Å; L271-W294 HydrophobicContact CD2-CZ3 4.31Å; L271-M295 HydrophobicContact CD2-CG 4.16Å; L271-M295 HydrophobicContact CD2-SD 4.15Å
272	I	98.9	Very high	97.9	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-57.9	-49.3	177.7	-68.2	166.7	0	0	0	110.6	L237 Y238 V241 L258 F260 I264 C268 W274 C275 L276	L237-I272 HydrophobicContact CB-CG1 4.25Å; L237-I272 HydrophobicContact CD2-CD1 4.46Å; L237-I272 HydrophobicContact CD2-CG1 3.69Å; L237-I272 HydrophobicContact CG-CD1 4.12Å; L237-I272 HydrophobicContact CG-CG1 3.73Å; Y238-I272 HydrophobicContact CD2-CG2 4.19Å; V241-I272 HydrophobicContact CG2-CD1 3.88Å; L258-I272 HydrophobicContact CD1-CG2 4.02Å; F260-I272 HydrophobicContact CE1-CB 4.43Å; F260-I272 HydrophobicContact CE1-CD1 3.91Å; F260-I272 HydrophobicContact CE1-CG2 4.2Å; F260-I272 HydrophobicContact CZ-CB 4.46Å; F260-I272 HydrophobicContact CZ-CG2 4.22Å; I264-I272 HydrophobicContact CD1-CD1 3.96Å; C268-I272 WeakPolarHBondContact O-CG1 3.36Å; C268-I272 PolarHBondContact O-N 3.31Å; I272-W274 VanDerWaalsContact C-N 3.26Å; I272-W274 PolarHBondContact O-N 3.15Å; I272-C275 PolarHBondContact O-N 3.16Å; I272-L276 HydrophobicContact CG2-CD1 3.86Å; I272-L276 WeakPolarHBondContact O-CB 3.39Å; I272-L276 WeakPolarHBondContact O-CG 3.17Å; I272-L276 PolarHBondContact O-N 3.21Å
273	K	98.8	Very high	98.3	Very high	104 Å²	104	61.5 Å²	61.5	45%	0.452	30%	0.302	S	S	.	.	H	α-helix	trans	-60.3	-36.8	178	-74.9	166.9	-169.3	168.9	0	112.1	L258 F260 Q269 Q270 L271 L276 A277	L258-K273 HydrophobicContact CD1-CG 3.78Å; F260-K273 VanDerWaalsContact CE2-CE 3.49Å; F260-K273 HydrophobicContact CZ-CG 4.5Å; Q269-K273 VanDerWaalsContact O-CB 3.31Å; Q269-K273 WeakPolarHBondContact O-CB 3.31Å; Q269-K273 WeakPolarHBondContact O-CD 3.33Å; Q269-K273 WeakPolarHBondContact O-CG 3.43Å; Q269-K273 PolarHBondContact O-N 3.34Å; Q270-K273 PolarHBondContact O-N 2.85Å; L271-K273 PolarHBondContact O-N 3.43Å; K273-L276 CarbonylContact O-C 3.6Å; K273-L276 PolarHBondContact O-N 3.16Å; K273-A277 PolarHBondContact O-N 3.41Å
274	W	98.9	Very high	98.6	Very high	86 Å²	86	49.7 Å²	49.7	33%	0.326	26%	0.258	S	S	.	.	H	α-helix	trans	-70.3	-45.4	-179.6	-166.4	18.1	0	0	0	111.7	Q270 L271 I272 L276 A277 D282 P284 Q288	Q270-W274 WeakPolarHBondContact O-CB 3.36Å; Q270-W274 PolarHBondContact O-N 2.9Å; L271-W274 PolarHBondContact O-N 3.37Å; L271-W274 VanDerWaalsContact O-N 3.16Å; I272-W274 VanDerWaalsContact C-N 3.26Å; I272-W274 PolarHBondContact O-N 3.15Å; W274-L276 VanDerWaalsContact C-N 3.26Å; W274-L276 PolarHBondContact O-N 2.92Å; W274-A277 WeakPolarHBondContact O-CB 3.32Å; W274-A277 PolarHBondContact O-N 3.4Å; W274-D282 PolarHBondContact NE1-O 3.17Å; W274-P284 HydrophobicContact CD2-CB 3.69Å; W274-P284 HydrophobicContact CD2-CG 3.77Å; W274-P284 HydrophobicContact CE3-CB 3.74Å; W274-P284 HydrophobicContact CE3-CG 3.96Å; W274-P284 HydrophobicContact CG-CB 4.41Å; W274-P284 HydrophobicContact CG-CG 4.03Å; W274-P284 HydrophobicContact CH2-CB 3.76Å; W274-P284 HydrophobicContact CZ2-CB 3.68Å; W274-P284 HydrophobicContact CZ3-CB 3.78Å; W274-P284 HydrophobicContact CZ3-CG 4.46Å; W274-P284 WeakPolarHBondContact O-CD 3.35Å; W274-Q288 HydrophobicContact CH2-CB 3.78Å; W274-Q288 HydrophobicContact CH2-CG 4.34Å; W274-Q288 HydrophobicContact CZ3-CB 4.27Å
275	C	98.9	Very high	98.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-59.7	-37.4	172.6	-68.8	0	0	0	0	112.3	V230 L271 I272 A277 R283	V230-C275 HydrophobicContact CG1-CB 4.1Å; L271-C275 PolarHBondContact O-N 2.93Å; L271-C275 PolarHBondContact O-SG 3.3Å; I272-C275 PolarHBondContact O-N 3.16Å; C275-A277 VanDerWaalsContact C-N 3.3Å; C275-A277 PolarHBondContact O-N 3.28Å; C275-R283 WeakPolarHBondContact O-CD 3.41Å; C275-R283 WeakPolarHBondContact O-CG 3.44Å
276	L	98.9	Very high	98.7	Very high	8 Å²	8	50.9 Å²	50.9	4%	0.042	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92	25.2	-179.5	-60.1	-179.9	0	0	0	113.6	W231 V235 P246 F247 L258 I272 K273 W274 L278	W231-L276 HydrophobicContact CD2-CD2 3.65Å; W231-L276 HydrophobicContact CE3-CB 4.37Å; W231-L276 HydrophobicContact CE3-CD2 3.88Å; W231-L276 HydrophobicContact CG-CD2 4.06Å; W231-L276 HydrophobicContact CH2-CB 4.46Å; W231-L276 HydrophobicContact CH2-CD2 4.35Å; W231-L276 HydrophobicContact CZ2-CD2 4.13Å; W231-L276 HydrophobicContact CZ3-CB 4.14Å; W231-L276 HydrophobicContact CZ3-CD2 4.24Å; W231-L276 VanDerWaalsContact CZ3-O 3.25Å; W231-L276 WeakPolarHBondContact CZ3-O 3.41Å; W231-L276 VanDerWaalsContact O-CD2 3.31Å; W231-L276 WeakPolarHBondContact O-CD2 3.12Å; V235-L276 HydrophobicContact CG2-CD2 3.81Å; P246-L276 HydrophobicContact CG-CD1 4.33Å; F247-L276 HydrophobicContact CE2-CD1 4.21Å; L258-L276 HydrophobicContact CD1-CB 4.42Å; L258-L276 HydrophobicContact CD1-CD1 4.03Å; L258-L276 HydrophobicContact CD2-CD1 3.71Å; L258-L276 HydrophobicContact CG-CD1 4.41Å; I272-L276 HydrophobicContact CG2-CD1 3.86Å; I272-L276 WeakPolarHBondContact O-CB 3.39Å; I272-L276 WeakPolarHBondContact O-CG 3.17Å; I272-L276 PolarHBondContact O-N 3.21Å; K273-L276 CarbonylContact O-C 3.6Å; K273-L276 PolarHBondContact O-N 3.16Å; W274-L276 VanDerWaalsContact C-N 3.26Å; W274-L276 PolarHBondContact O-N 2.92Å; L276-L278 PolarHBondContact O-N 3.21Å
277	A	98.9	Very high	98.7	Very high	21 Å²	21	52.2 Å²	52.2	17%	0.174	26%	0.258	C	S	.	.			trans	-62.6	131.8	170.6	0	0	0	0	0	110.7	K273 W274 C275 R279 D282 R283	K273-A277 PolarHBondContact O-N 3.41Å; W274-A277 WeakPolarHBondContact O-CB 3.32Å; W274-A277 PolarHBondContact O-N 3.4Å; C275-A277 VanDerWaalsContact C-N 3.3Å; C275-A277 PolarHBondContact O-N 3.28Å; A277-R279 VanDerWaalsContact C-N 3.32Å; A277-R279 PolarHBondContact O-N 2.85Å; A277-D282 HydrophobicContact CB-CB 3.98Å; A277-R283 HydrophobicContact CB-CG 3.98Å; A277-R283 PolarHBondContact O-NE 3.46Å; A277-R283 PolarHBondContact O-NH2 3.41Å
278	L	98.8	Very high	98.7	Very high	81 Å²	81	52 Å²	52	42%	0.424	26%	0.257	S	S	.	.	S	Bend	trans	-62.4	-38	-176.8	-70.6	178.4	0	0	0	112.6	P215 W231 L276	P215-L278 HydrophobicContact CB-CD2 4.28Å; P215-L278 HydrophobicContact CG-CD2 4.02Å; W231-L278 HydrophobicContact CH2-CD2 4.39Å; W231-L278 HydrophobicContact CZ3-CD2 4.48Å; L276-L278 PolarHBondContact O-N 3.21Å
279	R	98.7	Very high	98.7	Very high	149 Å²	149	52 Å²	52	56%	0.562	26%	0.257	S	S	*	.	S	Bend	trans	-83.2	125.4	175.3	-72.4	179.3	63.3	-130.4	0.7	109.2	A277 S281 D282	A277-R279 VanDerWaalsContact C-N 3.32Å; A277-R279 PolarHBondContact O-N 2.85Å; R279-S281 PolarHBondContact NH2-OG 2.96Å; R279-S281 PolarHBondContact O-N 3.49Å; R279-S281 VanDerWaalsContact O-N 3.14Å; R279-D282 HydrophobicContact CB-CB 4.22Å; R279-D282 WeakPolarHBondContact CB-OD2 3.35Å; R279-D282 WeakPolarHBondContact CD-OD2 3.34Å; R279-D282 IonicContact CZ-OD1 2.92Å; R279-D282 IonicContact CZ-OD2 3.48Å; R279-D282 IonicContact NE-OD2 2.86Å; R279-D282 IonicContact NH1-OD1 3.61Å; R279-D282 PolarHBondContact NH1-OD1 3.46Å; R279-D282 IonicContact NH1-OD2 3.94Å; R279-D282 PolarHBondContact NH1-OD2 3.25Å; R279-D282 IonicContact NH2-OD1 3.6Å; R279-D282 PolarHBondContact O-N 3.4Å
280	P	98.8	Very high	98.6	Very high	47 Å²	47	51.5 Å²	51.5	31%	0.305	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-58.3	-31	-178.8	-27.4	36.4	0	0	0	114.1	E216 D282	E216-P280 HydrophobicContact CB-CG 4.44Å; E216-P280 VanDerWaalsContact CD-CG 3.46Å; E216-P280 HydrophobicContact CG-CG 4.07Å; E216-P280 WeakPolarHBondContact OE1-CG 3.47Å; P280-D282 VanDerWaalsContact C-N 3.25Å; P280-D282 PolarHBondContact O-N 2.74Å
281	S	98.6	Very high	98.5	Very high	83 Å²	83	52 Å²	52	58%	0.58	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-70.7	-18.3	178.2	58.1	0	0	0	0	114.3	R279	R279-S281 PolarHBondContact NH2-OG 2.96Å; R279-S281 PolarHBondContact O-N 3.49Å; R279-S281 VanDerWaalsContact O-N 3.14Å
282	D	98.8	Very high	98.5	Very high	71 Å²	71	52.4 Å²	52.4	38%	0.38	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-95.8	-4.5	-175	-58.4	-6.7	0	0	0	110.9	W274 A277 R279 P280	W274-D282 PolarHBondContact NE1-O 3.17Å; A277-D282 HydrophobicContact CB-CB 3.98Å; R279-D282 HydrophobicContact CB-CB 4.22Å; R279-D282 WeakPolarHBondContact CB-OD2 3.35Å; R279-D282 WeakPolarHBondContact CD-OD2 3.34Å; R279-D282 IonicContact CZ-OD1 2.92Å; R279-D282 IonicContact CZ-OD2 3.48Å; R279-D282 IonicContact NE-OD2 2.86Å; R279-D282 IonicContact NH1-OD1 3.61Å; R279-D282 PolarHBondContact NH1-OD1 3.46Å; R279-D282 IonicContact NH1-OD2 3.94Å; R279-D282 PolarHBondContact NH1-OD2 3.25Å; R279-D282 IonicContact NH2-OD1 3.6Å; R279-D282 PolarHBondContact O-N 3.4Å; P280-D282 VanDerWaalsContact C-N 3.25Å; P280-D282 PolarHBondContact O-N 2.74Å
283	R	98.9	Very high	98.5	Very high	15 Å²	15	56.1 Å²	56.1	6%	0.057	29%	0.292	C	S	.	.	S	Bend	trans	-78.1	146.9	174.4	-61.6	-178.8	-165	142.3	11.7	110.6	E216 S227 V230 C275 A277	E216-R283 IonicContact OE1-CZ 2.63Å; E216-R283 IonicContact OE1-NH1 2.78Å; E216-R283 PolarHBondContact OE1-NH1 3.4Å; E216-R283 IonicContact OE1-NH2 3.75Å; E216-R283 PolarHBondContact OE1-NH2 2.96Å; E216-R283 IonicContact OE2-CZ 3.57Å; E216-R283 IonicContact OE2-NH1 3.8Å; E216-R283 IonicContact OE2-NH2 2.79Å; E216-R283 PolarHBondContact OE2-NH2 3.44Å; S227-R283 WeakPolarHBondContact O-CD 3.49Å; S227-R283 PolarHBondContact O-NH1 3.45Å; V230-R283 HydrophobicContact CB-CB 4.48Å; V230-R283 HydrophobicContact CG1-CB 3.84Å; V230-R283 HydrophobicContact CG1-CG 4.5Å; C275-R283 WeakPolarHBondContact O-CD 3.41Å; C275-R283 WeakPolarHBondContact O-CG 3.44Å; A277-R283 HydrophobicContact CB-CG 3.98Å; A277-R283 PolarHBondContact O-NE 3.46Å; A277-R283 PolarHBondContact O-NH2 3.41Å
284	P	98.8	Very high	98.4	Very high	4 Å²	4	51.6 Å²	51.6	3%	0.026	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-68.2	157.2	177.5	27.9	-33	0	0	0	112.1	V230 W274 Q288 I289	V230-P284 HydrophobicContact CG1-CG 4.01Å; V230-P284 WeakPolarHBondContact CG2-O 3.43Å; W274-P284 HydrophobicContact CD2-CB 3.69Å; W274-P284 HydrophobicContact CD2-CG 3.77Å; W274-P284 HydrophobicContact CE3-CB 3.74Å; W274-P284 HydrophobicContact CE3-CG 3.96Å; W274-P284 HydrophobicContact CG-CB 4.41Å; W274-P284 HydrophobicContact CG-CG 4.03Å; W274-P284 HydrophobicContact CH2-CB 3.76Å; W274-P284 HydrophobicContact CZ2-CB 3.68Å; W274-P284 HydrophobicContact CZ3-CB 3.78Å; W274-P284 HydrophobicContact CZ3-CG 4.46Å; W274-P284 WeakPolarHBondContact O-CD 3.35Å; P284-Q288 HydrophobicContact CB-CB 3.87Å; P284-I289 HydrophobicContact CB-CG1 3.87Å; P284-I289 HydrophobicContact CG-CD1 4.02Å; P284-I289 HydrophobicContact CG-CG1 3.56Å
285	T	98.8	Very high	98.4	Very high	66 Å²	66	48.3 Å²	48.3	41%	0.405	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-75.5	167	161.2	78.5	0	0	0	0	110.9	E287 Q288 I289	T285-E287 VanDerWaalsContact CB-OE2 3.25Å; T285-E287 WeakPolarHBondContact CB-OE2 3.4Å; T285-E287 PolarHBondContact O-N 3.27Å; T285-E287 PolarHBondContact OG1-N 3.38Å; T285-E287 PolarHBondContact OG1-OE2 3.3Å; T285-Q288 PolarHBondContact O-N 3.41Å; T285-Q288 PolarHBondContact OG1-N 3.43Å; T285-I289 WeakPolarHBondContact O-CG1 3.46Å; T285-I289 PolarHBondContact O-N 2.83Å
286	L	98.2	Very high	97.9	Very high	11 Å²	11	56.9 Å²	56.9	6%	0.058	29%	0.292	C	S	.	.	H	α-helix	trans	-61.2	-36.1	176.5	-63.4	-176.2	0	0	0	112	L157 V160 R161 Y164 V230 L233 I289 C290	L157-L286 HydrophobicContact CD2-CD2 4.01Å; V160-L286 HydrophobicContact CB-CD1 4.45Å; V160-L286 HydrophobicContact CG1-CD1 3.77Å; R161-L286 HydrophobicContact CG-CB 4.39Å; R161-L286 HydrophobicContact CG-CD1 3.75Å; Y164-L286 HydrophobicContact CD2-CD1 3.75Å; Y164-L286 HydrophobicContact CE2-CD1 3.6Å; Y164-L286 HydrophobicContact CE2-CG 4.39Å; V230-L286 HydrophobicContact CG2-CD2 4.29Å; L233-L286 HydrophobicContact CD1-CD2 3.66Å; L286-I289 HydrophobicContact CD2-CD1 4.28Å; L286-I289 PolarHBondContact O-N 2.75Å; L286-C290 PolarHBondContact O-N 3.37Å; L286-C290 PolarHBondContact O-SG 3.19Å
287	E	97.8	Very high	96.4	Very high	98 Å²	98	61.6 Å²	61.6	46%	0.458	32%	0.318	S	S	.	.	H	α-helix	trans	-63.5	-45.6	175.6	-58.9	72.8	-158.2	0	0	110.8	T285 I289 C290 D291	T285-E287 VanDerWaalsContact CB-OE2 3.25Å; T285-E287 WeakPolarHBondContact CB-OE2 3.4Å; T285-E287 PolarHBondContact O-N 3.27Å; T285-E287 PolarHBondContact OG1-N 3.38Å; T285-E287 PolarHBondContact OG1-OE2 3.3Å; E287-I289 VanDerWaalsContact C-N 3.29Å; E287-I289 PolarHBondContact O-N 2.9Å; E287-C290 WeakPolarHBondContact O-CB 3.49Å; E287-C290 PolarHBondContact O-N 2.88Å; E287-D291 PolarHBondContact O-N 3.11Å
288	Q	98.6	Very high	94.4	Very high	85 Å²	85	65.7 Å²	65.7	40%	0.397	34%	0.341	S	S	.	.	H	α-helix	trans	-64	-33.4	176.5	-70.7	177.9	-43.1	0	0	112.9	W274 P284 T285 H292	W274-Q288 HydrophobicContact CH2-CB 3.78Å; W274-Q288 HydrophobicContact CH2-CG 4.34Å; W274-Q288 HydrophobicContact CZ3-CB 4.27Å; P284-Q288 HydrophobicContact CB-CB 3.87Å; T285-Q288 PolarHBondContact O-N 3.41Å; T285-Q288 PolarHBondContact OG1-N 3.43Å; Q288-H292 PolarHBondContact O-N 2.94Å
289	I	98.7	Very high	92.2	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-64.2	-51.6	171.4	-66.2	170.4	0	0	0	109.6	F153 L157 V230 L271 P284 T285 L286 E287 D291 H292 M295	F153-I289 HydrophobicContact CE1-CG2 3.77Å; L157-I289 HydrophobicContact CD1-CG2 3.59Å; L157-I289 HydrophobicContact CD2-CB 4.49Å; L157-I289 HydrophobicContact CD2-CD1 4.38Å; L157-I289 HydrophobicContact CD2-CG2 3.91Å; L157-I289 HydrophobicContact CG-CG2 4.4Å; V230-I289 HydrophobicContact CG1-CD1 4.15Å; V230-I289 HydrophobicContact CG2-CD1 4.33Å; L271-I289 HydrophobicContact CD1-CG1 4.26Å; L271-I289 HydrophobicContact CD1-CG2 4.17Å; L271-I289 HydrophobicContact CD2-CG2 4.4Å; P284-I289 HydrophobicContact CB-CG1 3.87Å; P284-I289 HydrophobicContact CG-CD1 4.02Å; P284-I289 HydrophobicContact CG-CG1 3.56Å; T285-I289 WeakPolarHBondContact O-CG1 3.46Å; T285-I289 PolarHBondContact O-N 2.83Å; L286-I289 HydrophobicContact CD2-CD1 4.28Å; L286-I289 PolarHBondContact O-N 2.75Å; E287-I289 VanDerWaalsContact C-N 3.29Å; E287-I289 PolarHBondContact O-N 2.9Å; I289-D291 PolarHBondContact O-N 2.88Å; I289-H292 WeakPolarHBondContact O-CB 3.25Å; I289-H292 PolarHBondContact O-N 3.04Å; I289-M295 WeakPolarHBondContact O-CG 3.34Å
290	C	97.1	Very high	89.6	Confident	41 Å²	41	71.8 Å²	71.8	28%	0.277	37%	0.374	S	S	.	.	H	α-helix	trans	-56.8	-36.2	179.3	-69.3	0	0	0	0	112.8	L286 E287 H292 M295	L286-C290 PolarHBondContact O-N 3.37Å; L286-C290 PolarHBondContact O-SG 3.19Å; E287-C290 WeakPolarHBondContact O-CB 3.49Å; E287-C290 PolarHBondContact O-N 2.88Å; C290-H292 VanDerWaalsContact C-N 3.31Å; C290-M295 WeakPolarHBondContact O-CB 3.46Å
291	D	97.1	Very high	86.6	Confident	121 Å²	121	73.6 Å²	73.6	65%	0.647	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-6.6	179.5	-67.4	-25.1	0	0	0	113.6	E287 I289	E287-D291 PolarHBondContact O-N 3.11Å; I289-D291 PolarHBondContact O-N 2.88Å
292	H	98.4	Very high	83.8	Confident	9 Å²	9	75.6 Å²	75.6	4%	0.042	40%	0.398	C	S	.	.	S	Bend	trans	-61.8	140	-178	-172.3	-87.2	0	0	0	110.9	E267 L271 Q288 I289 C290 W294 M295	E267-H292 PolarHBondContact O-CE1 3Å; L271-H292 HydrophobicContact CD1-CB 4.06Å; L271-H292 HydrophobicContact CD2-CB 4.48Å; Q288-H292 PolarHBondContact O-N 2.94Å; I289-H292 WeakPolarHBondContact O-CB 3.25Å; I289-H292 PolarHBondContact O-N 3.04Å; C290-H292 VanDerWaalsContact C-N 3.31Å; H292-W294 WeakPolarHBondContact ND1-CB 3.26Å; H292-W294 PolarHBondContact ND1-N 3.38Å; H292-W294 VanDerWaalsContact ND1-N 3.12Å; H292-W294 PolarHBondContact O-N 3.46Å; H292-W294 VanDerWaalsContact O-N 3.11Å; H292-M295 HydrophobicContact CB-CG 4.35Å; H292-M295 WeakPolarHBondContact O-CB 3.41Å; H292-M295 PolarHBondContact O-N 2.96Å
293	P	97.6	Very high	80.9	Confident	79 Å²	79	81.9 Å²	81.9	51%	0.513	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-51.3	-39.7	-178.3	-30.7	36.2	0	0	0	114.6	E267 M295 R296	E267-P293 HydrophobicContact CG-CB 4.43Å; P293-M295 PolarHBondContact O-N 3.26Å; P293-R296 PolarHBondContact O-N 3.34Å; P293-R296 VanDerWaalsContact O-N 3.13Å
294	W	98.2	Very high	78.1	Confident	8 Å²	8	85.6 Å²	85.6	3%	0.03	45%	0.45	C	S	.	.	G	3₁₀ helix	trans	-58.8	-28.9	175.9	-171.5	74.2	0	0	0	113.9	E146 A149 R150 F153 L237 E267 C268 L271 H292	E146-W294 HydrophobicContact CB-CZ2 4.18Å; E146-W294 HydrophobicContact CG-CZ2 4.46Å; E146-W294 PolarHBondContact OE2-NE1 3.33Å; A149-W294 HydrophobicContact CB-CH2 4.35Å; R150-W294 VanDerWaalsContact CA-CH2 3.49Å; R150-W294 HydrophobicContact CB-CH2 3.71Å; R150-W294 HydrophobicContact CB-CZ2 4.02Å; R150-W294 HydrophobicContact CB-CZ3 4.09Å; R150-W294 VanDerWaalsContact CD-O 3.28Å; R150-W294 WeakPolarHBondContact CD-O 3.39Å; R150-W294 HydrophobicContact CG-CE3 4.48Å; R150-W294 HydrophobicContact CG-CH2 4.3Å; R150-W294 HydrophobicContact CG-CZ3 4.18Å; R150-W294 PolarHBondContact NE-O 3.33Å; F153-W294 HydrophobicContact CB-CZ3 4.44Å; F153-W294 HydrophobicContact CD1-CZ3 4.13Å; L237-W294 HydrophobicContact CD1-CH2 3.39Å; L237-W294 HydrophobicContact CD1-CZ2 4.18Å; L237-W294 HydrophobicContact CD1-CZ3 3.69Å; L237-W294 HydrophobicContact CD2-CE3 4.38Å; L237-W294 HydrophobicContact CD2-CH2 4.46Å; L237-W294 HydrophobicContact CD2-CZ3 4.03Å; E267-W294 HydrophobicContact CB-CB 3.86Å; E267-W294 HydrophobicContact CB-CG 4.41Å; C268-W294 HydrophobicContact CB-CD2 4.38Å; C268-W294 HydrophobicContact CB-CG 4.17Å; C268-W294 VanDerWaalsContact CB-NE1 3.34Å; L271-W294 HydrophobicContact CD2-CB 4.46Å; L271-W294 HydrophobicContact CD2-CD2 4.41Å; L271-W294 HydrophobicContact CD2-CE3 3.62Å; L271-W294 HydrophobicContact CD2-CZ3 4.31Å; H292-W294 WeakPolarHBondContact ND1-CB 3.26Å; H292-W294 PolarHBondContact ND1-N 3.38Å; H292-W294 VanDerWaalsContact ND1-N 3.12Å; H292-W294 PolarHBondContact O-N 3.46Å; H292-W294 VanDerWaalsContact O-N 3.11Å
295	M	97.2	Very high	75.6	Confident	17 Å²	17	91.7 Å²	91.7	8%	0.084	49%	0.49	C	S	.	.	G	3₁₀ helix	trans	-82.6	-15	-179.7	-65.2	-59.3	-67.2	0	0	113.1	R150 F153 C154 L157 L271 I289 C290 H292 P293	R150-M295 HydrophobicContact CG-SD 4.39Å; F153-M295 HydrophobicContact CD1-CE 4.01Å; F153-M295 HydrophobicContact CD1-SD 3.73Å; F153-M295 HydrophobicContact CE1-SD 4.33Å; C154-M295 HydrophobicContact CB-CE 4.34Å; C154-M295 WeakPolarHBondContact SG-CE 3.42Å; L157-M295 HydrophobicContact CD1-CE 3.53Å; L271-M295 HydrophobicContact CD2-CG 4.16Å; L271-M295 HydrophobicContact CD2-SD 4.15Å; I289-M295 WeakPolarHBondContact O-CG 3.34Å; C290-M295 WeakPolarHBondContact O-CB 3.46Å; H292-M295 HydrophobicContact CB-CG 4.35Å; H292-M295 WeakPolarHBondContact O-CB 3.41Å; H292-M295 PolarHBondContact O-N 2.96Å; P293-M295 PolarHBondContact O-N 3.26Å
296	R	88.7	Confident	72.9	Confident	180 Å²	180	96.5 Å²	96.5	68%	0.679	51%	0.508	S	S	*	.	S	Bend	trans	-83	120.7	-178.3	-57.1	179.1	82.8	167.7	4.8	108.6	P293 T298	P293-R296 PolarHBondContact O-N 3.34Å; P293-R296 VanDerWaalsContact O-N 3.13Å; R296-T298 PolarHBondContact O-N 3.19Å
297	N	67.9	Low	70.3	Confident	107 Å²	107	104.6 Å²	104.6	57%	0.572	55%	0.546	S	S	*	.			trans	-59.9	126.3	176.6	-102.1	-1.9	0	0	0	110.5	E299	N297-E299 PolarHBondContact O-N 2.69Å
298	T	56.5	Low	67.6	Low	108 Å²	108	107.3 Å²	107.3	66%	0.663	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-73	-6.3	174.3	38.5	0	0	0	0	113.6	R296 E300 S301	R296-T298 PolarHBondContact O-N 3.19Å; T298-E300 VanDerWaalsContact C-N 3.29Å; T298-E300 PolarHBondContact O-N 2.8Å; T298-S301 PolarHBondContact O-OG 3.26Å
299	E	52.7	Low	64.8	Low	174 Å²	174	107.9 Å²	107.9	81%	0.813	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-74.5	-11.3	-179.4	-67.1	-120.5	147.3	0	0	114.4	N297 S301	N297-E299 PolarHBondContact O-N 2.69Å; E299-S301 VanDerWaalsContact C-N 3.3Å; E299-S301 PolarHBondContact O-N 3.27Å
300	E	44.7	Very low	62	Low	184 Å²	184	112.9 Å²	112.9	86%	0.86	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-93.5	28.4	173.3	-68	-171.2	171.8	0	0	113.3	T298	T298-E300 VanDerWaalsContact C-N 3.29Å; T298-E300 PolarHBondContact O-N 2.8Å
301	S	36.1	Very low	59	Low	85 Å²	85	114.3 Å²	114.3	59%	0.594	65%	0.651	S	S	*	*	S	Bend	trans	-80.5	122.4	162.5	43.4	0	0	0	0	108.6	T298 E299 K303	T298-S301 PolarHBondContact O-OG 3.26Å; E299-S301 VanDerWaalsContact C-N 3.3Å; E299-S301 PolarHBondContact O-N 3.27Å; S301-K303 PolarHBondContact O-N 2.93Å
302	P	40	Very low	56.2	Low	124 Å²	124	116.9 Å²	116.9	81%	0.805	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-60.8	117.8	175.9	23.1	-29.8	0	0	0	107.8	S304	P302-S304 PolarHBondContact O-N 2.98Å
303	K	37.4	Very low	53.3	Low	203 Å²	203	124.3 Å²	124.3	88%	0.883	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-49.4	118.4	169.7	-68.2	-179	179.8	177.5	0	107.5	S301	S301-K303 PolarHBondContact O-N 2.93Å
304	S	39.2	Very low	50.4	Low	93 Å²	93	130.4 Å²	130.4	65%	0.65	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-53.5	135.8	170.8	46.8	0	0	0	0	109.3	P302 E306	P302-S304 PolarHBondContact O-N 2.98Å; S304-E306 PolarHBondContact O-N 3.14Å
305	P	46.2	Very low	47.6	Very low	133 Å²	133	138 Å²	138	86%	0.864	75%	0.751	S	S	*	*			trans	-80.9	84.8	179.4	31.9	-31.7	0	0	0	110.4
306	E	43.5	Very low	44.6	Very low	167 Å²	167	147.5 Å²	147.5	78%	0.78	79%	0.786	S	S	*	*			trans	-148	121.7	168.5	-79.1	-173.4	173.7	0	0	105.6	S304	S304-E306 PolarHBondContact O-N 3.14Å
307	E	42.8	Very low	42.2	Very low	181 Å²	181	145.1 Å²	145.1	85%	0.846	79%	0.791	S	S	*	*			cis	-148.6	122.3	13.5	-69.6	165.4	134.5	0	0	107.9
308	T	39.9	Very low	40.8	Very low	155 Å²	155	147.5 Å²	147.5	95%	0.951	80%	0.802	S	S	*	*			trans	-110.8	89.4	157.4	43.4	0	0	0	0	108.1
309	A	39.8	Very low	39.8	Very low	97 Å²	97	148.7 Å²	148.7	80%	0.802	81%	0.805	S	S	*	*			trans	-125.3	70.3	161.8	0	0	0	0	0	108.8	G311	A309-G311 VanDerWaalsContact C-N 3.34Å; A309-G311 PolarHBondContact O-N 3.01Å; A309-G311 VanDerWaalsContact O-N 3.14Å
310	A	40.7	Very low	39.1	Very low	105 Å²	105	146.3 Å²	146.3	87%	0.868	80%	0.802	S	S	*	*			trans	-72.6	93.4	158.3	0	0	0	0	0	107.8	E312	A310-E312 PolarHBondContact O-N 3.41Å
311	G	35.1	Very low	38.6	Very low	71 Å²	71	144.5 Å²	144.5	73%	0.732	80%	0.798	S	S	*	*			trans	-79.3	103.4	166.6	0	0	0	0	0	109.8	A309 I313	A309-G311 VanDerWaalsContact C-N 3.34Å; A309-G311 PolarHBondContact O-N 3.01Å; A309-G311 VanDerWaalsContact O-N 3.14Å; G311-I313 PolarHBondContact O-N 3.35Å
312	E	37.3	Very low	38.6	Very low	175 Å²	175	145.5 Å²	145.5	82%	0.818	81%	0.805	S	S	*	*			trans	-52.2	119.9	170	-71.6	177.7	135.6	0	0	111.8	A310 R314	A310-E312 PolarHBondContact O-N 3.41Å; E312-R314 PolarHBondContact O-N 3.24Å
313	I	38.1	Very low	38.5	Very low	165 Å²	165	144.4 Å²	144.4	85%	0.846	80%	0.801	S	S	*	*			trans	-85.6	99.3	161.1	-61.8	176.9	0	0	0	107.5	G311 L315	G311-I313 PolarHBondContact O-N 3.35Å; I313-L315 PolarHBondContact O-N 2.79Å
314	R	37	Very low	38.5	Very low	206 Å²	206	140 Å²	140	78%	0.777	80%	0.795	S	S	*	*			trans	-76.7	110.5	171.3	-119.3	178	177.4	-176.6	-1.1	109.7	E312 R316	E312-R314 PolarHBondContact O-N 3.24Å; R314-R316 PolarHBondContact O-N 2.86Å
315	L	37.7	Very low	38.4	Very low	167 Å²	167	140.1 Å²	140.1	87%	0.874	80%	0.796	S	S	*	*			trans	-65	119.5	164	-91.9	140.8	0	0	0	109.5	I313	I313-L315 PolarHBondContact O-N 2.79Å
316	R	34.5	Very low	38.1	Very low	218 Å²	218	139.5 Å²	139.5	82%	0.823	79%	0.79	S	S	*	*			trans	-102.1	113.8	165.9	-77.6	-172.7	178.7	175	0.9	109.2	R314	R314-R316 PolarHBondContact O-N 2.86Å
317	T	39.1	Very low	37.8	Very low	129 Å²	129	137.1 Å²	137.1	79%	0.791	79%	0.792	S	S	*	*			trans	-73.7	127.7	163.2	-15.9	0	0	0	0	109.1
318	I	38.1	Very low	37.8	Very low	158 Å²	158	133.1 Å²	133.1	81%	0.81	78%	0.784	S	S	*	*			trans	-138.7	117.4	157.3	-61.6	-180	0	0	0	107
319	D	36.9	Very low	37.8	Very low	133 Å²	133	130.1 Å²	130.1	71%	0.711	77%	0.769	S	S	*	*			trans	-76.5	136.4	165.1	-68.7	-53.2	0	0	0	110.4
320	T	37.3	Very low	37.9	Very low	124 Å²	124	134.2 Å²	134.2	76%	0.761	77%	0.769	S	S	*	*				157.1	144.9	101.1	42.9	0	0	0	0	112.8
321	D	34.6	Very low	38.2	Very low	145 Å²	145	137.1 Å²	137.1	78%	0.775	77%	0.765	S	S	*	*			trans	67.5	109.8	154.4	-68.1	-12.4	0	0	0	121.3
322	S	36.1	Very low	39	Very low	106 Å²	106	138.7 Å²	138.7	74%	0.741	76%	0.764	S	S	*	*				166.1	134.9	85.5	48.6	0	0	0	0	113.6
323	S	37.8	Very low	39.5	Very low	102 Å²	102	142 Å²	142	71%	0.713	79%	0.787	S	S	*	*			trans	73.4	130	143.6	72.2	0	0	0	0	122.3
324	S	36.9	Very low	39.6	Very low	109 Å²	109	140.9 Å²	140.9	76%	0.762	78%	0.784	S	S	*	*			trans	72.3	140.2	150.1	76.4	0	0	0	0	116.9
325	S	37.2	Very low	39.7	Very low	96 Å²	96	137.5 Å²	137.5	67%	0.671	78%	0.784	S	S	*	*			cis	-176.9	148.5	-6.3	38.9	0	0	0	0	106.3
326	T	38.8	Very low	39.8	Very low	121 Å²	121	135.8 Å²	135.8	74%	0.742	78%	0.779	S	S	*	*			trans	65.6	120.4	147.2	36.3	0	0	0	0	122.2
327	S	38.3	Very low	40.1	Very low	117 Å²	117	131 Å²	131	82%	0.818	78%	0.776	S	S	*	*			trans	73.3	148.2	133	86.7	0	0	0	0	116.3
328	S	41.8	Very low	40.2	Very low	96 Å²	96	131.1 Å²	131.1	67%	0.671	78%	0.775	S	S	*	*			cis	-166.6	137.6	0.9	155.9	0	0	0	0	105.8
329	S	41.2	Very low	40.3	Very low	93 Å²	93	129.3 Å²	129.3	65%	0.65	77%	0.773	S	S	*	*			trans	44	125.9	139.3	-41.2	0	0	0	0	121.9
330	K	41.9	Very low	40.6	Very low	182 Å²	182	129.1 Å²	129.1	79%	0.791	78%	0.778	S	S	*	*				66.3	142.4	129.6	-66	178.9	178.3	-170.7	0	116
331	E	46.7	Very low	40.9	Very low	167 Å²	167	129.5 Å²	129.5	78%	0.78	78%	0.779	S	S	*	*			cis	-165.7	156.3	30.8	-136.6	156.1	-150.7	0	0	108.7
332	S	51.4	Low	41.4	Very low	103 Å²	103	128.2 Å²	128.2	72%	0.72	78%	0.779	S	S	*	*			trans	-54.8	139.1	169.3	43.2	0	0	0	0	115.4
333	L	48.4	Very low	41.9	Very low	246 Å²	246	130.2 Å²	130.2	100%	1.288	78%	0.783	S	S	*	*				-166.2	0	110.9	-102.3	161.8	0	0	0	110.9

Retrieved 333 of 333 residues in 562.5 ms (Link to these results)

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