A0A2K5ZHM0_MANLE Loading...

Endothelial protein C receptor

Binds activated protein C. Enhances protein C activation by the thrombin-thrombomodulin complex; plays a role in the protein C pathway controlling blood coagulation.

AlphaFold DB , UniProt , Accession A0A2K5ZHM0, Species MANLE (Mandrillus leucophaeus, Drill), Gene PROCR, Length 238 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	35	Very low	40.4	Very low	230 Å²	230	149.4 Å²	149.4	100%	1.133	80%	0.803	S	S	*	*				0	93.4	0	-65.4	-65.5	167.2	0	0	105.7
2	L	30.1	Very low	40.6	Very low	159 Å²	159	146.6 Å²	146.6	83%	0.832	80%	0.804	S	S	*	*				63.7	117.1	107.7	-117.9	78.7	0	0	0	109.5
3	T	41.7	Very low	40.3	Very low	106 Å²	106	146.5 Å²	146.5	65%	0.65	80%	0.802	S	S	*	*			cis	-175.6	128.1	40	30.5	0	0	0	0	105.6
4	T	47.6	Very low	40.4	Very low	121 Å²	121	150.6 Å²	150.6	74%	0.742	80%	0.8	S	S	*	*				45	141.2	93.7	42.1	0	0	0	0	117.7
5	L	39.5	Very low	40	Very low	157 Å²	157	146.9 Å²	146.9	82%	0.822	80%	0.799	S	S	*	*			trans	98.7	118.4	171.5	-58.1	165.6	0	0	0	112.7
6	L	36.9	Very low	39.8	Very low	159 Å²	159	147.8 Å²	147.8	83%	0.832	79%	0.793	S	S	*	*			cis	-159.3	167.1	38	-129.2	106.2	0	0	0	109.2
7	P	45.3	Very low	39.6	Very low	91 Å²	91	145 Å²	145	59%	0.591	79%	0.786	S	S	*	*			trans	-117.1	170	-143.4	11.4	16.6	0	0	0	113.4
8	I	41.6	Very low	39.4	Very low	140 Å²	140	141.9 Å²	141.9	72%	0.718	78%	0.777	S	S	*	*			trans	53.3	81.3	142.6	-53.4	160.5	0	0	0	115.3	L10	I8-L10 HydrophobicContact CG2-CB 3.92Å; I8-L10 HydrophobicContact CG2-CD1 4.35Å
9	L	36.5	Very low	39.4	Very low	191 Å²	191	143.5 Å²	143.5	100%	1	78%	0.778	S	S	*	*			trans	-94.6	79	145.8	-81.5	162.8	0	0	0	107.1
10	L	43.4	Very low	39.2	Very low	129 Å²	129	143.2 Å²	143.2	68%	0.675	78%	0.776	S	S	*	*			trans	-109.3	132	168.4	-97.7	160.7	0	0	0	108.4	I8	I8-L10 HydrophobicContact CG2-CB 3.92Å; I8-L10 HydrophobicContact CG2-CD1 4.35Å
11	L	47.1	Very low	39.2	Very low	160 Å²	160	139.7 Å²	139.7	84%	0.838	77%	0.767	S	S	*	*			trans	78.6	84.2	151.6	-59.1	158.1	0	0	0	116.7
12	S	42.4	Very low	39.6	Very low	116 Å²	116	133.6 Å²	133.6	81%	0.811	75%	0.747	S	S	*	*			trans	-155.2	69.2	142.6	58.6	0	0	0	0	109.5
13	D	36.8	Very low	40.7	Very low	145 Å²	145	132.8 Å²	132.8	78%	0.775	74%	0.743	S	S	*	*	S	Bend	trans	-145.5	121.1	164.9	-107.8	-39.4	0	0	0	109
14	W	41.2	Very low	41.5	Very low	204 Å²	204	130 Å²	130	77%	0.773	74%	0.735	S	S	*	*			trans	79.3	54.4	167.5	-61.1	54.3	0	0	0	117	F16	W14-F16 HydrophobicContact CD2-CD2 4.21Å; W14-F16 AromaticContact CE3-CD2 3.76Å; W14-F16 HydrophobicContact CE3-CD2 3.76Å; W14-F16 HydrophobicContact CE3-CE2 4.39Å; W14-F16 HydrophobicContact CH2-CE2 4.35Å; W14-F16 AromaticContact CZ3-CD2 3.93Å; W14-F16 HydrophobicContact CZ3-CD2 3.93Å; W14-F16 HydrophobicContact CZ3-CE2 4.14Å; W14-F16 PolarHBondContact O-N 3.27Å
15	A	35.4	Very low	42.6	Very low	95 Å²	95	128.2 Å²	128.2	79%	0.785	72%	0.721	S	S	*	*			trans	-80.5	75.8	133	0	0	0	0	0	107.3	C17	A15-C17 PolarHBondContact O-N 3.31Å
16	F	35.9	Very low	45	Very low	162 Å²	162	124.5 Å²	124.5	71%	0.711	70%	0.7	S	S	*	*			trans	-64.7	89.4	160	-130.1	-89.2	0	0	0	104.8	W14 S18	W14-F16 HydrophobicContact CD2-CD2 4.21Å; W14-F16 AromaticContact CE3-CD2 3.76Å; W14-F16 HydrophobicContact CE3-CD2 3.76Å; W14-F16 HydrophobicContact CE3-CE2 4.39Å; W14-F16 HydrophobicContact CH2-CE2 4.35Å; W14-F16 AromaticContact CZ3-CD2 3.93Å; W14-F16 HydrophobicContact CZ3-CD2 3.93Å; W14-F16 HydrophobicContact CZ3-CE2 4.14Å; W14-F16 PolarHBondContact O-N 3.27Å; F16-S18 PolarHBondContact O-N 3.39Å
17	C	36.9	Very low	47.8	Very low	100 Å²	100	117.2 Å²	117.2	68%	0.676	66%	0.662	S	S	*	*			trans	-55.8	103.1	161	-73.3	0	0	0	0	104.7	A15 Q19	A15-C17 PolarHBondContact O-N 3.31Å; C17-Q19 PolarHBondContact O-N 3.4Å
18	S	36.3	Very low	50.3	Low	89 Å²	89	113.4 Å²	113.4	62%	0.622	64%	0.637	S	S	*	*			trans	-57.7	86.2	153.4	157.4	0	0	0	0	104.8	F16 N20	F16-S18 PolarHBondContact O-N 3.39Å; S18-N20 PolarHBondContact O-N 3Å; S18-N20 PolarHBondContact OG-OD1 3.45Å; S18-N20 VanDerWaalsContact OG-OD1 3.1Å
19	Q	38.7	Very low	53	Low	172 Å²	172	108.9 Å²	108.9	80%	0.804	61%	0.612	S	S	*	*			trans	-66.5	82.3	152.1	-149.6	139	-8	0	0	102.4	C17 A21	C17-Q19 PolarHBondContact O-N 3.4Å; Q19-A21 PolarHBondContact O-N 2.88Å
20	N	36.6	Very low	56	Low	137 Å²	137	101.1 Å²	101.1	73%	0.733	57%	0.571	S	S	*	*			trans	-54.9	96.4	149.3	-86.6	3.3	0	0	0	102.9	S18 S22	S18-N20 PolarHBondContact O-N 3Å; S18-N20 PolarHBondContact OG-OD1 3.45Å; S18-N20 VanDerWaalsContact OG-OD1 3.1Å; N20-S22 PolarHBondContact O-N 3.15Å
21	A	39.3	Very low	58.6	Low	71 Å²	71	96.9 Å²	96.9	59%	0.587	55%	0.549	S	S	*	.			trans	-47.3	102.2	152.6	0	0	0	0	0	103.4	Q19 D23	Q19-A21 PolarHBondContact O-N 2.88Å; A21-D23 PolarHBondContact O-N 3.07Å
22	S	43.5	Very low	61	Low	101 Å²	101	89.7 Å²	89.7	71%	0.706	51%	0.511	S	S	*	.			trans	-56.1	83.6	148.9	155.7	0	0	0	0	103.1	N20 G24	N20-S22 PolarHBondContact O-N 3.15Å; S22-G24 VanDerWaalsContact O-CA 3.3Å; S22-G24 WeakPolarHBondContact O-CA 3.33Å; S22-G24 PolarHBondContact O-N 3.43Å
23	D	51.5	Low	63.7	Low	142 Å²	142	85.7 Å²	85.7	76%	0.759	48%	0.48	S	S	*	.			trans	-50.9	103.6	162	-91.7	-21.2	0	0	0	103.5	A21 L25	A21-D23 PolarHBondContact O-N 3.07Å; D23-L25 PolarHBondContact O-N 3.49Å
24	G	59.4	Low	66.7	Low	47 Å²	47	78.8 Å²	78.8	49%	0.485	44%	0.443	S	S	.	.			trans	-54.3	116.6	-152.2	0	0	0	0	0	109.8	S22 Q26	S22-G24 VanDerWaalsContact O-CA 3.3Å; S22-G24 WeakPolarHBondContact O-CA 3.33Å; S22-G24 PolarHBondContact O-N 3.43Å; G24-Q26 PolarHBondContact O-N 3.13Å
25	L	69.8	Low	69.4	Low	85 Å²	85	73.2 Å²	73.2	45%	0.445	42%	0.423	S	S	.	.			trans	-53.5	113.1	178.5	-177.8	68.2	0	0	0	107.7	D23 S27	D23-L25 PolarHBondContact O-N 3.49Å; L25-S27 VanDerWaalsContact C-N 3.34Å; L25-S27 PolarHBondContact O-N 2.97Å
26	Q	90.9	Very high	72.4	Confident	79 Å²	79	68.8 Å²	68.8	37%	0.369	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	89.7	-176.7	-69.6	-173.2	38.5	0	0	108.4	G24 L120 V190 I194	G24-Q26 PolarHBondContact O-N 3.13Å; Q26-L120 HydrophobicContact CB-CB 3.91Å; Q26-L120 WeakPolarHBondContact O-CD1 3.45Å; Q26-L120 PolarHBondContact O-N 3.27Å; Q26-V190 HydrophobicContact CB-CG1 3.86Å; Q26-I194 VanDerWaalsContact CA-CD1 3.48Å; Q26-I194 HydrophobicContact CB-CD1 3.87Å; Q26-I194 HydrophobicContact CG-CD1 3.81Å; Q26-I194 HydrophobicContact CG-CG2 4.34Å
27	S	95.4	Very high	75.4	Confident	5 Å²	5	70.5 Å²	70.5	4%	0.035	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	150.8	-173.7	62.6	0	0	0	0	113	L25 L50 G51 C118	L25-S27 VanDerWaalsContact C-N 3.34Å; L25-S27 PolarHBondContact O-N 2.97Å; S27-L50 CarbonylContact O-C 3.57Å; S27-L50 WeakPolarHBondContact O-CA 3.18Å; S27-G51 PolarHBondContact O-N 2.95Å; S27-C118 CarbonylContact C-O 3.53Å; S27-C118 VanDerWaalsContact CA-O 3.23Å; S27-C118 WeakPolarHBondContact CA-O 3.16Å; S27-C118 WeakPolarHBondContact CB-O 3.39Å
28	L	97.6	Very high	78.3	Confident	12 Å²	12	68.1 Å²	68.1	6%	0.063	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	117.1	162.5	174.8	67.7	0	0	0	107.6	M30 A48 S49 L50 G117 C118 Y189 V190	L28-M30 HydrophobicContact CD2-CE 4.16Å; L28-M30 HydrophobicContact CD2-SD 4.33Å; L28-M30 HydrophobicContact CG-CE 4.28Å; L28-M30 HydrophobicContact CG-CG 4.38Å; L28-A48 HydrophobicContact CD1-CB 4.21Å; L28-S49 WeakPolarHBondContact CA-O 3.35Å; L28-L50 HydrophobicContact CB-CD1 4.37Å; L28-L50 HydrophobicContact CD1-CB 4.5Å; L28-G117 CarbonylContact O-C 3.52Å; L28-G117 WeakPolarHBondContact O-CA 3.3Å; L28-C118 PolarHBondContact N-O 3.46Å; L28-C118 PolarHBondContact O-N 3.07Å; L28-Y189 HydrophobicContact CD2-CD1 3.9Å; L28-Y189 HydrophobicContact CD2-CG 4.26Å; L28-V190 HydrophobicContact CB-CG2 3.45Å; L28-V190 VanDerWaalsContact CB-CG2 3.45Å
29	H	98.3	Very high	81.2	Confident	44 Å²	44	64.4 Å²	64.4	20%	0.204	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	133.8	175.7	-64.7	161.5	0	0	0	109.6	A48 S49 F115 E119 F130	H29-A48 CarbonylContact O-C 3.48Å; H29-A48 WeakPolarHBondContact O-CA 3.5Å; H29-S49 PolarHBondContact N-O 2.95Å; H29-S49 PolarHBondContact O-N 3.35Å; H29-F115 HydrophobicContact CB-CE2 4.09Å; H29-F115 HydrophobicContact CB-CZ 4.44Å; H29-E119 IonicContact CD2-OE1 3.4Å; H29-E119 IonicContact CE1-OE1 2.74Å; H29-E119 PolarHBondContact CE1-OE1 3.1Å; H29-E119 IonicContact NE2-OE1 3.07Å; H29-E119 PolarHBondContact NE2-OE1 3.17Å; H29-F130 AromaticContact CD2-CE1 3.88Å; H29-F130 AromaticContact CD2-CZ 3.53Å; H29-F130 AromaticContact NE2-CE1 3.92Å; H29-F130 AromaticContact NE2-CZ 3.87Å
30	M	98.7	Very high	83.9	Confident	29 Å²	29	62.9 Å²	62.9	14%	0.143	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	131.9	179.9	-66.2	162.7	-79.4	0	0	109.1	L28 A48 F115 L116 F181	L28-M30 HydrophobicContact CD2-CE 4.16Å; L28-M30 HydrophobicContact CD2-SD 4.33Å; L28-M30 HydrophobicContact CG-CE 4.28Å; L28-M30 HydrophobicContact CG-CG 4.38Å; M30-A48 HydrophobicContact CG-CB 3.8Å; M30-F115 WeakPolarHBondContact O-CD2 3.24Å; M30-L116 HydrophobicContact CB-CD2 4.05Å; M30-L116 HydrophobicContact CB-CG 4.07Å; M30-L116 HydrophobicContact CE-CD1 4.27Å; M30-L116 HydrophobicContact CE-CG 4.2Å; M30-L116 PolarHBondContact N-O 2.79Å; M30-L116 PolarHBondContact O-N 3.38Å; M30-F181 HydrophobicContact CE-CE1 4.02Å; M30-F181 HydrophobicContact CE-CZ 4.04Å; M30-F181 HydrophobicContact SD-CE1 4.43Å; M30-F181 HydrophobicContact SD-CZ 3.98Å
31	L	98.8	Very high	86.8	Confident	40 Å²	40	61.9 Å²	61.9	21%	0.209	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	127.2	177.2	177.7	65.1	0	0	0	108.7	I33 G46 N47 R113 F115	L31-I33 HydrophobicContact CD1-CG1 4.36Å; L31-I33 HydrophobicContact CD2-CD1 4.39Å; L31-I33 HydrophobicContact CG-CG1 4.31Å; L31-G46 CarbonylContact O-C 3.59Å; L31-G46 WeakPolarHBondContact O-CA 3.26Å; L31-N47 PolarHBondContact N-O 3.38Å; L31-N47 PolarHBondContact O-N 2.8Å; L31-R113 HydrophobicContact CD1-CG 3.77Å; L31-F115 HydrophobicContact CD1-CD2 4.5Å
32	Q	98.6	Very high	89.7	Confident	9 Å²	9	59 Å²	59	4%	0.042	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	135	167	167.9	-170.5	-28.5	0	0	109.2	S34 Y44 L58 Y89 R113 C114	Q32-S34 PolarHBondContact NE2-OG 2.99Å; Q32-Y44 HydrophobicContact CG-CD1 4.49Å; Q32-L58 HydrophobicContact CG-CD2 4.42Å; Q32-Y89 PolarHBondContact OE1-OH 3.14Å; Q32-R113 CarbonylContact O-C 3.56Å; Q32-R113 WeakPolarHBondContact O-CA 3.32Å; Q32-C114 HydrophobicContact CB-CB 4.22Å; Q32-C114 PolarHBondContact N-O 3.21Å; Q32-C114 PolarHBondContact O-N 3.04Å
33	I	98.8	Very high	92.3	Very high	31 Å²	31	59.3 Å²	59.3	16%	0.159	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	128.2	170.5	-49.4	173.7	0	0	0	107.2	L31 Y35 Y44 Q45 T111 I112 R113	L31-I33 HydrophobicContact CD1-CG1 4.36Å; L31-I33 HydrophobicContact CD2-CD1 4.39Å; L31-I33 HydrophobicContact CG-CG1 4.31Å; I33-Y35 HydrophobicContact CB-CE2 4.18Å; I33-Y35 HydrophobicContact CG2-CD1 4.43Å; I33-Y35 HydrophobicContact CG2-CD2 4.28Å; I33-Y35 HydrophobicContact CG2-CE1 3.81Å; I33-Y35 HydrophobicContact CG2-CE2 3.64Å; I33-Y35 WeakPolarHBondContact CG2-OH 3.26Å; I33-Y44 WeakPolarHBondContact O-CA 3.4Å; I33-Q45 WeakPolarHBondContact CA-O 3.24Å; I33-Q45 WeakPolarHBondContact CB-O 3.44Å; I33-Q45 PolarHBondContact N-O 2.85Å; I33-Q45 PolarHBondContact O-N 2.81Å; I33-Q45 VanDerWaalsContact O-O 3.14Å; I33-T111 HydrophobicContact CG2-CG2 3.64Å; I33-I112 CarbonylContact C-O 3.5Å; I33-I112 WeakPolarHBondContact CA-O 3.42Å; I33-R113 HydrophobicContact CG1-CG 4.47Å
34	S	98.8	Very high	94.5	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	110.1	-177.1	-58.4	0	0	0	0	109.2	Q32 Y44 F93 T111 I112	Q32-S34 PolarHBondContact NE2-OG 2.99Å; S34-Y44 VanDerWaalsContact OG-CD1 3.25Å; S34-Y44 WeakPolarHBondContact OG-CD1 3.48Å; S34-Y44 WeakPolarHBondContact OG-CE1 3.12Å; S34-F93 WeakPolarHBondContact OG-CE1 3.42Å; S34-T111 WeakPolarHBondContact O-CA 3.39Å; S34-I112 PolarHBondContact N-O 3.47Å; S34-I112 PolarHBondContact O-N 3.08Å
35	Y	98.7	Very high	96.4	Very high	88 Å²	88	54.2 Å²	54.2	35%	0.345	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	103.8	178.6	-55.3	-82.8	0	0	0	109.2	I33 V42 W43 Q45 T111	I33-Y35 HydrophobicContact CB-CE2 4.18Å; I33-Y35 HydrophobicContact CG2-CD1 4.43Å; I33-Y35 HydrophobicContact CG2-CD2 4.28Å; I33-Y35 HydrophobicContact CG2-CE1 3.81Å; I33-Y35 HydrophobicContact CG2-CE2 3.64Å; I33-Y35 WeakPolarHBondContact CG2-OH 3.26Å; Y35-V42 WeakPolarHBondContact O-CA 3.38Å; Y35-W43 WeakPolarHBondContact CD2-O 3.42Å; Y35-W43 PolarHBondContact N-O 2.83Å; Y35-W43 PolarHBondContact O-N 3.12Å; Y35-Q45 HydrophobicContact CE2-CB 4.02Å; Y35-Q45 PolarHBondContact OH-OE1 2.85Å; Y35-T111 HydrophobicContact CD1-CG2 3.84Å; Y35-T111 HydrophobicContact CE1-CG2 3.81Å
36	F	98.6	Very high	97.8	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.009	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	118	176.3	-68.8	-94.6	0	0	0	110.1	V42 F93 H94 V97 F108 P109 L110 I112	F36-V42 HydrophobicContact CD1-CB 3.75Å; F36-V42 HydrophobicContact CD1-CG2 3.97Å; F36-V42 HydrophobicContact CD2-CG2 4.03Å; F36-V42 HydrophobicContact CE1-CB 3.61Å; F36-V42 HydrophobicContact CE1-CG1 4.32Å; F36-V42 HydrophobicContact CE1-CG2 3.73Å; F36-V42 HydrophobicContact CE2-CG2 3.81Å; F36-V42 HydrophobicContact CG-CB 4.29Å; F36-V42 HydrophobicContact CG-CG2 4.11Å; F36-V42 HydrophobicContact CZ-CB 4.06Å; F36-V42 HydrophobicContact CZ-CG2 3.64Å; F36-F93 AromaticContact CE2-CE1 3.87Å; F36-F93 HydrophobicContact CE2-CE1 3.87Å; F36-F93 HydrophobicContact CE2-CZ 4.41Å; F36-F93 HydrophobicContact CZ-CD1 4.39Å; F36-F93 AromaticContact CZ-CE1 3.77Å; F36-F93 HydrophobicContact CZ-CE1 3.77Å; F36-H94 AromaticContact CE1-CD2 3.61Å; F36-V97 HydrophobicContact CD1-CG1 4.19Å; F36-V97 HydrophobicContact CE1-CB 4.16Å; F36-V97 HydrophobicContact CE1-CG1 3.86Å; F36-V97 HydrophobicContact CE1-CG2 4.47Å; F36-V97 HydrophobicContact CE2-CG1 4.27Å; F36-V97 HydrophobicContact CE2-CG2 4.16Å; F36-V97 HydrophobicContact CZ-CB 3.98Å; F36-V97 HydrophobicContact CZ-CG1 3.9Å; F36-V97 HydrophobicContact CZ-CG2 3.79Å; F36-F108 HydrophobicContact CB-CD1 3.7Å; F36-F108 HydrophobicContact CB-CE1 3.5Å; F36-F108 VanDerWaalsContact CB-CE1 3.5Å; F36-F108 HydrophobicContact CD1-CE1 4.31Å; F36-F108 HydrophobicContact CG-CE1 4.11Å; F36-P109 VanDerWaalsContact O-CA 3.26Å; F36-P109 WeakPolarHBondContact O-CA 3.42Å; F36-P109 WeakPolarHBondContact O-CB 3.48Å; F36-L110 HydrophobicContact CB-CD1 4.08Å; F36-L110 HydrophobicContact CB-CG 4.1Å; F36-L110 HydrophobicContact CD2-CD1 3.65Å; F36-L110 HydrophobicContact CE2-CD1 4.45Å; F36-L110 HydrophobicContact CG-CD1 4.13Å; F36-L110 PolarHBondContact N-O 2.99Å; F36-L110 PolarHBondContact O-N 3.25Å; F36-I112 HydrophobicContact CD2-CD1 4.39Å; F36-I112 HydrophobicContact CD2-CG1 4.46Å; F36-I112 HydrophobicContact CE2-CD1 3.91Å; F36-I112 HydrophobicContact CE2-CG1 4.29Å
37	R	98	Very high	98.1	Very high	198 Å²	198	49.8 Å²	49.8	75%	0.747	22%	0.22	S	C	*	.	S	Bend	trans	-76.7	-36.7	170.7	-65.4	-176.9	-179.1	179.7	0.7	111	H41	R37-H41 PolarHBondContact N-O 3.04Å; R37-H41 VanDerWaalsContact N-O 3.09Å
38	D	97.8	Very high	98.3	Very high	49 Å²	49	49.9 Å²	49.9	26%	0.262	22%	0.222	S	C	.	.	S	Bend	trans	-155.7	179.2	178.9	63.9	58.6	0	0	0	108.3	Y40 H41	D38-Y40 PolarHBondContact O-N 2.72Å; D38-Y40 VanDerWaalsContact O-N 3.1Å; D38-Y40 WeakPolarHBondContact OD1-CA 3.37Å; D38-Y40 WeakPolarHBondContact OD1-CB 3.45Å; D38-Y40 PolarHBondContact OD1-N 2.86Å; D38-H41 VanDerWaalsContact CG-ND1 3.28Å; D38-H41 IonicContact OD1-CG 3.64Å; D38-H41 PolarHBondContact OD1-N 2.87Å; D38-H41 IonicContact OD1-ND1 2.78Å; D38-H41 PolarHBondContact OD1-ND1 2.83Å; D38-H41 IonicContact OD2-CE1 3.67Å; D38-H41 IonicContact OD2-CG 3.02Å; D38-H41 IonicContact OD2-ND1 3.79Å; D38-H41 PolarHBondContact OD2-ND1 2.82Å
39	P	97.1	Very high	98.2	Very high	12 Å²	12	50.6 Å²	50.6	8%	0.078	23%	0.228	C	C	.	.	S	Bend	trans	-61.9	-17	-177.8	-20.5	30.1	0	0	0	115.3	H94 H101 F108	P39-H94 PolarHBondContact O-NE2 2.78Å; P39-H101 WeakPolarHBondContact CG-CD2 3.4Å; P39-H101 WeakPolarHBondContact CG-NE2 3.32Å; P39-F108 HydrophobicContact CB-CE2 4.26Å; P39-F108 HydrophobicContact CB-CZ 4.12Å; P39-F108 HydrophobicContact CG-CD2 4.13Å; P39-F108 HydrophobicContact CG-CE2 3.54Å; P39-F108 HydrophobicContact CG-CZ 3.9Å
40	Y	96.5	Very high	98.1	Very high	140 Å²	140	48.5 Å²	48.5	55%	0.549	22%	0.218	S	C	.	.	S	Bend	trans	-111.7	-19.1	-170.6	-54	-77.7	0	0	0	113.2	D38 H94	D38-Y40 PolarHBondContact O-N 2.72Å; D38-Y40 VanDerWaalsContact O-N 3.1Å; D38-Y40 WeakPolarHBondContact OD1-CA 3.37Å; D38-Y40 WeakPolarHBondContact OD1-CB 3.45Å; D38-Y40 PolarHBondContact OD1-N 2.86Å; Y40-H94 PolarHBondContact O-CE1 2.88Å; Y40-H94 VanDerWaalsContact O-CE1 3.28Å
41	H	97.7	Very high	97.7	Very high	116 Å²	116	48.5 Å²	48.5	54%	0.537	23%	0.226	S	C	.	.			trans	-118.2	116.1	-178.9	-56.3	99.6	0	0	0	112	R37 D38	R37-H41 PolarHBondContact N-O 3.04Å; R37-H41 VanDerWaalsContact N-O 3.09Å; D38-H41 VanDerWaalsContact CG-ND1 3.28Å; D38-H41 IonicContact OD1-CG 3.64Å; D38-H41 PolarHBondContact OD1-N 2.87Å; D38-H41 IonicContact OD1-ND1 2.78Å; D38-H41 PolarHBondContact OD1-ND1 2.83Å; D38-H41 IonicContact OD2-CE1 3.67Å; D38-H41 IonicContact OD2-CG 3.02Å; D38-H41 IonicContact OD2-ND1 3.79Å; D38-H41 PolarHBondContact OD2-ND1 2.82Å
42	V	98.5	Very high	97.3	Very high	9 Å²	9	49.6 Å²	49.6	6%	0.055	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	138.3	177.9	63.9	0	0	0	0	111.1	Y35 F36 Y44 P61 G62	Y35-V42 WeakPolarHBondContact O-CA 3.38Å; F36-V42 HydrophobicContact CD1-CB 3.75Å; F36-V42 HydrophobicContact CD1-CG2 3.97Å; F36-V42 HydrophobicContact CD2-CG2 4.03Å; F36-V42 HydrophobicContact CE1-CB 3.61Å; F36-V42 HydrophobicContact CE1-CG1 4.32Å; F36-V42 HydrophobicContact CE1-CG2 3.73Å; F36-V42 HydrophobicContact CE2-CG2 3.81Å; F36-V42 HydrophobicContact CG-CB 4.29Å; F36-V42 HydrophobicContact CG-CG2 4.11Å; F36-V42 HydrophobicContact CZ-CB 4.06Å; F36-V42 HydrophobicContact CZ-CG2 3.64Å; V42-Y44 HydrophobicContact CG1-CD2 4.33Å; V42-Y44 HydrophobicContact CG1-CE1 4.31Å; V42-Y44 HydrophobicContact CG1-CE2 3.62Å; V42-Y44 HydrophobicContact CG2-CD1 4.15Å; V42-Y44 HydrophobicContact CG2-CE1 3.76Å; V42-Y44 HydrophobicContact CG2-CE2 4.42Å; V42-P61 WeakPolarHBondContact O-CA 3.29Å; V42-G62 PolarHBondContact O-N 3.21Å
43	W	98.6	Very high	97	Very high	108 Å²	108	54.5 Å²	54.5	41%	0.409	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	125.5	164.9	-173.5	-82.4	0	0	0	109.4	Y35 E59 P61	Y35-W43 WeakPolarHBondContact CD2-O 3.42Å; Y35-W43 PolarHBondContact N-O 2.83Å; Y35-W43 PolarHBondContact O-N 3.12Å; W43-E59 HydrophobicContact CZ2-CG 4.1Å; W43-P61 HydrophobicContact CE3-CB 4.13Å; W43-P61 HydrophobicContact CZ3-CB 4.34Å; W43-P61 HydrophobicContact CZ3-CG 4.38Å
44	Y	98.7	Very high	96.9	Very high	2 Å²	2	57.1 Å²	57.1	1%	0.008	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	137.8	175.7	-64.9	-64.3	0	0	0	110.5	Q32 I33 S34 V42 E59 G60 G62 A65 L90 F93	Q32-Y44 HydrophobicContact CG-CD1 4.49Å; I33-Y44 WeakPolarHBondContact O-CA 3.4Å; S34-Y44 VanDerWaalsContact OG-CD1 3.25Å; S34-Y44 WeakPolarHBondContact OG-CD1 3.48Å; S34-Y44 WeakPolarHBondContact OG-CE1 3.12Å; V42-Y44 HydrophobicContact CG1-CD2 4.33Å; V42-Y44 HydrophobicContact CG1-CE1 4.31Å; V42-Y44 HydrophobicContact CG1-CE2 3.62Å; V42-Y44 HydrophobicContact CG2-CD1 4.15Å; V42-Y44 HydrophobicContact CG2-CE1 3.76Å; V42-Y44 HydrophobicContact CG2-CE2 4.42Å; Y44-E59 WeakPolarHBondContact O-CA 3.35Å; Y44-G60 PolarHBondContact N-O 3.1Å; Y44-G60 PolarHBondContact O-N 2.84Å; Y44-G62 WeakPolarHBondContact CD2-O 3.46Å; Y44-G62 WeakPolarHBondContact CE2-O 3.39Å; Y44-A65 HydrophobicContact CD2-CB 3.93Å; Y44-L90 HydrophobicContact CD1-CD2 4.03Å; Y44-L90 HydrophobicContact CD2-CD1 4.17Å; Y44-L90 HydrophobicContact CD2-CD2 4.34Å; Y44-L90 HydrophobicContact CE1-CD2 3.87Å; Y44-L90 HydrophobicContact CE2-CB 4.13Å; Y44-L90 HydrophobicContact CE2-CD1 4.25Å; Y44-L90 HydrophobicContact CE2-CD2 4.16Å; Y44-L90 HydrophobicContact CE2-CG 4.41Å; Y44-L90 HydrophobicContact CG-CD2 4.27Å; Y44-L90 PolarHBondContact OH-O 3.24Å; Y44-L90 VanDerWaalsContact OH-O 3.12Å; Y44-F93 HydrophobicContact CE1-CD1 4.09Å; Y44-F93 HydrophobicContact CE1-CE1 4.17Å
45	Q	98.6	Very high	96.8	Very high	81 Å²	81	57.1 Å²	57.1	38%	0.379	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	131.9	167.1	-176.5	-179.8	42.6	0	0	107.8	I33 Y35 L58	I33-Q45 WeakPolarHBondContact CA-O 3.24Å; I33-Q45 WeakPolarHBondContact CB-O 3.44Å; I33-Q45 PolarHBondContact N-O 2.85Å; I33-Q45 PolarHBondContact O-N 2.81Å; I33-Q45 VanDerWaalsContact O-O 3.14Å; Y35-Q45 HydrophobicContact CE2-CB 4.02Å; Y35-Q45 PolarHBondContact OH-OE1 2.85Å; Q45-L58 CarbonylContact C-O 3.59Å; Q45-L58 WeakPolarHBondContact CA-O 3.5Å
46	G	98.4	Very high	96.8	Very high	4 Å²	4	53.8 Å²	53.8	4%	0.041	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.9	169.6	-177.7	0	0	0	0	0	112.9	L31 L58	L31-G46 CarbonylContact O-C 3.59Å; L31-G46 WeakPolarHBondContact O-CA 3.26Å; G46-L58 PolarHBondContact N-O 3.36Å; G46-L58 PolarHBondContact O-N 3.24Å
47	N	98.5	Very high	96.8	Very high	66 Å²	66	55.8 Å²	55.8	35%	0.353	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	165.2	175.9	53.5	50	0	0	0	111	L31 L54 H56	L31-N47 PolarHBondContact N-O 3.38Å; L31-N47 PolarHBondContact O-N 2.8Å; N47-L54 HydrophobicContact CB-CD1 3.54Å; N47-H56 WeakPolarHBondContact CA-O 3.39Å; N47-H56 VanDerWaalsContact CB-O 3.31Å; N47-H56 WeakPolarHBondContact CB-O 3.12Å
48	A	98.3	Very high	96.8	Very high	8 Å²	8	47.4 Å²	47.4	7%	0.066	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	143.8	168.1	0	0	0	0	0	110.4	L28 H29 M30 T55 H56	L28-A48 HydrophobicContact CD1-CB 4.21Å; H29-A48 CarbonylContact O-C 3.48Å; H29-A48 WeakPolarHBondContact O-CA 3.5Å; M30-A48 HydrophobicContact CG-CB 3.8Å; A48-T55 PolarHBondContact O-N 3.32Å; A48-T55 PolarHBondContact O-OG1 2.75Å; A48-H56 HydrophobicContact CB-CB 3.93Å; A48-H56 PolarHBondContact N-O 3.07Å; A48-H56 PolarHBondContact O-N 2.89Å
49	S	96.3	Very high	96.8	Very high	27 Å²	27	49.6 Å²	49.6	19%	0.189	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	130.5	177.6	-57.5	0	0	0	0	110.7	L28 H29 H53	L28-S49 WeakPolarHBondContact CA-O 3.35Å; H29-S49 PolarHBondContact N-O 2.95Å; H29-S49 PolarHBondContact O-N 3.35Å; S49-H53 CarbonylContact C-O 3.53Å; S49-H53 WeakPolarHBondContact CA-O 3.38Å
50	L	95.2	Very high	96.8	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	118	176.4	-178.8	68.2	0	0	0	108.6	S27 L28 G52 H53 T55 V190 H193 E197	S27-L50 CarbonylContact O-C 3.57Å; S27-L50 WeakPolarHBondContact O-CA 3.18Å; L28-L50 HydrophobicContact CB-CD1 4.37Å; L28-L50 HydrophobicContact CD1-CB 4.5Å; L50-G52 PolarHBondContact O-N 3.29Å; L50-H53 PolarHBondContact N-O 3.4Å; L50-H53 PolarHBondContact O-N 2.9Å; L50-T55 HydrophobicContact CB-CG2 3.74Å; L50-V190 HydrophobicContact CD1-CB 4.3Å; L50-V190 HydrophobicContact CD1-CG1 4.29Å; L50-V190 HydrophobicContact CD1-CG2 3.95Å; L50-H193 HydrophobicContact CD2-CB 3.7Å; L50-E197 HydrophobicContact CD2-CG 4.27Å
51	G	91.5	Very high	96.8	Very high	29 Å²	29	45.6 Å²	45.6	30%	0.299	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	31.2	-175.4	0	0	0	0	0	113.3	S27 H53	S27-G51 PolarHBondContact O-N 2.95Å; G51-H53 VanDerWaalsContact C-N 3.32Å; G51-H53 PolarHBondContact O-N 2.91Å
52	G	90.7	Very high	96.5	Very high	62 Å²	62	40.9 Å²	40.9	64%	0.639	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.1	-4.1	-175.8	0	0	0	0	0	115.7	L50	L50-G52 PolarHBondContact O-N 3.29Å
53	H	92.8	Very high	95.7	Very high	112 Å²	112	44.5 Å²	44.5	52%	0.519	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	129.1	175.9	-63.5	-74.2	0	0	0	111.2	S49 L50 G51 T55	S49-H53 CarbonylContact C-O 3.53Å; S49-H53 WeakPolarHBondContact CA-O 3.38Å; L50-H53 PolarHBondContact N-O 3.4Å; L50-H53 PolarHBondContact O-N 2.9Å; G51-H53 VanDerWaalsContact C-N 3.32Å; G51-H53 PolarHBondContact O-N 2.91Å; H53-T55 PolarHBondContact O-N 3.5Å
54	L	95.7	Very high	95.4	Very high	86 Å²	86	45.1 Å²	45.1	45%	0.45	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	118.5	176.3	-178.3	70	0	0	0	110.3	N47 L70	N47-L54 HydrophobicContact CB-CD1 3.54Å; L54-L70 HydrophobicContact CD2-CD1 3.67Å; L54-L70 HydrophobicContact CG-CD1 3.65Å
55	T	96.6	Very high	95.2	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	-26	-176.8	51.2	0	0	0	0	113.4	A48 L50 H53 Q69 L70 L73	A48-T55 PolarHBondContact O-N 3.32Å; A48-T55 PolarHBondContact O-OG1 2.75Å; L50-T55 HydrophobicContact CB-CG2 3.74Å; H53-T55 PolarHBondContact O-N 3.5Å; T55-Q69 CarbonylContact O-C 3.59Å; T55-L70 PolarHBondContact O-N 2.8Å; T55-L73 HydrophobicContact CG2-CD1 3.66Å
56	H	98.1	Very high	95.1	Very high	19 Å²	19	45.1 Å²	45.1	9%	0.088	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	154.8	-178.6	-55.1	74.6	0	0	0	112.5	N47 A48 L68 W79 Y189	N47-H56 WeakPolarHBondContact CA-O 3.39Å; N47-H56 VanDerWaalsContact CB-O 3.31Å; N47-H56 WeakPolarHBondContact CB-O 3.12Å; A48-H56 HydrophobicContact CB-CB 3.93Å; A48-H56 PolarHBondContact N-O 3.07Å; A48-H56 PolarHBondContact O-N 2.89Å; H56-L68 CarbonylContact C-O 3.49Å; H56-L68 WeakPolarHBondContact CA-O 3.49Å; H56-L68 WeakPolarHBondContact CB-O 3.48Å; H56-W79 AromaticContact CD2-CH2 3.68Å; H56-W79 AromaticContact CD2-CZ3 3.67Å; H56-W79 AromaticContact NE2-CZ3 3.75Å; H56-Y189 AromaticContact CE1-CZ 3.99Å; H56-Y189 PolarHBondContact CE1-OH 2.77Å; H56-Y189 PolarHBondContact NE2-OH 2.97Å
57	V	98.4	Very high	95	Very high	44 Å²	44	45.5 Å²	45.5	27%	0.267	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	139.5	173.5	-179.1	0	0	0	0	109.4	I67 L68 L70	V57-I67 CarbonylContact O-C 3.6Å; V57-I67 WeakPolarHBondContact O-CA 3.5Å; V57-L68 PolarHBondContact N-O 3.14Å; V57-L68 PolarHBondContact O-N 3.1Å; V57-L70 HydrophobicContact CG2-CD1 4.12Å; V57-L70 HydrophobicContact CG2-CD2 4.02Å; V57-L70 HydrophobicContact CG2-CG 4.25Å
58	L	98.4	Very high	94.9	Very high	21 Å²	21	46.8 Å²	46.8	11%	0.11	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	122.6	170.2	163.6	67.9	0	0	0	107.7	Q32 Q45 G46 A65 T66 I67 L90	Q32-L58 HydrophobicContact CG-CD2 4.42Å; Q45-L58 CarbonylContact C-O 3.59Å; Q45-L58 WeakPolarHBondContact CA-O 3.5Å; G46-L58 PolarHBondContact N-O 3.36Å; G46-L58 PolarHBondContact O-N 3.24Å; L58-A65 HydrophobicContact CD1-CB 3.81Å; L58-T66 CarbonylContact C-O 3.44Å; L58-T66 WeakPolarHBondContact CA-O 3.18Å; L58-I67 HydrophobicContact CD1-CD1 4.29Å; L58-I67 HydrophobicContact CD1-CG1 3.59Å; L58-L90 HydrophobicContact CD1-CD1 3.83Å; L58-L90 HydrophobicContact CD2-CD2 4.25Å
59	E	98.3	Very high	94.8	Very high	95 Å²	95	48.2 Å²	48.2	44%	0.444	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	137.9	175.4	-170.1	165.7	-162.4	0	0	112.5	W43 Y44 T66	W43-E59 HydrophobicContact CZ2-CG 4.1Å; Y44-E59 WeakPolarHBondContact O-CA 3.35Å; E59-T66 PolarHBondContact N-O 3Å; E59-T66 PolarHBondContact O-N 3.35Å
60	G	97.4	Very high	94.7	Very high	6 Å²	6	51.3 Å²	51.3	6%	0.062	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	134.4	-176.2	167	0	0	0	0	0	114.4	Y44	Y44-G60 PolarHBondContact N-O 3.1Å; Y44-G60 PolarHBondContact O-N 2.84Å
61	P	96.9	Very high	94.4	Very high	62 Å²	62	53.8 Å²	53.8	40%	0.403	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	131.3	-171.9	32.2	-31.9	0	0	0	112.3	V42 W43 T63 N64 A65	V42-P61 WeakPolarHBondContact O-CA 3.29Å; W43-P61 HydrophobicContact CE3-CB 4.13Å; W43-P61 HydrophobicContact CZ3-CB 4.34Å; W43-P61 HydrophobicContact CZ3-CG 4.38Å; P61-T63 PolarHBondContact O-N 3.5Å; P61-N64 HydrophobicContact CG-CB 4.34Å; P61-N64 CarbonylContact O-C 3.6Å; P61-N64 WeakPolarHBondContact O-CA 3.41Å; P61-N64 PolarHBondContact O-N 2.96Å; P61-A65 PolarHBondContact O-N 3.23Å
62	G	91	Very high	94.5	Very high	18 Å²	18	57.2 Å²	57.2	19%	0.186	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	45.2	-125.3	168.9	0	0	0	0	0	114	V42 Y44 N64 A65	V42-G62 PolarHBondContact O-N 3.21Å; Y44-G62 WeakPolarHBondContact CD2-O 3.46Å; Y44-G62 WeakPolarHBondContact CE2-O 3.39Å; G62-N64 VanDerWaalsContact C-N 3.25Å; G62-N64 PolarHBondContact O-N 2.87Å; G62-A65 PolarHBondContact O-N 2.87Å
63	T	80.9	Confident	94.6	Very high	85 Å²	85	54.6 Å²	54.6	52%	0.521	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-74.4	-11.4	179.3	58.2	0	0	0	0	114.5	P61 A65 L91	P61-T63 PolarHBondContact O-N 3.5Å; T63-A65 VanDerWaalsContact C-N 3.33Å; T63-L91 HydrophobicContact CG2-CD2 3.35Å; T63-L91 HydrophobicContact CG2-CG 4.22Å
64	N	91.8	Very high	94.7	Very high	121 Å²	121	50.1 Å²	50.1	65%	0.647	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-97.7	12.3	179.6	-62.5	-13.9	0	0	0	111.3	P61 G62 T66	P61-N64 HydrophobicContact CG-CB 4.34Å; P61-N64 CarbonylContact O-C 3.6Å; P61-N64 WeakPolarHBondContact O-CA 3.41Å; P61-N64 PolarHBondContact O-N 2.96Å; G62-N64 VanDerWaalsContact C-N 3.25Å; G62-N64 PolarHBondContact O-N 2.87Å; N64-T66 PolarHBondContact O-N 3.09Å
65	A	94.8	Very high	94.7	Very high	3 Å²	3	53 Å²	53	3%	0.025	29%	0.293	C	S	.	.			trans	-63.1	131.6	174.2	0	0	0	0	0	110.1	Y44 L58 P61 G62 T63 Q87 L90	Y44-A65 HydrophobicContact CD2-CB 3.93Å; L58-A65 HydrophobicContact CD1-CB 3.81Å; P61-A65 PolarHBondContact O-N 3.23Å; G62-A65 PolarHBondContact O-N 2.87Å; T63-A65 VanDerWaalsContact C-N 3.33Å; A65-Q87 PolarHBondContact O-NE2 2.95Å; A65-L90 HydrophobicContact CB-CD1 4.23Å
66	T	96.4	Very high	94.7	Very high	80 Å²	80	57.8 Å²	57.8	49%	0.491	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	134.4	178.3	-53.1	0	0	0	0	108.6	L58 E59 N64 L68	L58-T66 CarbonylContact C-O 3.44Å; L58-T66 WeakPolarHBondContact CA-O 3.18Å; E59-T66 PolarHBondContact N-O 3Å; E59-T66 PolarHBondContact O-N 3.35Å; N64-T66 PolarHBondContact O-N 3.09Å; T66-L68 HydrophobicContact CG2-CD1 4.25Å; T66-L68 HydrophobicContact CG2-CD2 3.85Å; T66-L68 HydrophobicContact CG2-CG 3.82Å
67	I	97.1	Very high	94.6	Very high	11 Å²	11	63.3 Å²	63.3	6%	0.056	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	124.5	173.3	-53.6	167.1	0	0	0	106.8	V57 L58 W79 Q83 L86 Q87	V57-I67 CarbonylContact O-C 3.6Å; V57-I67 WeakPolarHBondContact O-CA 3.5Å; L58-I67 HydrophobicContact CD1-CD1 4.29Å; L58-I67 HydrophobicContact CD1-CG1 3.59Å; I67-W79 HydrophobicContact CB-CZ2 4.45Å; I67-W79 HydrophobicContact CG2-CH2 3.7Å; I67-W79 HydrophobicContact CG2-CZ2 3.97Å; I67-Q83 HydrophobicContact CB-CG 4.48Å; I67-L86 HydrophobicContact CD1-CB 3.49Å; I67-L86 VanDerWaalsContact CD1-CB 3.49Å; I67-L86 HydrophobicContact CD1-CD1 4.07Å; I67-L86 HydrophobicContact CD1-CG 4.43Å; I67-L86 HydrophobicContact CG2-CD1 3.98Å; I67-Q87 HydrophobicContact CD1-CG 4.48Å
68	L	96.8	Very high	94.5	Very high	93 Å²	93	62.6 Å²	62.6	49%	0.487	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	137.8	-177.2	-62.5	175.1	0	0	0	110.3	H56 V57 T66	H56-L68 CarbonylContact C-O 3.49Å; H56-L68 WeakPolarHBondContact CA-O 3.49Å; H56-L68 WeakPolarHBondContact CB-O 3.48Å; V57-L68 PolarHBondContact N-O 3.14Å; V57-L68 PolarHBondContact O-N 3.1Å; T66-L68 HydrophobicContact CG2-CD1 4.25Å; T66-L68 HydrophobicContact CG2-CD2 3.85Å; T66-L68 HydrophobicContact CG2-CG 3.82Å
69	Q	95.8	Very high	94.4	Very high	38 Å²	38	62.9 Å²	62.9	18%	0.178	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	123.1	158.2	60.9	175.7	-28	0	0	108.3	T55 Q71 Q74 W79	T55-Q69 CarbonylContact O-C 3.59Å; Q69-Q71 VanDerWaalsContact C-N 3.29Å; Q69-Q71 WeakPolarHBondContact CB-O 3.34Å; Q69-Q71 WeakPolarHBondContact CG-O 3.41Å; Q69-Q71 PolarHBondContact OE1-O 2.8Å; Q69-Q71 VanDerWaalsContact OE1-O 3.14Å; Q69-Q74 PolarHBondContact NE2-O 2.79Å; Q69-W79 HydrophobicContact CB-CE3 4.41Å; Q69-W79 HydrophobicContact CB-CH2 4.38Å; Q69-W79 HydrophobicContact CB-CZ2 4.46Å; Q69-W79 HydrophobicContact CB-CZ3 4.35Å; Q69-W79 HydrophobicContact CG-CD2 4.08Å; Q69-W79 HydrophobicContact CG-CE3 4.4Å; Q69-W79 HydrophobicContact CG-CG 4.43Å; Q69-W79 VanDerWaalsContact NE2-CG 3.27Å
70	L	95.2	Very high	94.3	Very high	92 Å²	92	61 Å²	61	48%	0.482	35%	0.347	S	S	.	.	S	Bend	trans	-74	-26.1	-178.5	-62.7	-178	0	0	0	112.1	L54 T55 V57	L54-L70 HydrophobicContact CD2-CD1 3.67Å; L54-L70 HydrophobicContact CG-CD1 3.65Å; T55-L70 PolarHBondContact O-N 2.8Å; V57-L70 HydrophobicContact CG2-CD1 4.12Å; V57-L70 HydrophobicContact CG2-CD2 4.02Å; V57-L70 HydrophobicContact CG2-CG 4.25Å
71	Q	88.8	Confident	94.3	Very high	53 Å²	53	68 Å²	68	25%	0.248	37%	0.372	C	S	.	.	S	Bend	trans	-121.4	148.5	168.1	-60.1	-167.1	44.4	0	0	108.4	Q69 L73 E197	Q69-Q71 VanDerWaalsContact C-N 3.29Å; Q69-Q71 WeakPolarHBondContact CB-O 3.34Å; Q69-Q71 WeakPolarHBondContact CG-O 3.41Å; Q69-Q71 PolarHBondContact OE1-O 2.8Å; Q69-Q71 VanDerWaalsContact OE1-O 3.14Å; Q71-L73 HydrophobicContact CB-CG 4.37Å; Q71-L73 PolarHBondContact O-N 3.4Å; Q71-E197 PolarHBondContact NE2-OE1 2.77Å; Q71-E197 PolarHBondContact NE2-OE2 2.75Å; Q71-E197 PolarHBondContact OE1-OE1 2.74Å
72	P	92.4	Very high	94.2	Very high	100 Å²	100	67.2 Å²	67.2	65%	0.649	36%	0.363	S	S	*	.			trans	-74.3	71.5	176.4	32.3	-35.4	0	0	0	110
73	L	93.2	Very high	94.4	Very high	8 Å²	8	69.6 Å²	69.6	4%	0.042	37%	0.369	C	S	.	.			trans	-69.9	-39.3	176.1	-66.1	175	0	0	0	110	T55 Q71 Y189 H193	T55-L73 HydrophobicContact CG2-CD1 3.66Å; Q71-L73 HydrophobicContact CB-CG 4.37Å; Q71-L73 PolarHBondContact O-N 3.4Å; L73-Y189 HydrophobicContact CD1-CE1 4.44Å; L73-Y189 WeakPolarHBondContact CD1-OH 3.46Å; L73-H193 HydrophobicContact CD2-CB 4.43Å; L73-H193 PolarHBondContact O-CE1 3.29Å; L73-H193 PolarHBondContact O-ND1 3.2Å
74	Q	95.1	Very high	95.1	Very high	17 Å²	17	69.4 Å²	69.4	8%	0.079	37%	0.372	C	S	.	.	S	Bend	trans	-109.7	139.4	176.4	-65.3	-178.1	-93	0	0	111.4	Q69 S78 W79 Y189	Q69-Q74 PolarHBondContact NE2-O 2.79Å; Q74-S78 PolarHBondContact NE2-O 2.86Å; Q74-S78 PolarHBondContact NE2-OG 3Å; Q74-W79 HydrophobicContact CB-CB 4.07Å; Q74-Y189 HydrophobicContact CG-CE2 4Å
75	E	95.3	Very high	95.3	Very high	148 Å²	148	65.6 Å²	65.6	69%	0.692	36%	0.361	S	S	*	.			trans	-56.4	150.1	169.1	-66.4	-57.5	146.9	0	0	111.5	E77 S78 W79	E75-E77 VanDerWaalsContact C-N 3.3Å; E75-E77 PolarHBondContact O-N 2.79Å; E75-E77 VanDerWaalsContact O-N 3.1Å; E75-S78 PolarHBondContact O-N 3.22Å; E75-W79 PolarHBondContact O-N 3.36Å
76	P	96.3	Very high	95.3	Very high	100 Å²	100	67.7 Å²	67.7	65%	0.649	37%	0.371	S	S	*	.	H	α-helix	trans	-50.7	-42.7	-170.5	-30.3	35.4	0	0	0	115.1	W79 A80	P76-W79 PolarHBondContact O-N 2.94Å; P76-A80 WeakPolarHBondContact O-CB 3.31Å; P76-A80 PolarHBondContact O-N 3.21Å
77	E	96.6	Very high	95.3	Very high	135 Å²	135	65.7 Å²	65.7	63%	0.631	36%	0.356	S	S	*	.	H	α-helix	trans	-70.6	-40.8	-179.7	-163.6	-149.1	118.2	0	0	112.3	E75 W79 A80 R81	E75-E77 VanDerWaalsContact C-N 3.3Å; E75-E77 PolarHBondContact O-N 2.79Å; E75-E77 VanDerWaalsContact O-N 3.1Å; E77-W79 VanDerWaalsContact C-N 3.32Å; E77-A80 PolarHBondContact O-N 3.01Å; E77-R81 PolarHBondContact O-N 3.41Å; E77-R81 VanDerWaalsContact O-N 3.13Å; E77-R81 IonicContact OE1-CZ 3.7Å; E77-R81 IonicContact OE1-NE 3.98Å; E77-R81 PolarHBondContact OE1-NE 3.4Å; E77-R81 IonicContact OE1-NH2 2.74Å; E77-R81 PolarHBondContact OE1-NH2 3.22Å
78	S	95.6	Very high	95.2	Very high	28 Å²	28	66.9 Å²	66.9	20%	0.196	37%	0.368	C	S	.	.	H	α-helix	trans	-66.5	-38.4	175.7	-176.1	0	0	0	0	111.2	Q74 E75 R81 M82	Q74-S78 PolarHBondContact NE2-O 2.86Å; Q74-S78 PolarHBondContact NE2-OG 3Å; E75-S78 PolarHBondContact O-N 3.22Å; S78-R81 PolarHBondContact O-N 3.45Å; S78-M82 PolarHBondContact O-N 3.1Å; S78-M82 VanDerWaalsContact O-N 3.12Å
79	W	96.9	Very high	95.2	Very high	27 Å²	27	65.3 Å²	65.3	10%	0.102	36%	0.356	C	S	.	.	H	α-helix	trans	-64.8	-45.4	175.1	175.5	-115.6	0	0	0	111.4	H56 I67 Q69 Q74 E75 P76 E77 R81 M82 Q83	H56-W79 AromaticContact CD2-CH2 3.68Å; H56-W79 AromaticContact CD2-CZ3 3.67Å; H56-W79 AromaticContact NE2-CZ3 3.75Å; I67-W79 HydrophobicContact CB-CZ2 4.45Å; I67-W79 HydrophobicContact CG2-CH2 3.7Å; I67-W79 HydrophobicContact CG2-CZ2 3.97Å; Q69-W79 HydrophobicContact CB-CE3 4.41Å; Q69-W79 HydrophobicContact CB-CH2 4.38Å; Q69-W79 HydrophobicContact CB-CZ2 4.46Å; Q69-W79 HydrophobicContact CB-CZ3 4.35Å; Q69-W79 HydrophobicContact CG-CD2 4.08Å; Q69-W79 HydrophobicContact CG-CE3 4.4Å; Q69-W79 HydrophobicContact CG-CG 4.43Å; Q69-W79 VanDerWaalsContact NE2-CG 3.27Å; Q74-W79 HydrophobicContact CB-CB 4.07Å; E75-W79 PolarHBondContact O-N 3.36Å; P76-W79 PolarHBondContact O-N 2.94Å; E77-W79 VanDerWaalsContact C-N 3.32Å; W79-R81 VanDerWaalsContact C-N 3.28Å; W79-R81 PolarHBondContact O-N 2.94Å; W79-M82 HydrophobicContact CE3-CB 4.27Å; W79-M82 HydrophobicContact CE3-CG 4.38Å; W79-M82 HydrophobicContact CZ3-CB 4.44Å; W79-M82 HydrophobicContact CZ3-CG 4.09Å; W79-M82 PolarHBondContact O-N 2.84Å; W79-M82 VanDerWaalsContact O-N 3.13Å; W79-Q83 HydrophobicContact CZ2-CB 4.42Å; W79-Q83 VanDerWaalsContact NE1-OE1 3.09Å; W79-Q83 WeakPolarHBondContact O-CB 3.49Å; W79-Q83 PolarHBondContact O-N 3.44Å
80	A	96.8	Very high	95.2	Very high	56 Å²	56	63.8 Å²	63.8	46%	0.463	35%	0.349	S	S	.	.	H	α-helix	trans	-58.6	-39.5	177.6	0	0	0	0	0	112.3	P76 E77 S84	P76-A80 WeakPolarHBondContact O-CB 3.31Å; P76-A80 PolarHBondContact O-N 3.21Å; E77-A80 PolarHBondContact O-N 3.01Å; A80-S84 WeakPolarHBondContact O-CB 3.41Å; A80-S84 PolarHBondContact O-N 3.31Å
81	R	96.9	Very high	95.3	Very high	153 Å²	153	64.2 Å²	64.2	58%	0.577	35%	0.351	S	S	*	.	H	α-helix	trans	-64.1	-45.7	174	-75.9	-173.5	-91.6	115.2	-8.5	112.5	E77 S78 W79 S84 G85	E77-R81 PolarHBondContact O-N 3.41Å; E77-R81 VanDerWaalsContact O-N 3.13Å; E77-R81 IonicContact OE1-CZ 3.7Å; E77-R81 IonicContact OE1-NE 3.98Å; E77-R81 PolarHBondContact OE1-NE 3.4Å; E77-R81 IonicContact OE1-NH2 2.74Å; E77-R81 PolarHBondContact OE1-NH2 3.22Å; S78-R81 PolarHBondContact O-N 3.45Å; W79-R81 VanDerWaalsContact C-N 3.28Å; W79-R81 PolarHBondContact O-N 2.94Å; R81-S84 PolarHBondContact O-N 2.64Å; R81-G85 PolarHBondContact O-N 3.2Å; R81-G85 VanDerWaalsContact O-N 3.11Å
82	M	95.1	Very high	95.6	Very high	45 Å²	45	65.9 Å²	65.9	22%	0.222	36%	0.359	C	S	.	.	H	α-helix	trans	-60.4	-47.9	175.7	-179.6	61.2	78.2	0	0	111.2	S78 W79 S84 G85 L86 T185	S78-M82 PolarHBondContact O-N 3.1Å; S78-M82 VanDerWaalsContact O-N 3.12Å; W79-M82 HydrophobicContact CE3-CB 4.27Å; W79-M82 HydrophobicContact CE3-CG 4.38Å; W79-M82 HydrophobicContact CZ3-CB 4.44Å; W79-M82 HydrophobicContact CZ3-CG 4.09Å; W79-M82 PolarHBondContact O-N 2.84Å; W79-M82 VanDerWaalsContact O-N 3.13Å; M82-S84 VanDerWaalsContact C-N 3.32Å; M82-S84 PolarHBondContact O-N 3.04Å; M82-G85 PolarHBondContact O-N 2.97Å; M82-G85 VanDerWaalsContact O-N 3.12Å; M82-L86 HydrophobicContact CG-CD1 4.13Å; M82-L86 WeakPolarHBondContact O-CG 3.2Å; M82-L86 PolarHBondContact O-N 2.83Å; M82-L86 HydrophobicContact SD-CG 4.43Å; M82-T185 HydrophobicContact CE-CG2 4.36Å
83	Q	95.6	Very high	95.8	Very high	69 Å²	69	62.4 Å²	62.4	32%	0.322	33%	0.334	S	S	.	.	H	α-helix	trans	-59.5	-41.8	179	-172.5	178.8	-39.7	0	0	111.7	I67 W79 G85 L86 Q87	I67-Q83 HydrophobicContact CB-CG 4.48Å; W79-Q83 HydrophobicContact CZ2-CB 4.42Å; W79-Q83 VanDerWaalsContact NE1-OE1 3.09Å; W79-Q83 WeakPolarHBondContact O-CB 3.49Å; W79-Q83 PolarHBondContact O-N 3.44Å; Q83-G85 PolarHBondContact O-N 2.81Å; Q83-L86 PolarHBondContact O-N 2.96Å; Q83-Q87 VanDerWaalsContact O-CG 3.28Å; Q83-Q87 WeakPolarHBondContact O-CG 3.45Å; Q83-Q87 PolarHBondContact O-N 3.27Å
84	S	95.8	Very high	96	Very high	81 Å²	81	63.7 Å²	63.7	57%	0.566	34%	0.339	S	S	*	.	H	α-helix	trans	-60.4	-44.1	174.7	-173	0	0	0	0	112.1	A80 R81 M82 L86 Q87 A88	A80-S84 WeakPolarHBondContact O-CB 3.41Å; A80-S84 PolarHBondContact O-N 3.31Å; R81-S84 PolarHBondContact O-N 2.64Å; M82-S84 VanDerWaalsContact C-N 3.32Å; M82-S84 PolarHBondContact O-N 3.04Å; S84-L86 PolarHBondContact O-N 3.24Å; S84-Q87 PolarHBondContact O-N 3.26Å; S84-A88 PolarHBondContact O-N 2.83Å
85	G	94.9	Very high	96.1	Very high	41 Å²	41	64.2 Å²	64.2	42%	0.423	35%	0.349	S	S	.	.	H	α-helix	trans	-61	-43.2	175.4	0	0	0	0	0	112.9	R81 M82 Q83 A88 Y89	R81-G85 PolarHBondContact O-N 3.2Å; R81-G85 VanDerWaalsContact O-N 3.11Å; M82-G85 PolarHBondContact O-N 2.97Å; M82-G85 VanDerWaalsContact O-N 3.12Å; Q83-G85 PolarHBondContact O-N 2.81Å; G85-A88 PolarHBondContact O-N 3.14Å; G85-Y89 PolarHBondContact O-N 3.36Å
86	L	95.4	Very high	96.2	Very high	46 Å²	46	59.5 Å²	59.5	24%	0.241	33%	0.329	C	S	.	.	H	α-helix	trans	-65.9	-38.6	176.8	-67.5	172	0	0	0	112.2	I67 M82 Q83 S84 Y89 L90	I67-L86 HydrophobicContact CD1-CB 3.49Å; I67-L86 VanDerWaalsContact CD1-CB 3.49Å; I67-L86 HydrophobicContact CD1-CD1 4.07Å; I67-L86 HydrophobicContact CD1-CG 4.43Å; I67-L86 HydrophobicContact CG2-CD1 3.98Å; M82-L86 HydrophobicContact CG-CD1 4.13Å; M82-L86 WeakPolarHBondContact O-CG 3.2Å; M82-L86 PolarHBondContact O-N 2.83Å; M82-L86 HydrophobicContact SD-CG 4.43Å; Q83-L86 PolarHBondContact O-N 2.96Å; S84-L86 PolarHBondContact O-N 3.24Å; L86-Y89 WeakPolarHBondContact O-CB 3.48Å; L86-Y89 PolarHBondContact O-N 3.35Å; L86-L90 WeakPolarHBondContact O-CG 3.35Å; L86-L90 PolarHBondContact O-N 2.75Å
87	Q	95.9	Very high	96.3	Very high	38 Å²	38	55.2 Å²	55.2	18%	0.178	30%	0.301	C	S	.	.	H	α-helix	trans	-64.6	-42.8	175	-70.5	-67.6	-7.4	0	0	111.9	A65 I67 Q83 S84 Y89 L90 L91	A65-Q87 PolarHBondContact O-NE2 2.95Å; I67-Q87 HydrophobicContact CD1-CG 4.48Å; Q83-Q87 VanDerWaalsContact O-CG 3.28Å; Q83-Q87 WeakPolarHBondContact O-CG 3.45Å; Q83-Q87 PolarHBondContact O-N 3.27Å; S84-Q87 PolarHBondContact O-N 3.26Å; Q87-Y89 VanDerWaalsContact C-N 3.3Å; Q87-Y89 PolarHBondContact O-N 2.84Å; Q87-L90 PolarHBondContact O-N 2.69Å; Q87-L91 PolarHBondContact O-N 2.87Å; Q87-L91 VanDerWaalsContact O-N 3.08Å
88	A	95.3	Very high	96.3	Very high	37 Å²	37	54 Å²	54	31%	0.306	29%	0.291	S	S	.	.	H	α-helix	trans	-60.4	-41.7	173.5	0	0	0	0	0	111.6	S84 G85 L91 E92	S84-A88 PolarHBondContact O-N 2.83Å; G85-A88 PolarHBondContact O-N 3.14Å; A88-L91 WeakPolarHBondContact O-CB 3.48Å; A88-L91 PolarHBondContact O-N 3.01Å; A88-E92 WeakPolarHBondContact O-CG 3.25Å; A88-E92 PolarHBondContact O-N 3.3Å
89	Y	95.9	Very high	96.4	Very high	60 Å²	60	55.4 Å²	55.4	24%	0.235	30%	0.295	C	S	.	.	H	α-helix	trans	-60.4	-45.4	174.1	161	-102.3	0	0	0	112.8	Q32 G85 L86 Q87 L91 E92 F93	Q32-Y89 PolarHBondContact OE1-OH 3.14Å; G85-Y89 PolarHBondContact O-N 3.36Å; L86-Y89 WeakPolarHBondContact O-CB 3.48Å; L86-Y89 PolarHBondContact O-N 3.35Å; Q87-Y89 VanDerWaalsContact C-N 3.3Å; Q87-Y89 PolarHBondContact O-N 2.84Å; Y89-L91 VanDerWaalsContact C-N 3.28Å; Y89-L91 PolarHBondContact O-N 2.84Å; Y89-E92 PolarHBondContact O-N 3.49Å; Y89-F93 HydrophobicContact CE2-CB 4.44Å; Y89-F93 VanDerWaalsContact O-CB 3.27Å; Y89-F93 WeakPolarHBondContact O-CB 3.41Å; Y89-F93 PolarHBondContact O-N 2.78Å
90	L	97	Very high	96.4	Very high	6 Å²	6	54.1 Å²	54.1	3%	0.031	29%	0.291	C	S	.	.	H	α-helix	trans	-62.7	-36.1	177.9	-67.6	178	0	0	0	112.3	Y44 L58 A65 L86 Q87 H94	Y44-L90 HydrophobicContact CD1-CD2 4.03Å; Y44-L90 HydrophobicContact CD2-CD1 4.17Å; Y44-L90 HydrophobicContact CD2-CD2 4.34Å; Y44-L90 HydrophobicContact CE1-CD2 3.87Å; Y44-L90 HydrophobicContact CE2-CB 4.13Å; Y44-L90 HydrophobicContact CE2-CD1 4.25Å; Y44-L90 HydrophobicContact CE2-CD2 4.16Å; Y44-L90 HydrophobicContact CE2-CG 4.41Å; Y44-L90 HydrophobicContact CG-CD2 4.27Å; Y44-L90 PolarHBondContact OH-O 3.24Å; Y44-L90 VanDerWaalsContact OH-O 3.12Å; L58-L90 HydrophobicContact CD1-CD1 3.83Å; L58-L90 HydrophobicContact CD2-CD2 4.25Å; A65-L90 HydrophobicContact CB-CD1 4.23Å; L86-L90 WeakPolarHBondContact O-CG 3.35Å; L86-L90 PolarHBondContact O-N 2.75Å; Q87-L90 PolarHBondContact O-N 2.69Å; L90-H94 WeakPolarHBondContact O-CB 3.38Å; L90-H94 PolarHBondContact O-N 3.02Å
91	L	96.4	Very high	96.4	Very high	100 Å²	100	53.7 Å²	53.7	52%	0.524	28%	0.279	S	S	.	.	H	α-helix	trans	-64.1	-49.3	173.4	-78.6	167.7	0	0	0	111.9	T63 Q87 A88 Y89 H94 G95	T63-L91 HydrophobicContact CG2-CD2 3.35Å; T63-L91 HydrophobicContact CG2-CG 4.22Å; Q87-L91 PolarHBondContact O-N 2.87Å; Q87-L91 VanDerWaalsContact O-N 3.08Å; A88-L91 WeakPolarHBondContact O-CB 3.48Å; A88-L91 PolarHBondContact O-N 3.01Å; Y89-L91 VanDerWaalsContact C-N 3.28Å; Y89-L91 PolarHBondContact O-N 2.84Å; L91-H94 PolarHBondContact O-N 2.94Å; L91-G95 PolarHBondContact O-N 3.46Å
92	E	95.3	Very high	96.4	Very high	89 Å²	89	51.9 Å²	51.9	42%	0.416	28%	0.277	S	S	.	.	H	α-helix	trans	-62.1	-43.5	177.8	-73.3	172.8	-161	0	0	111.4	A88 Y89 G95 L96 R173	A88-E92 WeakPolarHBondContact O-CG 3.25Å; A88-E92 PolarHBondContact O-N 3.3Å; Y89-E92 PolarHBondContact O-N 3.49Å; E92-G95 PolarHBondContact O-N 2.97Å; E92-L96 PolarHBondContact O-N 2.82Å; E92-R173 IonicContact OE1-CZ 2.86Å; E92-R173 IonicContact OE1-NE 3.21Å; E92-R173 IonicContact OE1-NH2 3.72Å; E92-R173 PolarHBondContact OE1-NH2 3.3Å; E92-R173 VanDerWaalsContact OE1-NH2 3.11Å; E92-R173 IonicContact OE2-CZ 3.72Å; E92-R173 IonicContact OE2-NE 3.11Å; E92-R173 PolarHBondContact OE2-NE 2.93Å; E92-R173 IonicContact OE2-NH2 3.63Å; E92-R173 PolarHBondContact OE2-NH2 2.91Å
93	F	97.3	Very high	96.6	Very high	27 Å²	27	54.3 Å²	54.3	12%	0.118	29%	0.288	C	S	.	.	H	α-helix	trans	-59.4	-50.2	177.1	174.2	-94.6	0	0	0	111.8	S34 F36 Y44 Y89 G95 L96 V97 I112	S34-F93 WeakPolarHBondContact OG-CE1 3.42Å; F36-F93 AromaticContact CE2-CE1 3.87Å; F36-F93 HydrophobicContact CE2-CE1 3.87Å; F36-F93 HydrophobicContact CE2-CZ 4.41Å; F36-F93 HydrophobicContact CZ-CD1 4.39Å; F36-F93 AromaticContact CZ-CE1 3.77Å; F36-F93 HydrophobicContact CZ-CE1 3.77Å; Y44-F93 HydrophobicContact CE1-CD1 4.09Å; Y44-F93 HydrophobicContact CE1-CE1 4.17Å; Y89-F93 HydrophobicContact CE2-CB 4.44Å; Y89-F93 VanDerWaalsContact O-CB 3.27Å; Y89-F93 WeakPolarHBondContact O-CB 3.41Å; Y89-F93 PolarHBondContact O-N 2.78Å; F93-G95 VanDerWaalsContact C-N 3.31Å; F93-G95 PolarHBondContact O-N 3.19Å; F93-L96 PolarHBondContact O-N 2.83Å; F93-V97 HydrophobicContact CE1-CG2 4.27Å; F93-V97 HydrophobicContact CZ-CG2 4.29Å; F93-V97 WeakPolarHBondContact O-CG2 3.34Å; F93-V97 PolarHBondContact O-N 2.87Å; F93-V97 VanDerWaalsContact O-N 3.1Å; F93-I112 HydrophobicContact CE2-CG2 4.26Å; F93-I112 HydrophobicContact CZ-CB 4.09Å; F93-I112 HydrophobicContact CZ-CD1 3.99Å; F93-I112 HydrophobicContact CZ-CG2 3.86Å
94	H	97.7	Very high	96.6	Very high	34 Å²	34	55.4 Å²	55.4	16%	0.157	29%	0.289	C	S	.	.	H	α-helix	trans	-62.1	-41.9	176.1	-172.3	-176.7	0	0	0	111.2	F36 P39 Y40 L90 L91 L96 V97 R98	F36-H94 AromaticContact CE1-CD2 3.61Å; P39-H94 PolarHBondContact O-NE2 2.78Å; Y40-H94 PolarHBondContact O-CE1 2.88Å; Y40-H94 VanDerWaalsContact O-CE1 3.28Å; L90-H94 WeakPolarHBondContact O-CB 3.38Å; L90-H94 PolarHBondContact O-N 3.02Å; L91-H94 PolarHBondContact O-N 2.94Å; H94-L96 VanDerWaalsContact C-N 3.31Å; H94-L96 PolarHBondContact O-N 2.92Å; H94-V97 PolarHBondContact O-N 2.78Å; H94-R98 PolarHBondContact O-N 3.28Å
95	G	97	Very high	96.5	Very high	28 Å²	28	56.7 Å²	56.7	29%	0.289	29%	0.293	S	S	.	.	H	α-helix	trans	-54.8	-45.1	174.8	0	0	0	0	0	112.8	L91 E92 F93 R98 L99	L91-G95 PolarHBondContact O-N 3.46Å; E92-G95 PolarHBondContact O-N 2.97Å; F93-G95 VanDerWaalsContact C-N 3.31Å; F93-G95 PolarHBondContact O-N 3.19Å; G95-R98 PolarHBondContact O-N 2.91Å; G95-L99 WeakPolarHBondContact O-CB 3.37Å; G95-L99 PolarHBondContact O-N 2.94Å
96	L	96.9	Very high	96.6	Very high	49 Å²	49	56.1 Å²	56.1	26%	0.257	28%	0.281	S	S	.	.	H	α-helix	trans	-64.3	-45.3	177.2	179.8	60.8	0	0	0	112	E92 F93 H94 R98 L99 V100 Q167 L168	E92-L96 PolarHBondContact O-N 2.82Å; F93-L96 PolarHBondContact O-N 2.83Å; H94-L96 VanDerWaalsContact C-N 3.31Å; H94-L96 PolarHBondContact O-N 2.92Å; L96-R98 VanDerWaalsContact C-N 3.28Å; L96-R98 PolarHBondContact O-N 2.91Å; L96-L99 HydrophobicContact CD1-CD2 4.45Å; L96-L99 WeakPolarHBondContact O-CB 3.31Å; L96-L99 PolarHBondContact O-N 2.89Å; L96-V100 HydrophobicContact CD1-CG2 4.28Å; L96-V100 VanDerWaalsContact O-CG2 3.25Å; L96-V100 WeakPolarHBondContact O-CG2 3.36Å; L96-V100 PolarHBondContact O-N 3.12Å; L96-Q167 HydrophobicContact CD1-CB 4.09Å; L96-Q167 HydrophobicContact CD1-CG 4.48Å; L96-L168 HydrophobicContact CD2-CD2 3.74Å
97	V	97.3	Very high	96.6	Very high	11 Å²	11	58 Å²	58	7%	0.067	30%	0.303	C	S	.	.	H	α-helix	trans	-59.2	-42.5	177.4	174.6	0	0	0	0	110.9	F36 F93 H94 V100 H101 L106 I112	F36-V97 HydrophobicContact CD1-CG1 4.19Å; F36-V97 HydrophobicContact CE1-CB 4.16Å; F36-V97 HydrophobicContact CE1-CG1 3.86Å; F36-V97 HydrophobicContact CE1-CG2 4.47Å; F36-V97 HydrophobicContact CE2-CG1 4.27Å; F36-V97 HydrophobicContact CE2-CG2 4.16Å; F36-V97 HydrophobicContact CZ-CB 3.98Å; F36-V97 HydrophobicContact CZ-CG1 3.9Å; F36-V97 HydrophobicContact CZ-CG2 3.79Å; F93-V97 HydrophobicContact CE1-CG2 4.27Å; F93-V97 HydrophobicContact CZ-CG2 4.29Å; F93-V97 WeakPolarHBondContact O-CG2 3.34Å; F93-V97 PolarHBondContact O-N 2.87Å; F93-V97 VanDerWaalsContact O-N 3.1Å; H94-V97 PolarHBondContact O-N 2.78Å; V97-V100 PolarHBondContact O-N 3.02Å; V97-H101 PolarHBondContact O-N 3.04Å; V97-L106 HydrophobicContact CG1-CD1 4Å; V97-I112 HydrophobicContact CG1-CD1 4.5Å; V97-I112 HydrophobicContact CG2-CD1 3.62Å
98	R	97.6	Very high	96.7	Very high	110 Å²	110	58.6 Å²	58.6	42%	0.415	31%	0.305	S	S	.	.	H	α-helix	trans	-64.7	-44.1	176.7	-173.3	177.6	65	154.2	1.2	112	H94 G95 L96 V100 H101 Q102	H94-R98 PolarHBondContact O-N 3.28Å; G95-R98 PolarHBondContact O-N 2.91Å; L96-R98 VanDerWaalsContact C-N 3.28Å; L96-R98 PolarHBondContact O-N 2.91Å; R98-V100 VanDerWaalsContact C-N 3.32Å; R98-V100 PolarHBondContact O-N 2.83Å; R98-H101 PolarHBondContact O-N 3.23Å; R98-Q102 WeakPolarHBondContact O-CG 3.28Å; R98-Q102 PolarHBondContact O-N 2.96Å
99	L	97.4	Very high	96.8	Very high	56 Å²	56	61.8 Å²	61.8	29%	0.293	32%	0.323	S	S	.	.	H	α-helix	trans	-57.4	-46.9	175.8	174.2	63.7	0	0	0	111	G95 L96 H101 Q102 E103 F163	G95-L99 WeakPolarHBondContact O-CB 3.37Å; G95-L99 PolarHBondContact O-N 2.94Å; L96-L99 HydrophobicContact CD1-CD2 4.45Å; L96-L99 WeakPolarHBondContact O-CB 3.31Å; L96-L99 PolarHBondContact O-N 2.89Å; L99-H101 VanDerWaalsContact C-N 3.32Å; L99-H101 PolarHBondContact O-N 3.1Å; L99-Q102 PolarHBondContact O-N 2.9Å; L99-E103 HydrophobicContact CD1-CG 4.07Å; L99-E103 WeakPolarHBondContact O-CB 3.44Å; L99-E103 WeakPolarHBondContact O-CG 3.41Å; L99-E103 PolarHBondContact O-N 2.94Å; L99-F163 HydrophobicContact CG-CE1 4.39Å; L99-F163 HydrophobicContact CG-CZ 4.42Å
100	V	96.8	Very high	96.9	Very high	1 Å²	1	59.4 Å²	59.4	1%	0.006	31%	0.314	C	S	.	.	H	α-helix	trans	-62.1	-41	178.1	176.8	0	0	0	0	111.3	L96 V97 R98 E103 R104 L106 V160 F163 I164	L96-V100 HydrophobicContact CD1-CG2 4.28Å; L96-V100 VanDerWaalsContact O-CG2 3.25Å; L96-V100 WeakPolarHBondContact O-CG2 3.36Å; L96-V100 PolarHBondContact O-N 3.12Å; V97-V100 PolarHBondContact O-N 3.02Å; R98-V100 VanDerWaalsContact C-N 3.32Å; R98-V100 PolarHBondContact O-N 2.83Å; V100-E103 PolarHBondContact O-N 2.78Å; V100-R104 PolarHBondContact O-N 3.04Å; V100-L106 HydrophobicContact CB-CD1 4.28Å; V100-L106 HydrophobicContact CG1-CD1 4.08Å; V100-L106 HydrophobicContact CG1-CD2 3.86Å; V100-L106 HydrophobicContact CG1-CG 4.05Å; V100-V160 HydrophobicContact CG1-CG1 3.84Å; V100-F163 HydrophobicContact CB-CD1 4.46Å; V100-F163 HydrophobicContact CG1-CD1 4.38Å; V100-F163 HydrophobicContact CG2-CD1 4.03Å; V100-F163 HydrophobicContact CG2-CE1 4.05Å; V100-I164 HydrophobicContact CB-CG1 4.38Å; V100-I164 HydrophobicContact CG1-CD1 3.95Å; V100-I164 HydrophobicContact CG1-CG1 3.96Å; V100-I164 HydrophobicContact CG2-CD1 3.98Å; V100-I164 HydrophobicContact CG2-CG1 3.47Å; V100-I164 VanDerWaalsContact CG2-CG1 3.47Å
101	H	97.1	Very high	97	Very high	47 Å²	47	61.3 Å²	61.3	22%	0.218	33%	0.326	C	S	.	.	H	α-helix	trans	-63.4	-43.2	175.5	173.7	73.6	0	0	0	112.1	P39 V97 R98 L99 E103 T105 L106 F108	P39-H101 WeakPolarHBondContact CG-CD2 3.4Å; P39-H101 WeakPolarHBondContact CG-NE2 3.32Å; V97-H101 PolarHBondContact O-N 3.04Å; R98-H101 PolarHBondContact O-N 3.23Å; L99-H101 VanDerWaalsContact C-N 3.32Å; L99-H101 PolarHBondContact O-N 3.1Å; H101-E103 VanDerWaalsContact C-N 3.27Å; H101-E103 PolarHBondContact O-N 3.37Å; H101-T105 WeakPolarHBondContact O-CA 3.25Å; H101-T105 PolarHBondContact O-N 3.45Å; H101-L106 HydrophobicContact CB-CB 4.1Å; H101-L106 HydrophobicContact CB-CD1 4.15Å; H101-L106 HydrophobicContact CB-CG 4.05Å; H101-L106 PolarHBondContact ND1-N 3.26Å; H101-L106 VanDerWaalsContact ND1-N 3.12Å; H101-L106 PolarHBondContact ND1-O 2.91Å; H101-F108 HydrophobicContact CB-CE2 4.21Å; H101-F108 HydrophobicContact CB-CZ 4.46Å; H101-F108 AromaticContact CG-CE2 3.83Å; H101-F108 AromaticContact ND1-CE2 3.5Å
102	Q	97.4	Very high	97.1	Very high	115 Å²	115	57.3 Å²	57.3	54%	0.537	31%	0.305	S	S	.	.	H	α-helix	trans	-61.3	-38.6	177	-71.4	172.1	-27.4	0	0	112	R98 L99	R98-Q102 WeakPolarHBondContact O-CG 3.28Å; R98-Q102 PolarHBondContact O-N 2.96Å; L99-Q102 PolarHBondContact O-N 2.9Å
103	E	97.6	Very high	97.3	Very high	96 Å²	96	57.5 Å²	57.5	45%	0.449	30%	0.302	S	S	.	.	H	α-helix	trans	-85.5	-37.7	-174.6	-77.4	-70.8	156.6	0	0	113.7	L99 V100 H101 F163	L99-E103 HydrophobicContact CD1-CG 4.07Å; L99-E103 WeakPolarHBondContact O-CB 3.44Å; L99-E103 WeakPolarHBondContact O-CG 3.41Å; L99-E103 PolarHBondContact O-N 2.94Å; V100-E103 PolarHBondContact O-N 2.78Å; H101-E103 VanDerWaalsContact C-N 3.27Å; H101-E103 PolarHBondContact O-N 3.37Å; E103-F163 HydrophobicContact CB-CD1 4.31Å; E103-F163 HydrophobicContact CB-CE1 3.77Å; E103-F163 HydrophobicContact CB-CE2 4.06Å; E103-F163 HydrophobicContact CB-CZ 3.64Å; E103-F163 HydrophobicContact CG-CE1 4.06Å; E103-F163 HydrophobicContact CG-CE2 4.07Å; E103-F163 HydrophobicContact CG-CZ 3.53Å
104	R	96.1	Very high	97.3	Very high	92 Å²	92	56.3 Å²	56.3	35%	0.347	30%	0.296	S	S	.	.	H	α-helix	trans	-130.8	4.9	-170.1	-60	-62.5	176.4	-86.3	-4.6	114.5	V100 V160 F163	V100-R104 PolarHBondContact O-N 3.04Å; R104-V160 HydrophobicContact CB-CG2 3.97Å; R104-F163 HydrophobicContact CG-CB 3.73Å; R104-F163 HydrophobicContact CG-CD1 4.12Å; R104-F163 HydrophobicContact CG-CD2 4.45Å; R104-F163 HydrophobicContact CG-CG 3.84Å
105	T	95.3	Very high	97.4	Very high	107 Å²	107	57 Å²	57	66%	0.656	30%	0.299	S	S	*	.			trans	52.5	98	-179.4	-55.5	0	0	0	0	113.2	H101	H101-T105 WeakPolarHBondContact O-CA 3.25Å; H101-T105 PolarHBondContact O-N 3.45Å
106	L	95.9	Very high	97.5	Very high	30 Å²	30	56.3 Å²	56.3	16%	0.157	29%	0.289	C	S	.	.			trans	-81.5	144.5	169.8	-62.2	178.3	0	0	0	111.7	V97 V100 H101 F108 L110 V160	V97-L106 HydrophobicContact CG1-CD1 4Å; V100-L106 HydrophobicContact CB-CD1 4.28Å; V100-L106 HydrophobicContact CG1-CD1 4.08Å; V100-L106 HydrophobicContact CG1-CD2 3.86Å; V100-L106 HydrophobicContact CG1-CG 4.05Å; H101-L106 HydrophobicContact CB-CB 4.1Å; H101-L106 HydrophobicContact CB-CD1 4.15Å; H101-L106 HydrophobicContact CB-CG 4.05Å; H101-L106 PolarHBondContact ND1-N 3.26Å; H101-L106 VanDerWaalsContact ND1-N 3.12Å; H101-L106 PolarHBondContact ND1-O 2.91Å; L106-F108 HydrophobicContact CB-CD2 4.41Å; L106-F108 HydrophobicContact CB-CE2 3.73Å; L106-F108 HydrophobicContact CB-CZ 4.09Å; L106-F108 HydrophobicContact CD1-CZ 4.37Å; L106-F108 WeakPolarHBondContact O-CD2 3.15Å; L106-L110 HydrophobicContact CB-CD2 3.91Å; L106-L110 HydrophobicContact CD1-CD2 3.99Å; L106-L110 HydrophobicContact CG-CD2 4.47Å; L106-V160 HydrophobicContact CD2-CG1 3.56Å; L106-V160 HydrophobicContact CD2-CG2 4.2Å
107	A	96.4	Very high	97.5	Very high	85 Å²	85	54 Å²	54	70%	0.702	28%	0.276	S	S	*	.			trans	-86	127.4	170.6	0	0	0	0	0	110.2
108	F	97.2	Very high	97.6	Very high	50 Å²	50	53.4 Å²	53.4	22%	0.219	27%	0.273	C	S	.	.	S	Bend	trans	-112.7	154.4	177.5	-68.8	-89.1	0	0	0	110.9	F36 P39 H101 L106 L110	F36-F108 HydrophobicContact CB-CD1 3.7Å; F36-F108 HydrophobicContact CB-CE1 3.5Å; F36-F108 VanDerWaalsContact CB-CE1 3.5Å; F36-F108 HydrophobicContact CD1-CE1 4.31Å; F36-F108 HydrophobicContact CG-CE1 4.11Å; P39-F108 HydrophobicContact CB-CE2 4.26Å; P39-F108 HydrophobicContact CB-CZ 4.12Å; P39-F108 HydrophobicContact CG-CD2 4.13Å; P39-F108 HydrophobicContact CG-CE2 3.54Å; P39-F108 HydrophobicContact CG-CZ 3.9Å; H101-F108 HydrophobicContact CB-CE2 4.21Å; H101-F108 HydrophobicContact CB-CZ 4.46Å; H101-F108 AromaticContact CG-CE2 3.83Å; H101-F108 AromaticContact ND1-CE2 3.5Å; L106-F108 HydrophobicContact CB-CD2 4.41Å; L106-F108 HydrophobicContact CB-CE2 3.73Å; L106-F108 HydrophobicContact CB-CZ 4.09Å; L106-F108 HydrophobicContact CD1-CZ 4.37Å; L106-F108 WeakPolarHBondContact O-CD2 3.15Å; F108-L110 HydrophobicContact CD1-CD2 3.82Å; F108-L110 HydrophobicContact CD1-CG 3.8Å; F108-L110 HydrophobicContact CE1-CD1 4.49Å; F108-L110 HydrophobicContact CE1-CD2 3.52Å; F108-L110 HydrophobicContact CE1-CG 3.74Å; F108-L110 HydrophobicContact CE2-CD2 4.38Å; F108-L110 HydrophobicContact CG-CD2 4.38Å; F108-L110 HydrophobicContact CZ-CD2 3.84Å
109	P	98.1	Very high	97.5	Very high	105 Å²	105	50.4 Å²	50.4	68%	0.682	26%	0.264	S	S	*	.	S	Bend	cis	-69.6	151.6	-2.2	31.1	-36	0	0	0	112	F36	F36-P109 VanDerWaalsContact O-CA 3.26Å; F36-P109 WeakPolarHBondContact O-CA 3.42Å; F36-P109 WeakPolarHBondContact O-CB 3.48Å
110	L	97.5	Very high	97.3	Very high	9 Å²	9	48.7 Å²	48.7	5%	0.047	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	149.6	174.6	67.1	85.4	0	0	0	110.9	F36 L106 F108 I112 N136	F36-L110 HydrophobicContact CB-CD1 4.08Å; F36-L110 HydrophobicContact CB-CG 4.1Å; F36-L110 HydrophobicContact CD2-CD1 3.65Å; F36-L110 HydrophobicContact CE2-CD1 4.45Å; F36-L110 HydrophobicContact CG-CD1 4.13Å; F36-L110 PolarHBondContact N-O 2.99Å; F36-L110 PolarHBondContact O-N 3.25Å; L106-L110 HydrophobicContact CB-CD2 3.91Å; L106-L110 HydrophobicContact CD1-CD2 3.99Å; L106-L110 HydrophobicContact CG-CD2 4.47Å; F108-L110 HydrophobicContact CD1-CD2 3.82Å; F108-L110 HydrophobicContact CD1-CG 3.8Å; F108-L110 HydrophobicContact CE1-CD1 4.49Å; F108-L110 HydrophobicContact CE1-CD2 3.52Å; F108-L110 HydrophobicContact CE1-CG 3.74Å; F108-L110 HydrophobicContact CE2-CD2 4.38Å; F108-L110 HydrophobicContact CG-CD2 4.38Å; F108-L110 HydrophobicContact CZ-CD2 3.84Å; L110-I112 HydrophobicContact CD1-CD1 3.79Å; L110-I112 HydrophobicContact CD1-CG1 3.48Å; L110-I112 VanDerWaalsContact CD1-CG1 3.48Å; L110-N136 WeakPolarHBondContact CA-OD1 3.46Å
111	T	98.7	Very high	96.9	Very high	46 Å²	46	50.5 Å²	50.5	28%	0.282	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	125.5	175.6	-56.5	0	0	0	0	108.9	I33 S34 Y35 V135 N136	I33-T111 HydrophobicContact CG2-CG2 3.64Å; S34-T111 WeakPolarHBondContact O-CA 3.39Å; Y35-T111 HydrophobicContact CD1-CG2 3.84Å; Y35-T111 HydrophobicContact CE1-CG2 3.81Å; T111-V135 CarbonylContact O-C 3.53Å; T111-V135 WeakPolarHBondContact O-CA 3.39Å; T111-N136 PolarHBondContact N-OD1 3.35Å; T111-N136 PolarHBondContact O-N 2.83Å
112	I	98.7	Very high	96.1	Very high	16 Å²	16	53.5 Å²	53.5	8%	0.082	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	129.5	172.3	-54.5	-179.3	0	0	0	107.9	I33 S34 F36 F93 V97 L110 V133 A134 V135	I33-I112 CarbonylContact C-O 3.5Å; I33-I112 WeakPolarHBondContact CA-O 3.42Å; S34-I112 PolarHBondContact N-O 3.47Å; S34-I112 PolarHBondContact O-N 3.08Å; F36-I112 HydrophobicContact CD2-CD1 4.39Å; F36-I112 HydrophobicContact CD2-CG1 4.46Å; F36-I112 HydrophobicContact CE2-CD1 3.91Å; F36-I112 HydrophobicContact CE2-CG1 4.29Å; F93-I112 HydrophobicContact CE2-CG2 4.26Å; F93-I112 HydrophobicContact CZ-CB 4.09Å; F93-I112 HydrophobicContact CZ-CD1 3.99Å; F93-I112 HydrophobicContact CZ-CG2 3.86Å; V97-I112 HydrophobicContact CG1-CD1 4.5Å; V97-I112 HydrophobicContact CG2-CD1 3.62Å; L110-I112 HydrophobicContact CD1-CD1 3.79Å; L110-I112 HydrophobicContact CD1-CG1 3.48Å; L110-I112 VanDerWaalsContact CD1-CG1 3.48Å; I112-V133 HydrophobicContact CG2-CG1 3.73Å; I112-A134 CarbonylContact C-O 3.58Å; I112-A134 WeakPolarHBondContact CA-O 3.43Å; I112-V135 HydrophobicContact CG1-CG2 4.4Å
113	R	98.8	Very high	95.1	Very high	94 Å²	94	56.1 Å²	56.1	36%	0.355	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	121.1	172.3	177	-177.6	173.9	-84.1	-1.6	108.5	L31 Q32 I33 V133 A134	L31-R113 HydrophobicContact CD1-CG 3.77Å; Q32-R113 CarbonylContact O-C 3.56Å; Q32-R113 WeakPolarHBondContact O-CA 3.32Å; I33-R113 HydrophobicContact CG1-CG 4.47Å; R113-V133 CarbonylContact O-C 3.42Å; R113-V133 WeakPolarHBondContact O-CA 3.36Å; R113-A134 HydrophobicContact CB-CB 4.38Å; R113-A134 PolarHBondContact N-O 2.74Å; R113-A134 PolarHBondContact O-N 3.33Å
114	C	98.8	Very high	93.8	Very high	1 Å²	1	55 Å²	55	1%	0.007	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	125.7	170.1	-60.3	0	0	0	0	108.3	Q32 L116 F131 E132	Q32-C114 HydrophobicContact CB-CB 4.22Å; Q32-C114 PolarHBondContact N-O 3.21Å; Q32-C114 PolarHBondContact O-N 3.04Å; C114-L116 HydrophobicContact CB-CD2 4.35Å; C114-F131 HydrophobicContact CB-CE1 3.66Å; C114-F131 HydrophobicContact CB-CZ 4.11Å; C114-E132 WeakPolarHBondContact CA-O 3.12Å
115	F	98.8	Very high	93.3	Very high	49 Å²	49	54 Å²	54	22%	0.215	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	117.8	172.8	-179.1	-123.9	0	0	0	108.4	H29 M30 L31 F130 F131 E132	H29-F115 HydrophobicContact CB-CE2 4.09Å; H29-F115 HydrophobicContact CB-CZ 4.44Å; M30-F115 WeakPolarHBondContact O-CD2 3.24Å; L31-F115 HydrophobicContact CD1-CD2 4.5Å; F115-F130 HydrophobicContact CD1-CD2 4.08Å; F115-F130 AromaticContact CD1-CE2 3.45Å; F115-F130 HydrophobicContact CD1-CE2 3.45Å; F115-F130 VanDerWaalsContact CD1-CE2 3.45Å; F115-F130 HydrophobicContact CD1-CZ 4.3Å; F115-F130 HydrophobicContact CD2-CE2 4.28Å; F115-F130 HydrophobicContact CE1-CD2 4.16Å; F115-F130 AromaticContact CE1-CE2 3.27Å; F115-F130 HydrophobicContact CE1-CE2 3.27Å; F115-F130 AromaticContact CE1-CZ 3.66Å; F115-F130 HydrophobicContact CE1-CZ 3.66Å; F115-F130 HydrophobicContact CE2-CE2 4.13Å; F115-F130 HydrophobicContact CE2-CZ 4.34Å; F115-F130 AromaticContact CG-CE2 3.96Å; F115-F130 HydrophobicContact CG-CE2 3.96Å; F115-F130 AromaticContact CZ-CE2 3.64Å; F115-F130 HydrophobicContact CZ-CE2 3.64Å; F115-F130 AromaticContact CZ-CZ 3.68Å; F115-F130 HydrophobicContact CZ-CZ 3.68Å; F115-F131 CarbonylContact O-C 3.48Å; F115-F131 WeakPolarHBondContact O-CA 3.29Å; F115-E132 PolarHBondContact N-O 3.41Å; F115-E132 PolarHBondContact O-N 2.93Å
116	L	98.7	Very high	93	Very high	13 Å²	13	56.7 Å²	56.7	7%	0.068	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	158	-172.1	67.2	155.6	0	0	0	110.9	M30 C114 F130 F131 F181 L182	M30-L116 HydrophobicContact CB-CD2 4.05Å; M30-L116 HydrophobicContact CB-CG 4.07Å; M30-L116 HydrophobicContact CE-CD1 4.27Å; M30-L116 HydrophobicContact CE-CG 4.2Å; M30-L116 PolarHBondContact N-O 2.79Å; M30-L116 PolarHBondContact O-N 3.38Å; C114-L116 HydrophobicContact CB-CD2 4.35Å; L116-F130 VanDerWaalsContact C-CE2 3.46Å; L116-F130 WeakPolarHBondContact CA-O 3.31Å; L116-F130 WeakPolarHBondContact CB-O 3.37Å; L116-F131 HydrophobicContact CB-CB 3.97Å; L116-F131 HydrophobicContact CB-CD1 4.13Å; L116-F131 HydrophobicContact CB-CD2 3.91Å; L116-F131 HydrophobicContact CB-CE2 4.45Å; L116-F131 HydrophobicContact CB-CG 3.73Å; L116-F131 HydrophobicContact CD1-CD2 3.84Å; L116-F131 HydrophobicContact CD1-CE2 3.8Å; L116-F131 HydrophobicContact CD1-CZ 4.42Å; L116-F131 HydrophobicContact CD2-CZ 4.43Å; L116-F131 HydrophobicContact CG-CD2 4.39Å; L116-F181 HydrophobicContact CD1-CE1 3.83Å; L116-L182 HydrophobicContact CB-CD2 4.37Å; L116-L182 HydrophobicContact CD1-CD2 4.24Å
117	G	98.4	Very high	92.9	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.6	-176	-179	0	0	0	0	0	114.2	L28 V129 F130	L28-G117 CarbonylContact O-C 3.52Å; L28-G117 WeakPolarHBondContact O-CA 3.3Å; G117-V129 WeakPolarHBondContact O-CA 2.94Å; G117-F130 PolarHBondContact N-O 3.37Å; G117-F130 PolarHBondContact O-N 3.09Å; G117-F130 VanDerWaalsContact O-N 3.1Å
118	C	98.1	Very high	92.8	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	146.9	174.3	61	0	0	0	0	110.1	S27 L28 H128 V129 C186 V187	S27-C118 CarbonylContact C-O 3.53Å; S27-C118 VanDerWaalsContact CA-O 3.23Å; S27-C118 WeakPolarHBondContact CA-O 3.16Å; S27-C118 WeakPolarHBondContact CB-O 3.39Å; L28-C118 PolarHBondContact N-O 3.46Å; L28-C118 PolarHBondContact O-N 3.07Å; C118-H128 CarbonylContact C-O 3.52Å; C118-H128 WeakPolarHBondContact CA-O 3.41Å; C118-V129 HydrophobicContact CB-CG1 3.86Å; C118-C186 HydrophobicContact CB-CB 3.85Å; C118-C186 WeakPolarHBondContact CB-SG 3.35Å; C118-C186 PolarHBondContact N-SG 2.78Å; C118-C186 WeakPolarHBondContact SG-CB 3.36Å; C118-C186 PolarHBondContact SG-O 3.38Å; C118-C186 VanDerWaalsContact SG-O 3.38Å; C118-C186 CovalentContact SG-SG 2.04Å; C118-C186 PolarHBondContact SG-SG 3.48Å; C118-V187 HydrophobicContact CB-CG2 3.98Å; C118-V187 PolarHBondContact SG-N 2.04Å
119	E	96.1	Very high	92.9	Very high	47 Å²	47	55 Å²	55	22%	0.22	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	126.9	179.6	-55.3	-178.7	167.3	0	0	108.3	H29 P121 A127 H128 F130	H29-E119 IonicContact CD2-OE1 3.4Å; H29-E119 IonicContact CE1-OE1 2.74Å; H29-E119 PolarHBondContact CE1-OE1 3.1Å; H29-E119 IonicContact NE2-OE1 3.07Å; H29-E119 PolarHBondContact NE2-OE1 3.17Å; E119-P121 WeakPolarHBondContact O-CD 3.38Å; E119-A127 CarbonylContact O-C 3.56Å; E119-A127 WeakPolarHBondContact O-CA 3.46Å; E119-H128 HydrophobicContact CB-CB 4.36Å; E119-H128 PolarHBondContact N-O 3.35Å; E119-H128 PolarHBondContact O-N 3.18Å; E119-H128 IonicContact OE2-CD2 3.92Å; E119-F130 HydrophobicContact CG-CE1 4.27Å
120	L	93.4	Very high	92.9	Very high	19 Å²	19	50.9 Å²	50.9	10%	0.099	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	115.2	179.6	-73.8	72.8	0	0	0	108.8	Q26 A127 V187 V190 Q191	Q26-L120 HydrophobicContact CB-CB 3.91Å; Q26-L120 WeakPolarHBondContact O-CD1 3.45Å; Q26-L120 PolarHBondContact O-N 3.27Å; L120-A127 HydrophobicContact CG-CB 4.48Å; L120-V187 HydrophobicContact CD1-CB 4.49Å; L120-V187 HydrophobicContact CD1-CG1 4.18Å; L120-V187 HydrophobicContact CD1-CG2 4.3Å; L120-V187 HydrophobicContact CD2-CG1 4.07Å; L120-V187 HydrophobicContact CG-CG1 4.22Å; L120-V190 HydrophobicContact CD1-CB 3.93Å; L120-V190 HydrophobicContact CD1-CG1 3.89Å; L120-V190 HydrophobicContact CD1-CG2 4.27Å; L120-Q191 HydrophobicContact CD2-CG 3.53Å
121	P	87.8	Confident	93	Very high	40 Å²	40	51 Å²	51	26%	0.26	27%	0.274	S	S	.	.			trans	-64.6	147.4	173.6	-21.5	34.4	0	0	0	111.4	E119 E123 G124 S125	E119-P121 WeakPolarHBondContact O-CD 3.38Å; P121-E123 PolarHBondContact O-N 2.76Å; P121-G124 PolarHBondContact O-N 3.16Å; P121-S125 VanDerWaalsContact CB-OG 3.31Å; P121-S125 WeakPolarHBondContact CB-OG 3.48Å; P121-S125 WeakPolarHBondContact CG-OG 3.47Å
122	P	79.8	Confident	93	Very high	109 Å²	109	53.2 Å²	53.2	71%	0.708	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-29.3	179.2	23.4	-32.2	0	0	0	113.1	G124	P122-G124 PolarHBondContact O-N 3.38Å; P122-G124 VanDerWaalsContact O-N 3.16Å
123	E	76.2	Confident	93	Very high	170 Å²	170	53.3 Å²	53.3	79%	0.794	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	6.4	-175.9	-56.8	-60.7	162.4	0	0	114.3	P121 S125	P121-E123 PolarHBondContact O-N 2.76Å; E123-S125 PolarHBondContact O-N 3.14Å
124	G	71.2	Confident	92.9	Very high	72 Å²	72	49.4 Å²	49.4	74%	0.742	27%	0.271	S	S	*	.			trans	67.2	15.2	-179.9	0	0	0	0	0	114.5	P121 P122	P121-G124 PolarHBondContact O-N 3.16Å; P122-G124 PolarHBondContact O-N 3.38Å; P122-G124 VanDerWaalsContact O-N 3.16Å
125	S	84.8	Confident	92.9	Very high	71 Å²	71	51.2 Å²	51.2	50%	0.497	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-69.6	169.2	170.9	56.9	0	0	0	0	111.2	P121 E123 A127	P121-S125 VanDerWaalsContact CB-OG 3.31Å; P121-S125 WeakPolarHBondContact CB-OG 3.48Å; P121-S125 WeakPolarHBondContact CG-OG 3.47Å; E123-S125 PolarHBondContact O-N 3.14Å; S125-A127 PolarHBondContact O-N 3.44Å
126	R	89.9	Confident	92.8	Very high	165 Å²	165	53.7 Å²	53.7	62%	0.623	30%	0.297	S	S	*	.	P	Polyproline II helix	trans	-53.7	133.8	179.5	-175	178.9	-177.4	159.9	-0	110	H128 E183	R126-H128 PolarHBondContact O-N 3.04Å; R126-E183 IonicContact CZ-OE1 3.56Å; R126-E183 IonicContact CZ-OE2 2.65Å; R126-E183 IonicContact NE-OE1 2.75Å; R126-E183 IonicContact NE-OE2 3.27Å; R126-E183 IonicContact NH2-OE1 2.92Å; R126-E183 PolarHBondContact NH2-OE1 3.26Å; R126-E183 IonicContact NH2-OE2 3.52Å; R126-E183 PolarHBondContact NH2-OE2 3.49Å
127	A	93.4	Very high	92.5	Very high	21 Å²	21	56.9 Å²	56.9	17%	0.174	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-54.9	136.3	176.2	0	0	0	0	0	110.8	E119 L120 S125 V187	E119-A127 CarbonylContact O-C 3.56Å; E119-A127 WeakPolarHBondContact O-CA 3.46Å; L120-A127 HydrophobicContact CG-CB 4.48Å; S125-A127 PolarHBondContact O-N 3.44Å; A127-V187 HydrophobicContact CB-CG2 3.52Å
128	H	95.8	Very high	92.4	Very high	103 Å²	103	60.7 Å²	60.7	48%	0.477	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	128.9	169.1	177.7	61.4	0	0	0	108.4	C118 E119 R126	C118-H128 CarbonylContact C-O 3.52Å; C118-H128 WeakPolarHBondContact CA-O 3.41Å; E119-H128 HydrophobicContact CB-CB 4.36Å; E119-H128 PolarHBondContact N-O 3.35Å; E119-H128 PolarHBondContact O-N 3.18Å; E119-H128 IonicContact OE2-CD2 3.92Å; R126-H128 PolarHBondContact O-N 3.04Å
129	V	97.9	Very high	92.4	Very high	5 Å²	5	64.4 Å²	64.4	3%	0.03	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	148.2	179.5	-56.6	0	0	0	0	110.6	G117 C118 P145 L182 E183	G117-V129 WeakPolarHBondContact O-CA 2.94Å; C118-V129 HydrophobicContact CB-CG1 3.86Å; V129-P145 HydrophobicContact CG2-CB 3.49Å; V129-P145 VanDerWaalsContact CG2-CB 3.49Å; V129-P145 HydrophobicContact CG2-CG 3.73Å; V129-L182 HydrophobicContact CB-CB 3.94Å; V129-L182 HydrophobicContact CG1-CB 4.15Å; V129-L182 WeakPolarHBondContact CG1-O 3.4Å; V129-L182 HydrophobicContact CG2-CB 4.21Å; V129-E183 HydrophobicContact CG1-CG 4.04Å; V129-E183 HydrophobicContact CG2-CG 3.9Å
130	F	98.4	Very high	92.4	Very high	18 Å²	18	63.6 Å²	63.6	8%	0.079	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	153.2	-177.9	61.2	-90.4	0	0	0	111.6	H29 F115 L116 G117 E119	H29-F130 AromaticContact CD2-CE1 3.88Å; H29-F130 AromaticContact CD2-CZ 3.53Å; H29-F130 AromaticContact NE2-CE1 3.92Å; H29-F130 AromaticContact NE2-CZ 3.87Å; F115-F130 HydrophobicContact CD1-CD2 4.08Å; F115-F130 AromaticContact CD1-CE2 3.45Å; F115-F130 HydrophobicContact CD1-CE2 3.45Å; F115-F130 VanDerWaalsContact CD1-CE2 3.45Å; F115-F130 HydrophobicContact CD1-CZ 4.3Å; F115-F130 HydrophobicContact CD2-CE2 4.28Å; F115-F130 HydrophobicContact CE1-CD2 4.16Å; F115-F130 AromaticContact CE1-CE2 3.27Å; F115-F130 HydrophobicContact CE1-CE2 3.27Å; F115-F130 AromaticContact CE1-CZ 3.66Å; F115-F130 HydrophobicContact CE1-CZ 3.66Å; F115-F130 HydrophobicContact CE2-CE2 4.13Å; F115-F130 HydrophobicContact CE2-CZ 4.34Å; F115-F130 AromaticContact CG-CE2 3.96Å; F115-F130 HydrophobicContact CG-CE2 3.96Å; F115-F130 AromaticContact CZ-CE2 3.64Å; F115-F130 HydrophobicContact CZ-CE2 3.64Å; F115-F130 AromaticContact CZ-CZ 3.68Å; F115-F130 HydrophobicContact CZ-CZ 3.68Å; L116-F130 VanDerWaalsContact C-CE2 3.46Å; L116-F130 WeakPolarHBondContact CA-O 3.31Å; L116-F130 WeakPolarHBondContact CB-O 3.37Å; G117-F130 PolarHBondContact N-O 3.37Å; G117-F130 PolarHBondContact O-N 3.09Å; G117-F130 VanDerWaalsContact O-N 3.1Å; E119-F130 HydrophobicContact CG-CE1 4.27Å
131	F	98.8	Very high	92.6	Very high	11 Å²	11	62.8 Å²	62.8	5%	0.048	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	112	165.3	-166.3	-33.7	0	0	0	107.7	C114 F115 L116 V133 S142 F143 W150 L178 L182	C114-F131 HydrophobicContact CB-CE1 3.66Å; C114-F131 HydrophobicContact CB-CZ 4.11Å; F115-F131 CarbonylContact O-C 3.48Å; F115-F131 WeakPolarHBondContact O-CA 3.29Å; L116-F131 HydrophobicContact CB-CB 3.97Å; L116-F131 HydrophobicContact CB-CD1 4.13Å; L116-F131 HydrophobicContact CB-CD2 3.91Å; L116-F131 HydrophobicContact CB-CE2 4.45Å; L116-F131 HydrophobicContact CB-CG 3.73Å; L116-F131 HydrophobicContact CD1-CD2 3.84Å; L116-F131 HydrophobicContact CD1-CE2 3.8Å; L116-F131 HydrophobicContact CD1-CZ 4.42Å; L116-F131 HydrophobicContact CD2-CZ 4.43Å; L116-F131 HydrophobicContact CG-CD2 4.39Å; F131-V133 HydrophobicContact CD1-CG2 3.94Å; F131-V133 HydrophobicContact CE1-CG2 3.62Å; F131-S142 CarbonylContact O-C 3.57Å; F131-S142 VanDerWaalsContact O-CA 3.24Å; F131-S142 WeakPolarHBondContact O-CA 3.47Å; F131-S142 WeakPolarHBondContact O-CB 3.07Å; F131-F143 HydrophobicContact CB-CB 3.82Å; F131-F143 PolarHBondContact O-N 3.22Å; F131-W150 HydrophobicContact CB-CH2 4.41Å; F131-W150 AromaticContact CD1-CH2 3.77Å; F131-W150 HydrophobicContact CD1-CH2 3.77Å; F131-W150 HydrophobicContact CD1-CZ3 4.16Å; F131-W150 AromaticContact CD2-CH2 3.98Å; F131-W150 HydrophobicContact CD2-CH2 3.98Å; F131-W150 HydrophobicContact CD2-CZ2 4.48Å; F131-W150 AromaticContact CE1-CH2 3.97Å; F131-W150 HydrophobicContact CE1-CH2 3.97Å; F131-W150 HydrophobicContact CE2-CH2 4.16Å; F131-W150 AromaticContact CG-CH2 3.79Å; F131-W150 HydrophobicContact CG-CH2 3.79Å; F131-W150 HydrophobicContact CG-CZ3 4.39Å; F131-W150 HydrophobicContact CZ-CH2 4.16Å; F131-L178 HydrophobicContact CD2-CD1 3.83Å; F131-L178 HydrophobicContact CD2-CD2 3.98Å; F131-L178 HydrophobicContact CD2-CG 4.36Å; F131-L178 HydrophobicContact CE2-CD1 3.93Å; F131-L178 HydrophobicContact CE2-CD2 4.39Å; F131-L182 HydrophobicContact CB-CD1 4.26Å
132	E	98.7	Very high	93.1	Very high	93 Å²	93	61 Å²	61	44%	0.435	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	136.7	179.5	-60.2	177.3	176.9	0	0	110.3	C114 F115	C114-E132 WeakPolarHBondContact CA-O 3.12Å; F115-E132 PolarHBondContact N-O 3.41Å; F115-E132 PolarHBondContact O-N 2.93Å
133	V	98.6	Very high	94	Very high	19 Å²	19	56.1 Å²	56.1	12%	0.115	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	127.9	177.8	-177.6	0	0	0	0	108.8	I112 R113 F131 F140 V141 W150	I112-V133 HydrophobicContact CG2-CG1 3.73Å; R113-V133 CarbonylContact O-C 3.42Å; R113-V133 WeakPolarHBondContact O-CA 3.36Å; F131-V133 HydrophobicContact CD1-CG2 3.94Å; F131-V133 HydrophobicContact CE1-CG2 3.62Å; V133-F140 HydrophobicContact CG1-CD1 4.49Å; V133-F140 WeakPolarHBondContact O-CA 3.07Å; V133-F140 VanDerWaalsContact O-CB 3.29Å; V133-F140 WeakPolarHBondContact O-CB 3.42Å; V133-F140 PolarHBondContact O-N 2.97Å; V133-V141 WeakPolarHBondContact CA-O 3.19Å; V133-V141 HydrophobicContact CB-CG2 3.86Å; V133-V141 WeakPolarHBondContact CB-O 3.25Å; V133-V141 HydrophobicContact CG1-CG2 4.49Å; V133-V141 HydrophobicContact CG2-CG2 4.13Å; V133-V141 PolarHBondContact N-O 3.35Å; V133-V141 PolarHBondContact O-N 3.18Å; V133-W150 HydrophobicContact CG2-CH2 4.28Å; V133-W150 HydrophobicContact CG2-CZ3 3.88Å
134	A	98.3	Very high	95.1	Very high	11 Å²	11	51.9 Å²	51.9	9%	0.091	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	145.4	171.3	0	0	0	0	0	110.5	I112 R113 S138	I112-A134 CarbonylContact C-O 3.58Å; I112-A134 WeakPolarHBondContact CA-O 3.43Å; R113-A134 HydrophobicContact CB-CB 4.38Å; R113-A134 PolarHBondContact N-O 2.74Å; R113-A134 PolarHBondContact O-N 3.33Å; A134-S138 CarbonylContact C-O 3.6Å; A134-S138 WeakPolarHBondContact CA-O 3.23Å; A134-S138 VanDerWaalsContact CB-O 3.32Å; A134-S138 WeakPolarHBondContact CB-O 3.3Å
135	V	97.5	Very high	96.3	Very high	39 Å²	39	49 Å²	49	24%	0.236	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	126.9	175.8	-179.4	0	0	0	0	108.5	T111 I112 G137 S138 F140	T111-V135 CarbonylContact O-C 3.53Å; T111-V135 WeakPolarHBondContact O-CA 3.39Å; I112-V135 HydrophobicContact CG1-CG2 4.4Å; V135-G137 PolarHBondContact O-N 3.08Å; V135-G137 VanDerWaalsContact O-N 3.15Å; V135-S138 PolarHBondContact N-O 2.65Å; V135-S138 PolarHBondContact O-N 3.38Å; V135-F140 HydrophobicContact CB-CB 4.41Å; V135-F140 HydrophobicContact CB-CD2 4.41Å; V135-F140 HydrophobicContact CB-CG 4.4Å; V135-F140 HydrophobicContact CG2-CB 3.89Å; V135-F140 HydrophobicContact CG2-CD1 3.91Å; V135-F140 HydrophobicContact CG2-CD2 4.02Å; V135-F140 HydrophobicContact CG2-CG 3.66Å
136	N	96.4	Very high	96.9	Very high	102 Å²	102	52.4 Å²	52.4	55%	0.545	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	38.9	-175.9	-66.8	-14.2	0	0	0	112.9	L110 T111 S138	L110-N136 WeakPolarHBondContact CA-OD1 3.46Å; T111-N136 PolarHBondContact N-OD1 3.35Å; T111-N136 PolarHBondContact O-N 2.83Å; N136-S138 VanDerWaalsContact C-N 3.3Å; N136-S138 PolarHBondContact O-N 3.09Å
137	G	94.3	Very high	97.2	Very high	79 Å²	79	47.9 Å²	47.9	81%	0.814	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	-2.9	178.7	0	0	0	0	0	115.6	V135	V135-G137 PolarHBondContact O-N 3.08Å; V135-G137 VanDerWaalsContact O-N 3.15Å
138	S	95.8	Very high	97.5	Very high	81 Å²	81	46.9 Å²	46.9	57%	0.566	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	137.7	176.9	-59.9	0	0	0	0	111.2	A134 V135 N136 F140	A134-S138 CarbonylContact C-O 3.6Å; A134-S138 WeakPolarHBondContact CA-O 3.23Å; A134-S138 VanDerWaalsContact CB-O 3.32Å; A134-S138 WeakPolarHBondContact CB-O 3.3Å; V135-S138 PolarHBondContact N-O 2.65Å; V135-S138 PolarHBondContact O-N 3.38Å; N136-S138 VanDerWaalsContact C-N 3.3Å; N136-S138 PolarHBondContact O-N 3.09Å; S138-F140 PolarHBondContact O-N 3.05Å
139	S	96.6	Very high	97.6	Very high	77 Å²	77	44.7 Å²	44.7	54%	0.538	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	135.8	174.2	-54.7	0	0	0	0	110.9
140	F	96.7	Very high	97.6	Very high	30 Å²	30	45.1 Å²	45.1	13%	0.132	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	-65.7	-169.9	-173.5	-108.1	0	0	0	111.4	V133 V135 S138 D153 V160 V161 I164	V133-F140 HydrophobicContact CG1-CD1 4.49Å; V133-F140 WeakPolarHBondContact O-CA 3.07Å; V133-F140 VanDerWaalsContact O-CB 3.29Å; V133-F140 WeakPolarHBondContact O-CB 3.42Å; V133-F140 PolarHBondContact O-N 2.97Å; V135-F140 HydrophobicContact CB-CB 4.41Å; V135-F140 HydrophobicContact CB-CD2 4.41Å; V135-F140 HydrophobicContact CB-CG 4.4Å; V135-F140 HydrophobicContact CG2-CB 3.89Å; V135-F140 HydrophobicContact CG2-CD1 3.91Å; V135-F140 HydrophobicContact CG2-CD2 4.02Å; V135-F140 HydrophobicContact CG2-CG 3.66Å; S138-F140 PolarHBondContact O-N 3.05Å; F140-D153 PolarHBondContact O-N 2.96Å; F140-V160 HydrophobicContact CZ-CG1 4.26Å; F140-V161 HydrophobicContact CD2-CG2 4.09Å; F140-V161 HydrophobicContact CE2-CB 4.42Å; F140-V161 HydrophobicContact CE2-CG2 3.31Å; F140-V161 HydrophobicContact CZ-CB 4.34Å; F140-V161 HydrophobicContact CZ-CG2 3.66Å; F140-I164 HydrophobicContact CE1-CB 4.4Å; F140-I164 HydrophobicContact CE1-CD1 3.5Å; F140-I164 VanDerWaalsContact CE1-CD1 3.5Å; F140-I164 HydrophobicContact CE1-CG2 4.15Å; F140-I164 HydrophobicContact CZ-CD1 3.71Å
141	V	98.1	Very high	97.6	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.012	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	152.5	175.1	-61.1	0	0	0	0	110.7	V133 W150 Q151 L165 L168	V133-V141 WeakPolarHBondContact CA-O 3.19Å; V133-V141 HydrophobicContact CB-CG2 3.86Å; V133-V141 WeakPolarHBondContact CB-O 3.25Å; V133-V141 HydrophobicContact CG1-CG2 4.49Å; V133-V141 HydrophobicContact CG2-CG2 4.13Å; V133-V141 PolarHBondContact N-O 3.35Å; V133-V141 PolarHBondContact O-N 3.18Å; V141-W150 HydrophobicContact CB-CE3 4.33Å; V141-W150 HydrophobicContact CG2-CE3 3.83Å; V141-W150 HydrophobicContact CG2-CZ3 4.04Å; V141-Q151 CarbonylContact C-O 3.43Å; V141-Q151 WeakPolarHBondContact CA-O 3.27Å; V141-Q151 VanDerWaalsContact CB-O 3.26Å; V141-Q151 WeakPolarHBondContact CB-O 3.48Å; V141-L165 HydrophobicContact CB-CD2 4.28Å; V141-L165 HydrophobicContact CG1-CD2 3.72Å; V141-L165 HydrophobicContact CG1-CG 4.23Å; V141-L168 HydrophobicContact CG2-CD1 4.2Å
142	S	98.4	Very high	97.5	Very high	4 Å²	4	50.1 Å²	50.1	3%	0.028	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	156.6	171.2	76.9	0	0	0	0	112	F131 R144 W150 Q151 D153	F131-S142 CarbonylContact O-C 3.57Å; F131-S142 VanDerWaalsContact O-CA 3.24Å; F131-S142 WeakPolarHBondContact O-CA 3.47Å; F131-S142 WeakPolarHBondContact O-CB 3.07Å; S142-R144 PolarHBondContact OG-NH1 2.79Å; S142-R144 PolarHBondContact OG-NH2 2.92Å; S142-W150 CarbonylContact O-C 3.57Å; S142-W150 WeakPolarHBondContact O-CA 3.48Å; S142-Q151 PolarHBondContact N-O 2.87Å; S142-Q151 PolarHBondContact O-N 3.28Å; S142-D153 WeakPolarHBondContact CB-OD2 3.48Å; S142-D153 PolarHBondContact N-OD2 2.99Å; S142-D153 VanDerWaalsContact N-OD2 3.13Å; S142-D153 PolarHBondContact OG-OD1 3.26Å; S142-D153 PolarHBondContact OG-OD2 2.96Å
143	F	98.7	Very high	97.4	Very high	5 Å²	5	48.3 Å²	48.3	2%	0.022	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	139.8	174.7	-171.2	-112.8	0	0	0	111.5	F131 P145 A148 W150 R175 L178 R179 L182	F131-F143 HydrophobicContact CB-CB 3.82Å; F131-F143 PolarHBondContact O-N 3.22Å; F143-P145 HydrophobicContact CD1-CB 4.46Å; F143-P145 HydrophobicContact CE1-CB 4.21Å; F143-A148 HydrophobicContact CE2-CB 4.4Å; F143-A148 HydrophobicContact CZ-CB 3.96Å; F143-W150 HydrophobicContact CB-CD2 4.28Å; F143-W150 HydrophobicContact CB-CE3 4.22Å; F143-W150 HydrophobicContact CB-CH2 4.43Å; F143-W150 HydrophobicContact CB-CZ2 4.5Å; F143-W150 HydrophobicContact CB-CZ3 4.28Å; F143-W150 AromaticContact CD2-CD1 3.84Å; F143-W150 HydrophobicContact CD2-CD2 4.07Å; F143-W150 AromaticContact CD2-CE2 3.79Å; F143-W150 HydrophobicContact CD2-CG 4.19Å; F143-W150 HydrophobicContact CD2-CZ2 4.39Å; F143-W150 AromaticContact CD2-NE1 3.59Å; F143-R175 WeakPolarHBondContact CZ-O 3.04Å; F143-L178 HydrophobicContact CD2-CD2 3.96Å; F143-L178 HydrophobicContact CE2-CD2 4.14Å; F143-L178 HydrophobicContact CG-CD2 4.19Å; F143-R179 HydrophobicContact CE1-CB 4.09Å; F143-R179 HydrophobicContact CE1-CG 4.49Å; F143-R179 HydrophobicContact CZ-CB 3.98Å; F143-L182 HydrophobicContact CD1-CD1 4.03Å; F143-L182 HydrophobicContact CE1-CD1 4.34Å
144	R	98.4	Very high	97	Very high	82 Å²	82	49.5 Å²	49.5	31%	0.309	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	100.9	174.6	-56.5	-57.8	178.9	-158.6	-11.8	109.3	S142 E146 T147 A148 L149 Q151 D153	S142-R144 PolarHBondContact OG-NH1 2.79Å; S142-R144 PolarHBondContact OG-NH2 2.92Å; R144-E146 VanDerWaalsContact C-N 3.27Å; R144-E146 PolarHBondContact O-N 3.22Å; R144-T147 PolarHBondContact O-N 3.22Å; R144-A148 WeakPolarHBondContact O-CA 3.33Å; R144-A148 PolarHBondContact O-N 2.85Å; R144-L149 WeakPolarHBondContact CB-O 3.42Å; R144-L149 PolarHBondContact N-O 3.32Å; R144-L149 PolarHBondContact O-N 2.89Å; R144-Q151 HydrophobicContact CG-CB 4.4Å; R144-Q151 VanDerWaalsContact CG-CD 3.42Å; R144-Q151 HydrophobicContact CG-CG 3.81Å; R144-D153 IonicContact NH2-OD1 3.43Å; R144-D153 PolarHBondContact NH2-OD1 2.96Å; R144-D153 VanDerWaalsContact NH2-OD1 3.07Å
145	P	96.9	Very high	96.3	Very high	12 Å²	12	58 Å²	58	8%	0.078	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-28.8	-170.7	24.5	-32.9	0	0	0	113.6	V129 F143 T147 A148 R179	V129-P145 HydrophobicContact CG2-CB 3.49Å; V129-P145 VanDerWaalsContact CG2-CB 3.49Å; V129-P145 HydrophobicContact CG2-CG 3.73Å; F143-P145 HydrophobicContact CD1-CB 4.46Å; F143-P145 HydrophobicContact CE1-CB 4.21Å; P145-T147 PolarHBondContact O-N 2.88Å; P145-A148 PolarHBondContact O-N 3.21Å; P145-R179 WeakPolarHBondContact O-CD 3.41Å; P145-R179 PolarHBondContact O-NH1 3.28Å
146	E	96.9	Very high	95.5	Very high	141 Å²	141	61.2 Å²	61.2	66%	0.659	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-36.8	-178.1	-55.8	73.1	-156.9	0	0	111.7	R144	R144-E146 VanDerWaalsContact C-N 3.27Å; R144-E146 PolarHBondContact O-N 3.22Å
147	T	97.5	Very high	94.8	Very high	70 Å²	70	62.3 Å²	62.3	43%	0.429	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-6.1	-178.1	56.1	0	0	0	0	113.4	R144 P145 L149	R144-T147 PolarHBondContact O-N 3.22Å; P145-T147 PolarHBondContact O-N 2.88Å; T147-L149 VanDerWaalsContact C-N 3.29Å; T147-L149 PolarHBondContact O-N 2.82Å
148	A	98.3	Very high	94.6	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	49.9	-168.5	0	0	0	0	0	111.8	F143 R144 P145 R175 Y176	F143-A148 HydrophobicContact CE2-CB 4.4Å; F143-A148 HydrophobicContact CZ-CB 3.96Å; R144-A148 WeakPolarHBondContact O-CA 3.33Å; R144-A148 PolarHBondContact O-N 2.85Å; P145-A148 PolarHBondContact O-N 3.21Å; A148-R175 HydrophobicContact CB-CB 4.32Å; A148-R175 WeakPolarHBondContact O-CB 3.41Å; A148-R175 WeakPolarHBondContact O-CG 3.34Å; A148-R175 PolarHBondContact O-NE 3.36Å; A148-Y176 HydrophobicContact CB-CD1 3.95Å; A148-Y176 HydrophobicContact CB-CE1 3.96Å
149	L	98.6	Very high	94.5	Very high	58 Å²	58	65 Å²	65	30%	0.304	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	148.7	179.6	-68.1	174	0	0	0	111	R144 T147 N169	R144-L149 WeakPolarHBondContact CB-O 3.42Å; R144-L149 PolarHBondContact N-O 3.32Å; R144-L149 PolarHBondContact O-N 2.89Å; T147-L149 VanDerWaalsContact C-N 3.29Å; T147-L149 PolarHBondContact O-N 2.82Å; L149-N169 WeakPolarHBondContact CA-OD1 3.4Å; L149-N169 HydrophobicContact CD2-CB 4.1Å; L149-N169 WeakPolarHBondContact CD2-OD1 3.37Å
150	W	98.6	Very high	94.5	Very high	14 Å²	14	62.6 Å²	62.6	5%	0.053	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	144.2	170.5	-66.1	81.4	0	0	0	110.8	F131 V133 V141 S142 F143 L165 L168 N169 T174 L178	F131-W150 HydrophobicContact CB-CH2 4.41Å; F131-W150 AromaticContact CD1-CH2 3.77Å; F131-W150 HydrophobicContact CD1-CH2 3.77Å; F131-W150 HydrophobicContact CD1-CZ3 4.16Å; F131-W150 AromaticContact CD2-CH2 3.98Å; F131-W150 HydrophobicContact CD2-CH2 3.98Å; F131-W150 HydrophobicContact CD2-CZ2 4.48Å; F131-W150 AromaticContact CE1-CH2 3.97Å; F131-W150 HydrophobicContact CE1-CH2 3.97Å; F131-W150 HydrophobicContact CE2-CH2 4.16Å; F131-W150 AromaticContact CG-CH2 3.79Å; F131-W150 HydrophobicContact CG-CH2 3.79Å; F131-W150 HydrophobicContact CG-CZ3 4.39Å; F131-W150 HydrophobicContact CZ-CH2 4.16Å; V133-W150 HydrophobicContact CG2-CH2 4.28Å; V133-W150 HydrophobicContact CG2-CZ3 3.88Å; V141-W150 HydrophobicContact CB-CE3 4.33Å; V141-W150 HydrophobicContact CG2-CE3 3.83Å; V141-W150 HydrophobicContact CG2-CZ3 4.04Å; S142-W150 CarbonylContact O-C 3.57Å; S142-W150 WeakPolarHBondContact O-CA 3.48Å; F143-W150 HydrophobicContact CB-CD2 4.28Å; F143-W150 HydrophobicContact CB-CE3 4.22Å; F143-W150 HydrophobicContact CB-CH2 4.43Å; F143-W150 HydrophobicContact CB-CZ2 4.5Å; F143-W150 HydrophobicContact CB-CZ3 4.28Å; F143-W150 AromaticContact CD2-CD1 3.84Å; F143-W150 HydrophobicContact CD2-CD2 4.07Å; F143-W150 AromaticContact CD2-CE2 3.79Å; F143-W150 HydrophobicContact CD2-CG 4.19Å; F143-W150 HydrophobicContact CD2-CZ2 4.39Å; F143-W150 AromaticContact CD2-NE1 3.59Å; W150-L165 HydrophobicContact CB-CD2 3.76Å; W150-L168 HydrophobicContact CB-CB 4.11Å; W150-L168 HydrophobicContact CB-CD1 4.26Å; W150-L168 VanDerWaalsContact CD1-CB 3.49Å; W150-L168 HydrophobicContact CD2-CB 4.22Å; W150-L168 HydrophobicContact CD2-CD1 3.66Å; W150-L168 HydrophobicContact CD2-CG 4.4Å; W150-L168 HydrophobicContact CE3-CD1 3.9Å; W150-L168 HydrophobicContact CG-CB 3.68Å; W150-L168 HydrophobicContact CG-CD1 3.85Å; W150-L168 HydrophobicContact CG-CG 4.34Å; W150-L168 HydrophobicContact CZ2-CD1 4.47Å; W150-L168 HydrophobicContact CZ2-CD2 4.35Å; W150-L168 HydrophobicContact CZ3-CD1 4.44Å; W150-N169 PolarHBondContact N-OD1 3.37Å; W150-N169 PolarHBondContact O-ND2 3.32Å; W150-T174 PolarHBondContact NE1-O 3.08Å; W150-L178 HydrophobicContact CH2-CD2 4.15Å; W150-L178 HydrophobicContact CZ2-CD2 3.29Å
151	Q	97.9	Very high	94.4	Very high	89 Å²	89	61.6 Å²	61.6	42%	0.416	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	153.9	177.3	-67.4	-178.2	-3.2	0	0	110.6	V141 S142 R144	V141-Q151 CarbonylContact C-O 3.43Å; V141-Q151 WeakPolarHBondContact CA-O 3.27Å; V141-Q151 VanDerWaalsContact CB-O 3.26Å; V141-Q151 WeakPolarHBondContact CB-O 3.48Å; S142-Q151 PolarHBondContact N-O 2.87Å; S142-Q151 PolarHBondContact O-N 3.28Å; R144-Q151 HydrophobicContact CG-CB 4.4Å; R144-Q151 VanDerWaalsContact CG-CD 3.42Å; R144-Q151 HydrophobicContact CG-CG 3.81Å
152	A	97.5	Very high	94.4	Very high	44 Å²	44	65.9 Å²	65.9	36%	0.364	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	134.8	172.3	0	0	0	0	0	110.2	T154 V161 L165	A152-T154 HydrophobicContact CB-CG2 4.47Å; A152-V161 HydrophobicContact CB-CG1 3.71Å; A152-L165 HydrophobicContact CB-CD1 3.98Å
153	D	95.4	Very high	94.3	Very high	55 Å²	55	66.3 Å²	66.3	29%	0.294	35%	0.354	S	S	.	.			trans	-102.4	-14.3	168.9	-60.1	-45.2	0	0	0	111.9	F140 S142 R144	F140-D153 PolarHBondContact O-N 2.96Å; S142-D153 WeakPolarHBondContact CB-OD2 3.48Å; S142-D153 PolarHBondContact N-OD2 2.99Å; S142-D153 VanDerWaalsContact N-OD2 3.13Å; S142-D153 PolarHBondContact OG-OD1 3.26Å; S142-D153 PolarHBondContact OG-OD2 2.96Å; R144-D153 IonicContact NH2-OD1 3.43Å; R144-D153 PolarHBondContact NH2-OD1 2.96Å; R144-D153 VanDerWaalsContact NH2-OD1 3.07Å
154	T	91.4	Very high	94.2	Very high	45 Å²	45	67.1 Å²	67.1	28%	0.276	36%	0.359	S	S	.	.			trans	-75.1	138.3	172.3	-179.4	0	0	0	0	111.2	A152 V156 V161	A152-T154 HydrophobicContact CB-CG2 4.47Å; T154-V156 VanDerWaalsContact C-N 3.33Å; T154-V156 PolarHBondContact OG1-N 3.23Å; T154-V161 HydrophobicContact CG2-CG1 4.23Å; T154-V161 HydrophobicContact CG2-CG2 3.67Å
155	Q	81.8	Confident	94.2	Very high	190 Å²	190	64.8 Å²	64.8	89%	0.888	35%	0.352	S	S	*	.	S	Bend	trans	-82.6	-12.5	175.9	-60.9	-170.9	15	0	0	112.9	P157	Q155-P157 WeakPolarHBondContact O-CD 3.46Å
156	V	80.9	Confident	94.2	Very high	105 Å²	105	70 Å²	70	64%	0.636	38%	0.375	S	S	*	.	S	Bend	trans	-94.2	113	-177.5	-177	0	0	0	0	109.5	T154 S158	T154-V156 VanDerWaalsContact C-N 3.33Å; T154-V156 PolarHBondContact OG1-N 3.23Å; V156-S158 PolarHBondContact O-N 3.17Å
157	P	82.1	Confident	94.2	Very high	126 Å²	126	64.7 Å²	64.7	82%	0.818	35%	0.35	S	S	*	.			trans	-61.2	133.7	175.9	-21.2	33.7	0	0	0	110.6	Q155	Q155-P157 WeakPolarHBondContact O-CD 3.46Å
158	S	91.1	Very high	94.3	Very high	43 Å²	43	62 Å²	62	30%	0.301	33%	0.333	S	S	.	.			trans	-145.1	137.2	-177.4	155.8	0	0	0	0	109.8	V156 V160 V161 T162	V156-S158 PolarHBondContact O-N 3.17Å; S158-V160 PolarHBondContact O-N 2.88Å; S158-V160 WeakPolarHBondContact OG-CB 3.31Å; S158-V160 PolarHBondContact OG-N 3.42Å; S158-V160 VanDerWaalsContact OG-N 3.1Å; S158-V161 PolarHBondContact O-N 2.9Å; S158-V161 VanDerWaalsContact O-N 3.07Å; S158-V161 PolarHBondContact OG-N 3.42Å; S158-T162 PolarHBondContact O-N 2.85Å; S158-T162 PolarHBondContact O-OG1 3.27Å
159	K	93.8	Very high	94.3	Very high	173 Å²	173	64 Å²	64	75%	0.752	34%	0.344	S	S	*	.	H	α-helix	trans	-58	-28.7	174.4	-66.5	-176.6	179.5	179.2	0	112	F163	K159-F163 VanDerWaalsContact O-CB 3.3Å; K159-F163 WeakPolarHBondContact O-CB 3.44Å; K159-F163 PolarHBondContact O-N 2.92Å; K159-F163 VanDerWaalsContact O-N 3.08Å
160	V	95.1	Very high	94.3	Very high	26 Å²	26	64 Å²	64	16%	0.158	35%	0.353	C	S	.	.	H	α-helix	trans	-68.3	-48.6	175.2	177.7	0	0	0	0	110.3	V100 R104 L106 F140 S158 T162 F163 I164	V100-V160 HydrophobicContact CG1-CG1 3.84Å; R104-V160 HydrophobicContact CB-CG2 3.97Å; L106-V160 HydrophobicContact CD2-CG1 3.56Å; L106-V160 HydrophobicContact CD2-CG2 4.2Å; F140-V160 HydrophobicContact CZ-CG1 4.26Å; S158-V160 PolarHBondContact O-N 2.88Å; S158-V160 WeakPolarHBondContact OG-CB 3.31Å; S158-V160 PolarHBondContact OG-N 3.42Å; S158-V160 VanDerWaalsContact OG-N 3.1Å; V160-T162 PolarHBondContact O-N 3.35Å; V160-F163 PolarHBondContact O-N 3.07Å; V160-I164 HydrophobicContact CG1-CD1 4.05Å; V160-I164 WeakPolarHBondContact O-CB 3.31Å; V160-I164 PolarHBondContact O-N 3.47Å
161	V	95.9	Very high	94.2	Very high	10 Å²	10	69.5 Å²	69.5	6%	0.061	37%	0.374	C	S	.	.	H	α-helix	trans	-60.8	-48	178.8	177.2	0	0	0	0	110.2	F140 A152 T154 S158 F163 I164 L165	F140-V161 HydrophobicContact CD2-CG2 4.09Å; F140-V161 HydrophobicContact CE2-CB 4.42Å; F140-V161 HydrophobicContact CE2-CG2 3.31Å; F140-V161 HydrophobicContact CZ-CB 4.34Å; F140-V161 HydrophobicContact CZ-CG2 3.66Å; A152-V161 HydrophobicContact CB-CG1 3.71Å; T154-V161 HydrophobicContact CG2-CG1 4.23Å; T154-V161 HydrophobicContact CG2-CG2 3.67Å; S158-V161 PolarHBondContact O-N 2.9Å; S158-V161 VanDerWaalsContact O-N 3.07Å; S158-V161 PolarHBondContact OG-N 3.42Å; V161-F163 VanDerWaalsContact C-N 3.33Å; V161-F163 PolarHBondContact O-N 2.88Å; V161-I164 PolarHBondContact O-N 2.75Å; V161-L165 HydrophobicContact CG1-CD1 4.07Å; V161-L165 HydrophobicContact CG1-CG 4.38Å; V161-L165 WeakPolarHBondContact O-CG 3.38Å; V161-L165 PolarHBondContact O-N 3.37Å
162	T	96.6	Very high	94.1	Very high	92 Å²	92	70.1 Å²	70.1	56%	0.564	38%	0.381	S	S	*	.	H	α-helix	trans	-58.9	-44.8	178.4	-54.6	0	0	0	0	111.8	S158 V160 L165 Q166	S158-T162 PolarHBondContact O-N 2.85Å; S158-T162 PolarHBondContact O-OG1 3.27Å; V160-T162 PolarHBondContact O-N 3.35Å; T162-L165 PolarHBondContact O-N 2.86Å; T162-Q166 WeakPolarHBondContact O-CB 3.36Å; T162-Q166 PolarHBondContact O-N 3.41Å
163	F	97.3	Very high	94	Very high	12 Å²	12	73.3 Å²	73.3	5%	0.053	38%	0.383	C	S	.	.	H	α-helix	trans	-66	-43.2	178.5	-178.3	-100	0	0	0	112.1	L99 V100 E103 R104 K159 V160 V161 Q166 Q167	L99-F163 HydrophobicContact CG-CE1 4.39Å; L99-F163 HydrophobicContact CG-CZ 4.42Å; V100-F163 HydrophobicContact CB-CD1 4.46Å; V100-F163 HydrophobicContact CG1-CD1 4.38Å; V100-F163 HydrophobicContact CG2-CD1 4.03Å; V100-F163 HydrophobicContact CG2-CE1 4.05Å; E103-F163 HydrophobicContact CB-CD1 4.31Å; E103-F163 HydrophobicContact CB-CE1 3.77Å; E103-F163 HydrophobicContact CB-CE2 4.06Å; E103-F163 HydrophobicContact CB-CZ 3.64Å; E103-F163 HydrophobicContact CG-CE1 4.06Å; E103-F163 HydrophobicContact CG-CE2 4.07Å; E103-F163 HydrophobicContact CG-CZ 3.53Å; R104-F163 HydrophobicContact CG-CB 3.73Å; R104-F163 HydrophobicContact CG-CD1 4.12Å; R104-F163 HydrophobicContact CG-CD2 4.45Å; R104-F163 HydrophobicContact CG-CG 3.84Å; K159-F163 VanDerWaalsContact O-CB 3.3Å; K159-F163 WeakPolarHBondContact O-CB 3.44Å; K159-F163 PolarHBondContact O-N 2.92Å; K159-F163 VanDerWaalsContact O-N 3.08Å; V160-F163 PolarHBondContact O-N 3.07Å; V161-F163 VanDerWaalsContact C-N 3.33Å; V161-F163 PolarHBondContact O-N 2.88Å; F163-Q166 WeakPolarHBondContact O-CB 3.43Å; F163-Q166 PolarHBondContact O-N 3.24Å; F163-Q167 HydrophobicContact CD1-CG 4.16Å; F163-Q167 HydrophobicContact CE1-CG 3.67Å; F163-Q167 HydrophobicContact CE2-CG 4.3Å; F163-Q167 HydrophobicContact CZ-CG 3.74Å; F163-Q167 WeakPolarHBondContact O-CG 3.34Å; F163-Q167 PolarHBondContact O-N 3.41Å
164	I	96.6	Very high	94.1	Very high	23 Å²	23	72.3 Å²	72.3	12%	0.118	38%	0.379	C	S	.	.	H	α-helix	trans	-60.8	-47.4	176.5	-78.9	176.7	0	0	0	111	V100 F140 V160 V161 Q166 Q167 L168	V100-I164 HydrophobicContact CB-CG1 4.38Å; V100-I164 HydrophobicContact CG1-CD1 3.95Å; V100-I164 HydrophobicContact CG1-CG1 3.96Å; V100-I164 HydrophobicContact CG2-CD1 3.98Å; V100-I164 HydrophobicContact CG2-CG1 3.47Å; V100-I164 VanDerWaalsContact CG2-CG1 3.47Å; F140-I164 HydrophobicContact CE1-CB 4.4Å; F140-I164 HydrophobicContact CE1-CD1 3.5Å; F140-I164 VanDerWaalsContact CE1-CD1 3.5Å; F140-I164 HydrophobicContact CE1-CG2 4.15Å; F140-I164 HydrophobicContact CZ-CD1 3.71Å; V160-I164 HydrophobicContact CG1-CD1 4.05Å; V160-I164 WeakPolarHBondContact O-CB 3.31Å; V160-I164 PolarHBondContact O-N 3.47Å; V161-I164 PolarHBondContact O-N 2.75Å; I164-Q166 VanDerWaalsContact C-N 3.26Å; I164-Q166 PolarHBondContact O-N 2.96Å; I164-Q167 PolarHBondContact O-N 3.49Å; I164-Q167 VanDerWaalsContact O-N 3.14Å; I164-L168 HydrophobicContact CG2-CD1 3.45Å; I164-L168 VanDerWaalsContact CG2-CD1 3.45Å; I164-L168 HydrophobicContact CG2-CG 4Å; I164-L168 WeakPolarHBondContact O-CB 3.4Å; I164-L168 WeakPolarHBondContact O-CG 3.26Å; I164-L168 PolarHBondContact O-N 3.46Å
165	L	97.8	Very high	94.4	Very high	33 Å²	33	72.4 Å²	72.4	17%	0.173	37%	0.374	C	S	.	.	H	α-helix	trans	-61.3	-37.7	177.7	-71.1	178.6	0	0	0	111.9	V141 W150 A152 V161 T162 N169	V141-L165 HydrophobicContact CB-CD2 4.28Å; V141-L165 HydrophobicContact CG1-CD2 3.72Å; V141-L165 HydrophobicContact CG1-CG 4.23Å; W150-L165 HydrophobicContact CB-CD2 3.76Å; A152-L165 HydrophobicContact CB-CD1 3.98Å; V161-L165 HydrophobicContact CG1-CD1 4.07Å; V161-L165 HydrophobicContact CG1-CG 4.38Å; V161-L165 WeakPolarHBondContact O-CG 3.38Å; V161-L165 PolarHBondContact O-N 3.37Å; T162-L165 PolarHBondContact O-N 2.86Å; L165-N169 WeakPolarHBondContact O-CB 3.21Å; L165-N169 PolarHBondContact O-N 2.81Å; L165-N169 PolarHBondContact O-ND2 2.89Å; L165-N169 VanDerWaalsContact O-ND2 3.14Å
166	Q	97.7	Very high	95.2	Very high	120 Å²	120	68.2 Å²	68.2	56%	0.561	35%	0.351	S	S	*	.	H	α-helix	trans	-61.1	-47.3	173.6	-176.2	-177	-3.5	0	0	111.3	T162 F163 I164 A170	T162-Q166 WeakPolarHBondContact O-CB 3.36Å; T162-Q166 PolarHBondContact O-N 3.41Å; F163-Q166 WeakPolarHBondContact O-CB 3.43Å; F163-Q166 PolarHBondContact O-N 3.24Å; I164-Q166 VanDerWaalsContact C-N 3.26Å; I164-Q166 PolarHBondContact O-N 2.96Å; Q166-A170 VanDerWaalsContact O-CB 3.24Å; Q166-A170 WeakPolarHBondContact O-CB 3.43Å; Q166-A170 PolarHBondContact O-N 3.49Å; Q166-A170 VanDerWaalsContact O-N 3.14Å
167	Q	97.5	Very high	96	Very high	30 Å²	30	67 Å²	67	14%	0.14	34%	0.338	C	S	.	.	H	α-helix	trans	-64.6	-49.2	178.7	-65.7	-57.3	-48.3	0	0	111.7	L96 F163 I164 N169 A170 Y171	L96-Q167 HydrophobicContact CD1-CB 4.09Å; L96-Q167 HydrophobicContact CD1-CG 4.48Å; F163-Q167 HydrophobicContact CD1-CG 4.16Å; F163-Q167 HydrophobicContact CE1-CG 3.67Å; F163-Q167 HydrophobicContact CE2-CG 4.3Å; F163-Q167 HydrophobicContact CZ-CG 3.74Å; F163-Q167 WeakPolarHBondContact O-CG 3.34Å; F163-Q167 PolarHBondContact O-N 3.41Å; I164-Q167 PolarHBondContact O-N 3.49Å; I164-Q167 VanDerWaalsContact O-N 3.14Å; Q167-N169 VanDerWaalsContact C-N 3.27Å; Q167-N169 PolarHBondContact O-N 2.96Å; Q167-A170 PolarHBondContact O-N 3.46Å; Q167-Y171 VanDerWaalsContact O-CD2 3.25Å; Q167-Y171 WeakPolarHBondContact O-CD2 3.18Å
168	L	97.9	Very high	96.7	Very high	13 Å²	13	62.1 Å²	62.1	7%	0.068	31%	0.306	C	S	.	.	H	α-helix	trans	-65.1	-29.7	-178.3	-69.1	176.5	0	0	0	112.8	L96 V141 W150 I164 T174 R175	L96-L168 HydrophobicContact CD2-CD2 3.74Å; V141-L168 HydrophobicContact CG2-CD1 4.2Å; W150-L168 HydrophobicContact CB-CB 4.11Å; W150-L168 HydrophobicContact CB-CD1 4.26Å; W150-L168 VanDerWaalsContact CD1-CB 3.49Å; W150-L168 HydrophobicContact CD2-CB 4.22Å; W150-L168 HydrophobicContact CD2-CD1 3.66Å; W150-L168 HydrophobicContact CD2-CG 4.4Å; W150-L168 HydrophobicContact CE3-CD1 3.9Å; W150-L168 HydrophobicContact CG-CB 3.68Å; W150-L168 HydrophobicContact CG-CD1 3.85Å; W150-L168 HydrophobicContact CG-CG 4.34Å; W150-L168 HydrophobicContact CZ2-CD1 4.47Å; W150-L168 HydrophobicContact CZ2-CD2 4.35Å; W150-L168 HydrophobicContact CZ3-CD1 4.44Å; I164-L168 HydrophobicContact CG2-CD1 3.45Å; I164-L168 VanDerWaalsContact CG2-CD1 3.45Å; I164-L168 HydrophobicContact CG2-CG 4Å; I164-L168 WeakPolarHBondContact O-CB 3.4Å; I164-L168 WeakPolarHBondContact O-CG 3.26Å; I164-L168 PolarHBondContact O-N 3.46Å; L168-T174 HydrophobicContact CD2-CG2 4.03Å; L168-T174 VanDerWaalsContact O-CB 3.28Å; L168-T174 WeakPolarHBondContact O-CB 3.39Å; L168-T174 PolarHBondContact O-OG1 3.47Å; L168-R175 WeakPolarHBondContact O-CG 3.5Å
169	N	98.5	Very high	97.1	Very high	42 Å²	42	63.1 Å²	63.1	23%	0.225	30%	0.303	C	S	.	.	H	α-helix	trans	-93.1	-1.4	178.2	-67.8	-36.7	0	0	0	114.3	L149 W150 L165 Q167 R175	L149-N169 WeakPolarHBondContact CA-OD1 3.4Å; L149-N169 HydrophobicContact CD2-CB 4.1Å; L149-N169 WeakPolarHBondContact CD2-OD1 3.37Å; W150-N169 PolarHBondContact N-OD1 3.37Å; W150-N169 PolarHBondContact O-ND2 3.32Å; L165-N169 WeakPolarHBondContact O-CB 3.21Å; L165-N169 PolarHBondContact O-N 2.81Å; L165-N169 PolarHBondContact O-ND2 2.89Å; L165-N169 VanDerWaalsContact O-ND2 3.14Å; Q167-N169 VanDerWaalsContact C-N 3.27Å; Q167-N169 PolarHBondContact O-N 2.96Å; N169-R175 VanDerWaalsContact O-CD 3.29Å; N169-R175 WeakPolarHBondContact O-CD 3.2Å
170	A	97.9	Very high	97.2	Very high	59 Å²	59	60.2 Å²	60.2	49%	0.488	29%	0.292	S	S	.	.	H	α-helix	trans	-85.9	-27.7	-178	0	0	0	0	0	113.9	Q166 Q167	Q166-A170 VanDerWaalsContact O-CB 3.24Å; Q166-A170 WeakPolarHBondContact O-CB 3.43Å; Q166-A170 PolarHBondContact O-N 3.49Å; Q166-A170 VanDerWaalsContact O-N 3.14Å; Q167-A170 PolarHBondContact O-N 3.46Å
171	Y	96.5	Very high	97.4	Very high	130 Å²	130	61.6 Å²	61.6	51%	0.51	30%	0.296	S	S	.	.			trans	-118	147.2	-166.6	-54.3	-72.3	0	0	0	113	Q167 R173 T174 R175	Q167-Y171 VanDerWaalsContact O-CD2 3.25Å; Q167-Y171 WeakPolarHBondContact O-CD2 3.18Å; Y171-R173 PolarHBondContact O-N 3.27Å; Y171-T174 PolarHBondContact O-N 3.49Å; Y171-T174 PolarHBondContact O-OG1 3.45Å; Y171-R175 WeakPolarHBondContact O-CB 3.4Å; Y171-R175 VanDerWaalsContact O-CG 3.31Å; Y171-R175 WeakPolarHBondContact O-CG 3.42Å; Y171-R175 PolarHBondContact O-N 3.02Å
172	N	97.8	Very high	97.5	Very high	102 Å²	102	61.1 Å²	61.1	55%	0.545	29%	0.293	S	S	.	.	S	Bend	trans	-60.9	-37.9	174.3	-72.4	-7.8	0	0	0	111.7	T174 R175 Y176 E177	N172-T174 VanDerWaalsContact C-N 3.34Å; N172-T174 PolarHBondContact O-N 3.47Å; N172-R175 CarbonylContact O-C 3.6Å; N172-R175 PolarHBondContact O-N 2.99Å; N172-R175 VanDerWaalsContact O-N 3.09Å; N172-Y176 HydrophobicContact CB-CD2 4.45Å; N172-Y176 PolarHBondContact O-N 3.32Å; N172-E177 PolarHBondContact O-N 2.93Å; N172-E177 VanDerWaalsContact O-N 3.08Å
173	R	94.6	Very high	97.5	Very high	111 Å²	111	58.5 Å²	58.5	42%	0.419	27%	0.274	S	S	.	.	I	π-helix	trans	-52.6	-48	178.2	-176.1	60.2	170.8	178.1	-1.8	113	E92 Y171 R175 E177 L178	E92-R173 IonicContact OE1-CZ 2.86Å; E92-R173 IonicContact OE1-NE 3.21Å; E92-R173 IonicContact OE1-NH2 3.72Å; E92-R173 PolarHBondContact OE1-NH2 3.3Å; E92-R173 VanDerWaalsContact OE1-NH2 3.11Å; E92-R173 IonicContact OE2-CZ 3.72Å; E92-R173 IonicContact OE2-NE 3.11Å; E92-R173 PolarHBondContact OE2-NE 2.93Å; E92-R173 IonicContact OE2-NH2 3.63Å; E92-R173 PolarHBondContact OE2-NH2 2.91Å; Y171-R173 PolarHBondContact O-N 3.27Å; R173-R175 VanDerWaalsContact C-N 3.32Å; R173-E177 WeakPolarHBondContact CD-OE2 3.45Å; R173-E177 IonicContact CZ-OE2 3.54Å; R173-E177 IonicContact NE-OE2 3.49Å; R173-E177 IonicContact NH1-OE2 3.71Å; R173-E177 PolarHBondContact NH1-OE2 3.44Å; R173-L178 PolarHBondContact O-N 2.86Å
174	T	96.7	Very high	97.5	Very high	34 Å²	34	61.6 Å²	61.6	21%	0.209	29%	0.291	C	S	.	.	I	π-helix	trans	-87.2	-1.8	-177.5	50.2	0	0	0	0	113.3	W150 L168 Y171 N172	W150-T174 PolarHBondContact NE1-O 3.08Å; L168-T174 HydrophobicContact CD2-CG2 4.03Å; L168-T174 VanDerWaalsContact O-CB 3.28Å; L168-T174 WeakPolarHBondContact O-CB 3.39Å; L168-T174 PolarHBondContact O-OG1 3.47Å; Y171-T174 PolarHBondContact O-N 3.49Å; Y171-T174 PolarHBondContact O-OG1 3.45Å; N172-T174 VanDerWaalsContact C-N 3.34Å; N172-T174 PolarHBondContact O-N 3.47Å
175	R	98.4	Very high	97.5	Very high	46 Å²	46	63.2 Å²	63.2	17%	0.174	30%	0.302	C	S	.	.	I	π-helix	trans	-119.4	-76.5	-177.4	-66.7	-179.5	63.9	-158	-5.2	112.5	F143 A148 L168 N169 Y171 N172 R173 R179	F143-R175 WeakPolarHBondContact CZ-O 3.04Å; A148-R175 HydrophobicContact CB-CB 4.32Å; A148-R175 WeakPolarHBondContact O-CB 3.41Å; A148-R175 WeakPolarHBondContact O-CG 3.34Å; A148-R175 PolarHBondContact O-NE 3.36Å; L168-R175 WeakPolarHBondContact O-CG 3.5Å; N169-R175 VanDerWaalsContact O-CD 3.29Å; N169-R175 WeakPolarHBondContact O-CD 3.2Å; Y171-R175 WeakPolarHBondContact O-CB 3.4Å; Y171-R175 VanDerWaalsContact O-CG 3.31Å; Y171-R175 WeakPolarHBondContact O-CG 3.42Å; Y171-R175 PolarHBondContact O-N 3.02Å; N172-R175 CarbonylContact O-C 3.6Å; N172-R175 PolarHBondContact O-N 2.99Å; N172-R175 VanDerWaalsContact O-N 3.09Å; R173-R175 VanDerWaalsContact C-N 3.32Å; R175-R179 WeakPolarHBondContact O-CB 3.45Å; R175-R179 PolarHBondContact O-N 3.41Å
176	Y	98.2	Very high	97.4	Very high	102 Å²	102	61.8 Å²	61.8	40%	0.4	30%	0.295	S	S	.	.	I	π-helix	trans	-79.4	-43.1	-170.6	-65	-65.7	0	0	0	111.8	A148 N172 L178 R179 E180	A148-Y176 HydrophobicContact CB-CD1 3.95Å; A148-Y176 HydrophobicContact CB-CE1 3.96Å; N172-Y176 HydrophobicContact CB-CD2 4.45Å; N172-Y176 PolarHBondContact O-N 3.32Å; Y176-L178 VanDerWaalsContact C-N 3.3Å; Y176-L178 PolarHBondContact O-N 2.88Å; Y176-R179 WeakPolarHBondContact O-CB 3.37Å; Y176-R179 PolarHBondContact O-N 2.95Å; Y176-E180 WeakPolarHBondContact O-CB 3.08Å; Y176-E180 PolarHBondContact O-N 2.99Å
177	E	97.3	Very high	97.4	Very high	80 Å²	80	56.9 Å²	56.9	37%	0.374	27%	0.273	S	S	.	.	I	π-helix	trans	-66.4	-36.1	175.4	-66.2	175.7	-133.6	0	0	111	N172 R173 R179 E180 F181	N172-E177 PolarHBondContact O-N 2.93Å; N172-E177 VanDerWaalsContact O-N 3.08Å; R173-E177 WeakPolarHBondContact CD-OE2 3.45Å; R173-E177 IonicContact CZ-OE2 3.54Å; R173-E177 IonicContact NE-OE2 3.49Å; R173-E177 IonicContact NH1-OE2 3.71Å; R173-E177 PolarHBondContact NH1-OE2 3.44Å; E177-R179 VanDerWaalsContact C-N 3.35Å; E177-E180 PolarHBondContact O-N 3.13Å; E177-F181 WeakPolarHBondContact O-CB 3.19Å; E177-F181 PolarHBondContact O-N 3.49Å
178	L	97.8	Very high	97.2	Very high	24 Å²	24	61.2 Å²	61.2	13%	0.126	29%	0.293	C	S	.	.	H	α-helix	trans	-63.4	-41.7	172.2	-177.4	64.4	0	0	0	112.1	F131 F143 W150 R173 Y176 F181 L182	F131-L178 HydrophobicContact CD2-CD1 3.83Å; F131-L178 HydrophobicContact CD2-CD2 3.98Å; F131-L178 HydrophobicContact CD2-CG 4.36Å; F131-L178 HydrophobicContact CE2-CD1 3.93Å; F131-L178 HydrophobicContact CE2-CD2 4.39Å; F143-L178 HydrophobicContact CD2-CD2 3.96Å; F143-L178 HydrophobicContact CE2-CD2 4.14Å; F143-L178 HydrophobicContact CG-CD2 4.19Å; W150-L178 HydrophobicContact CH2-CD2 4.15Å; W150-L178 HydrophobicContact CZ2-CD2 3.29Å; R173-L178 PolarHBondContact O-N 2.86Å; Y176-L178 VanDerWaalsContact C-N 3.3Å; Y176-L178 PolarHBondContact O-N 2.88Å; L178-F181 WeakPolarHBondContact O-CB 3.31Å; L178-F181 PolarHBondContact O-N 3.3Å; L178-L182 HydrophobicContact CG-CD1 4.4Å; L178-L182 WeakPolarHBondContact O-CG 3.32Å; L178-L182 PolarHBondContact O-N 2.96Å; L178-L182 VanDerWaalsContact O-N 3.09Å
179	R	98.4	Very high	97.1	Very high	63 Å²	63	61.6 Å²	61.6	24%	0.238	29%	0.294	C	S	.	.	H	α-helix	trans	-63.3	-44.6	174.9	-173.9	170.6	63.2	-175.3	4.9	111.4	F143 P145 R175 Y176 E177 F181 L182 E183	F143-R179 HydrophobicContact CE1-CB 4.09Å; F143-R179 HydrophobicContact CE1-CG 4.49Å; F143-R179 HydrophobicContact CZ-CB 3.98Å; P145-R179 WeakPolarHBondContact O-CD 3.41Å; P145-R179 PolarHBondContact O-NH1 3.28Å; R175-R179 WeakPolarHBondContact O-CB 3.45Å; R175-R179 PolarHBondContact O-N 3.41Å; Y176-R179 WeakPolarHBondContact O-CB 3.37Å; Y176-R179 PolarHBondContact O-N 2.95Å; E177-R179 VanDerWaalsContact C-N 3.35Å; R179-F181 VanDerWaalsContact C-N 3.3Å; R179-F181 PolarHBondContact O-N 3.42Å; R179-L182 PolarHBondContact O-N 3.38Å; R179-L182 VanDerWaalsContact O-N 3.14Å; R179-E183 VanDerWaalsContact CG-CD 3.45Å; R179-E183 HydrophobicContact CG-CG 3.86Å; R179-E183 WeakPolarHBondContact O-CB 3.36Å; R179-E183 PolarHBondContact O-N 3.06Å
180	E	97.7	Very high	97	Very high	112 Å²	112	59.6 Å²	59.6	52%	0.523	28%	0.283	S	S	.	.	H	α-helix	trans	-60	-40.8	175.9	-175.8	180	174.6	0	0	111.4	Y176 E177 L182 D184 T185	Y176-E180 WeakPolarHBondContact O-CB 3.08Å; Y176-E180 PolarHBondContact O-N 2.99Å; E177-E180 PolarHBondContact O-N 3.13Å; E180-L182 VanDerWaalsContact C-N 3.34Å; E180-L182 PolarHBondContact O-N 3.48Å; E180-D184 HydrophobicContact CG-CB 4.35Å; E180-D184 WeakPolarHBondContact O-CA 3.49Å; E180-D184 VanDerWaalsContact O-CB 3.27Å; E180-D184 WeakPolarHBondContact O-CB 3.25Å; E180-D184 PolarHBondContact O-N 2.97Å; E180-T185 PolarHBondContact O-N 3.33Å; E180-T185 VanDerWaalsContact O-N 3.07Å
181	F	97.4	Very high	96.7	Very high	55 Å²	55	61.9 Å²	61.9	24%	0.241	28%	0.284	C	S	.	.	I	π-helix	trans	-58.2	-45.8	172.9	171	-99.8	0	0	0	112.1	M30 L116 E177 L178 R179 T185 C186	M30-F181 HydrophobicContact CE-CE1 4.02Å; M30-F181 HydrophobicContact CE-CZ 4.04Å; M30-F181 HydrophobicContact SD-CE1 4.43Å; M30-F181 HydrophobicContact SD-CZ 3.98Å; L116-F181 HydrophobicContact CD1-CE1 3.83Å; E177-F181 WeakPolarHBondContact O-CB 3.19Å; E177-F181 PolarHBondContact O-N 3.49Å; L178-F181 WeakPolarHBondContact O-CB 3.31Å; L178-F181 PolarHBondContact O-N 3.3Å; R179-F181 VanDerWaalsContact C-N 3.3Å; R179-F181 PolarHBondContact O-N 3.42Å; F181-T185 HydrophobicContact CD2-CG2 4.14Å; F181-T185 HydrophobicContact CE2-CG2 4.35Å; F181-T185 WeakPolarHBondContact O-CB 3.28Å; F181-T185 PolarHBondContact O-N 3Å; F181-C186 WeakPolarHBondContact O-CB 3.49Å; F181-C186 PolarHBondContact O-N 2.99Å
182	L	98.1	Very high	96.5	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	29%	0.288	C	S	.	.	I	π-helix	trans	-76.6	-43.4	-177.3	-68.1	173.6	0	0	0	113.5	L116 V129 F131 F143 L178 R179 E180 C186	L116-L182 HydrophobicContact CB-CD2 4.37Å; L116-L182 HydrophobicContact CD1-CD2 4.24Å; V129-L182 HydrophobicContact CB-CB 3.94Å; V129-L182 HydrophobicContact CG1-CB 4.15Å; V129-L182 WeakPolarHBondContact CG1-O 3.4Å; V129-L182 HydrophobicContact CG2-CB 4.21Å; F131-L182 HydrophobicContact CB-CD1 4.26Å; F143-L182 HydrophobicContact CD1-CD1 4.03Å; F143-L182 HydrophobicContact CE1-CD1 4.34Å; L178-L182 HydrophobicContact CG-CD1 4.4Å; L178-L182 WeakPolarHBondContact O-CG 3.32Å; L178-L182 PolarHBondContact O-N 2.96Å; L178-L182 VanDerWaalsContact O-N 3.09Å; R179-L182 PolarHBondContact O-N 3.38Å; R179-L182 VanDerWaalsContact O-N 3.14Å; E180-L182 VanDerWaalsContact C-N 3.34Å; E180-L182 PolarHBondContact O-N 3.48Å; L182-C186 WeakPolarHBondContact O-CB 3.21Å
183	E	97.6	Very high	96.2	Very high	37 Å²	37	57.5 Å²	57.5	17%	0.173	26%	0.263	C	S	.	.	I	π-helix	trans	-86.3	-29.1	-173.6	-65.4	-170.5	165.1	0	0	113	R126 V129 R179 V187	R126-E183 IonicContact CZ-OE1 3.56Å; R126-E183 IonicContact CZ-OE2 2.65Å; R126-E183 IonicContact NE-OE1 2.75Å; R126-E183 IonicContact NE-OE2 3.27Å; R126-E183 IonicContact NH2-OE1 2.92Å; R126-E183 PolarHBondContact NH2-OE1 3.26Å; R126-E183 IonicContact NH2-OE2 3.52Å; R126-E183 PolarHBondContact NH2-OE2 3.49Å; V129-E183 HydrophobicContact CG1-CG 4.04Å; V129-E183 HydrophobicContact CG2-CG 3.9Å; R179-E183 VanDerWaalsContact CG-CD 3.45Å; R179-E183 HydrophobicContact CG-CG 3.86Å; R179-E183 WeakPolarHBondContact O-CB 3.36Å; R179-E183 PolarHBondContact O-N 3.06Å; E183-V187 VanDerWaalsContact O-CB 3.25Å; E183-V187 WeakPolarHBondContact O-CB 3.5Å; E183-V187 WeakPolarHBondContact O-CG2 3.41Å
184	D	96.5	Very high	95.6	Very high	78 Å²	78	52.7 Å²	52.7	42%	0.417	25%	0.245	S	C	.	.	I	π-helix	trans	-109.7	-59.7	-178	-60.3	-31.7	0	0	0	111	E180 V187 Q188	E180-D184 HydrophobicContact CG-CB 4.35Å; E180-D184 WeakPolarHBondContact O-CA 3.49Å; E180-D184 VanDerWaalsContact O-CB 3.27Å; E180-D184 WeakPolarHBondContact O-CB 3.25Å; E180-D184 PolarHBondContact O-N 2.97Å; D184-V187 PolarHBondContact O-N 3.28Å; D184-Q188 VanDerWaalsContact O-CB 3.28Å; D184-Q188 WeakPolarHBondContact O-CB 3.27Å; D184-Q188 WeakPolarHBondContact O-CG 2.97Å; D184-Q188 PolarHBondContact O-N 3.04Å
185	T	96.4	Very high	94.3	Very high	57 Å²	57	54.4 Å²	54.4	35%	0.35	26%	0.259	S	S	.	.	I	π-helix	trans	-64.4	-49.7	-172.6	-58.9	0	0	0	0	111.6	M82 E180 F181 Y189	M82-T185 HydrophobicContact CE-CG2 4.36Å; E180-T185 PolarHBondContact O-N 3.33Å; E180-T185 VanDerWaalsContact O-N 3.07Å; F181-T185 HydrophobicContact CD2-CG2 4.14Å; F181-T185 HydrophobicContact CE2-CG2 4.35Å; F181-T185 WeakPolarHBondContact O-CB 3.28Å; F181-T185 PolarHBondContact O-N 3Å; T185-Y189 WeakPolarHBondContact O-CB 3.35Å; T185-Y189 PolarHBondContact O-N 3.06Å
186	C	97.4	Very high	92.6	Very high	3 Å²	3	56 Å²	56	2%	0.02	27%	0.269	C	S	.	.	H	α-helix	trans	-63.3	-45.2	178.7	-179.4	0	0	0	0	111.3	C118 F181 L182 Y189 V190	C118-C186 HydrophobicContact CB-CB 3.85Å; C118-C186 WeakPolarHBondContact CB-SG 3.35Å; C118-C186 PolarHBondContact N-SG 2.78Å; C118-C186 WeakPolarHBondContact SG-CB 3.36Å; C118-C186 PolarHBondContact SG-O 3.38Å; C118-C186 VanDerWaalsContact SG-O 3.38Å; C118-C186 CovalentContact SG-SG 2.04Å; C118-C186 PolarHBondContact SG-SG 3.48Å; F181-C186 WeakPolarHBondContact O-CB 3.49Å; F181-C186 PolarHBondContact O-N 2.99Å; L182-C186 WeakPolarHBondContact O-CB 3.21Å; C186-Y189 VanDerWaalsContact O-CB 3.31Å; C186-Y189 WeakPolarHBondContact O-CB 3.34Å; C186-Y189 PolarHBondContact O-N 3.19Å; C186-V190 WeakPolarHBondContact O-CG2 3.5Å; C186-V190 PolarHBondContact O-N 3.08Å
187	V	96.1	Very high	90.8	Very high	16 Å²	16	52.1 Å²	52.1	10%	0.097	26%	0.255	C	S	.	.	H	α-helix	trans	-63.8	-46.4	-178.8	173	0	0	0	0	111.2	C118 L120 A127 E183 D184 Y189 V190 Q191	C118-V187 HydrophobicContact CB-CG2 3.98Å; C118-V187 PolarHBondContact SG-N 2.04Å; L120-V187 HydrophobicContact CD1-CB 4.49Å; L120-V187 HydrophobicContact CD1-CG1 4.18Å; L120-V187 HydrophobicContact CD1-CG2 4.3Å; L120-V187 HydrophobicContact CD2-CG1 4.07Å; L120-V187 HydrophobicContact CG-CG1 4.22Å; A127-V187 HydrophobicContact CB-CG2 3.52Å; E183-V187 VanDerWaalsContact O-CB 3.25Å; E183-V187 WeakPolarHBondContact O-CB 3.5Å; E183-V187 WeakPolarHBondContact O-CG2 3.41Å; D184-V187 PolarHBondContact O-N 3.28Å; V187-Y189 VanDerWaalsContact C-N 3.26Å; V187-Y189 PolarHBondContact O-N 2.64Å; V187-V190 PolarHBondContact O-N 2.89Å; V187-Q191 WeakPolarHBondContact O-CG 3.45Å; V187-Q191 PolarHBondContact O-N 3.18Å
188	Q	95.1	Very high	89	Confident	121 Å²	121	53.4 Å²	53.4	57%	0.565	26%	0.264	S	S	*	.	H	α-helix	trans	-61.6	-37.1	175	-71.5	175.8	37.6	0	0	111.6	D184 K192	D184-Q188 VanDerWaalsContact O-CB 3.28Å; D184-Q188 WeakPolarHBondContact O-CB 3.27Å; D184-Q188 WeakPolarHBondContact O-CG 2.97Å; D184-Q188 PolarHBondContact O-N 3.04Å; Q188-K192 VanDerWaalsContact O-CB 3.22Å; Q188-K192 WeakPolarHBondContact O-CB 3.45Å; Q188-K192 PolarHBondContact O-N 3.29Å
189	Y	95.6	Very high	87	Confident	21 Å²	21	58.9 Å²	58.9	8%	0.082	29%	0.291	C	S	.	.	H	α-helix	trans	-60.8	-48.3	175.3	-167.7	-80.2	0	0	0	111.4	L28 H56 L73 Q74 T185 C186 V187 K192 H193	L28-Y189 HydrophobicContact CD2-CD1 3.9Å; L28-Y189 HydrophobicContact CD2-CG 4.26Å; H56-Y189 AromaticContact CE1-CZ 3.99Å; H56-Y189 PolarHBondContact CE1-OH 2.77Å; H56-Y189 PolarHBondContact NE2-OH 2.97Å; L73-Y189 HydrophobicContact CD1-CE1 4.44Å; L73-Y189 WeakPolarHBondContact CD1-OH 3.46Å; Q74-Y189 HydrophobicContact CG-CE2 4Å; T185-Y189 WeakPolarHBondContact O-CB 3.35Å; T185-Y189 PolarHBondContact O-N 3.06Å; C186-Y189 VanDerWaalsContact O-CB 3.31Å; C186-Y189 WeakPolarHBondContact O-CB 3.34Å; C186-Y189 PolarHBondContact O-N 3.19Å; V187-Y189 VanDerWaalsContact C-N 3.26Å; V187-Y189 PolarHBondContact O-N 2.64Å; Y189-K192 PolarHBondContact O-N 3.49Å; Y189-H193 AromaticContact CD1-CD2 3.9Å; Y189-H193 AromaticContact CD2-CD2 3.88Å; Y189-H193 HydrophobicContact CE1-CB 4.27Å; Y189-H193 AromaticContact CE1-CD2 3.74Å; Y189-H193 AromaticContact CE2-CD2 3.75Å; Y189-H193 AromaticContact CG-CD2 3.95Å; Y189-H193 AromaticContact CZ-CD2 3.66Å; Y189-H193 PolarHBondContact O-CD2 3.41Å; Y189-H193 PolarHBondContact O-N 3.31Å
190	V	95.1	Very high	84.9	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-60	-52.7	178.2	175.8	0	0	0	0	110.7	Q26 L28 L50 L120 C186 V187 K192 H193 I194	Q26-V190 HydrophobicContact CB-CG1 3.86Å; L28-V190 HydrophobicContact CB-CG2 3.45Å; L28-V190 VanDerWaalsContact CB-CG2 3.45Å; L50-V190 HydrophobicContact CD1-CB 4.3Å; L50-V190 HydrophobicContact CD1-CG1 4.29Å; L50-V190 HydrophobicContact CD1-CG2 3.95Å; L120-V190 HydrophobicContact CD1-CB 3.93Å; L120-V190 HydrophobicContact CD1-CG1 3.89Å; L120-V190 HydrophobicContact CD1-CG2 4.27Å; C186-V190 WeakPolarHBondContact O-CG2 3.5Å; C186-V190 PolarHBondContact O-N 3.08Å; V187-V190 PolarHBondContact O-N 2.89Å; V190-K192 PolarHBondContact O-N 3.17Å; V190-H193 PolarHBondContact O-N 3.15Å; V190-I194 HydrophobicContact CG1-CB 4.34Å; V190-I194 HydrophobicContact CG1-CD1 4.01Å; V190-I194 HydrophobicContact CG1-CG2 4.43Å; V190-I194 VanDerWaalsContact O-CB 3.26Å; V190-I194 WeakPolarHBondContact O-CB 3.43Å; V190-I194 WeakPolarHBondContact O-CG2 3.38Å; V190-I194 PolarHBondContact O-N 3.02Å
191	Q	92.3	Very high	82.8	Confident	108 Å²	108	56.7 Å²	56.7	51%	0.505	29%	0.294	S	S	.	.	H	α-helix	trans	-56.5	-39	-179.3	-70.8	174.4	-19.4	0	0	112.3	L120 V187	L120-Q191 HydrophobicContact CD2-CG 3.53Å; V187-Q191 WeakPolarHBondContact O-CG 3.45Å; V187-Q191 PolarHBondContact O-N 3.18Å
192	K	92.6	Very high	80.3	Confident	135 Å²	135	58.4 Å²	58.4	59%	0.587	31%	0.313	S	S	*	.	H	α-helix	trans	-72.5	-41.1	-178.8	-174.4	174.4	178.2	-179.4	0	113	Q188 Y189 V190	Q188-K192 VanDerWaalsContact O-CB 3.22Å; Q188-K192 WeakPolarHBondContact O-CB 3.45Å; Q188-K192 PolarHBondContact O-N 3.29Å; Y189-K192 PolarHBondContact O-N 3.49Å; V190-K192 PolarHBondContact O-N 3.17Å
193	H	90.6	Very high	77.9	Confident	5 Å²	5	66.1 Å²	66.1	2%	0.023	35%	0.349	C	S	.	.	H	α-helix	trans	-105.6	-19.5	-165.8	-66.6	-59.4	0	0	0	114.8	L50 L73 Y189 V190 S195 M196 E197	L50-H193 HydrophobicContact CD2-CB 3.7Å; L73-H193 HydrophobicContact CD2-CB 4.43Å; L73-H193 PolarHBondContact O-CE1 3.29Å; L73-H193 PolarHBondContact O-ND1 3.2Å; Y189-H193 AromaticContact CD1-CD2 3.9Å; Y189-H193 AromaticContact CD2-CD2 3.88Å; Y189-H193 HydrophobicContact CE1-CB 4.27Å; Y189-H193 AromaticContact CE1-CD2 3.74Å; Y189-H193 AromaticContact CE2-CD2 3.75Å; Y189-H193 AromaticContact CG-CD2 3.95Å; Y189-H193 AromaticContact CZ-CD2 3.66Å; Y189-H193 PolarHBondContact O-CD2 3.41Å; Y189-H193 PolarHBondContact O-N 3.31Å; V190-H193 PolarHBondContact O-N 3.15Å; H193-S195 VanDerWaalsContact C-N 3.32Å; H193-S195 PolarHBondContact O-N 2.78Å; H193-M196 WeakPolarHBondContact O-CB 3.08Å; H193-M196 PolarHBondContact O-N 2.88Å; H193-M196 VanDerWaalsContact O-N 3.11Å; H193-E197 PolarHBondContact O-N 2.84Å
194	I	82.8	Confident	75.5	Confident	10 Å²	10	70 Å²	70	5%	0.051	38%	0.375	C	S	.	.	H	α-helix	trans	-67.2	-33.9	-177.1	-160	145.8	0	0	0	113.1	Q26 V190 M196 E197 N198	Q26-I194 VanDerWaalsContact CA-CD1 3.48Å; Q26-I194 HydrophobicContact CB-CD1 3.87Å; Q26-I194 HydrophobicContact CG-CD1 3.81Å; Q26-I194 HydrophobicContact CG-CG2 4.34Å; V190-I194 HydrophobicContact CG1-CB 4.34Å; V190-I194 HydrophobicContact CG1-CD1 4.01Å; V190-I194 HydrophobicContact CG1-CG2 4.43Å; V190-I194 VanDerWaalsContact O-CB 3.26Å; V190-I194 WeakPolarHBondContact O-CB 3.43Å; V190-I194 WeakPolarHBondContact O-CG2 3.38Å; V190-I194 PolarHBondContact O-N 3.02Å; I194-M196 PolarHBondContact O-N 3.41Å; I194-E197 PolarHBondContact O-N 3.47Å; I194-N198 PolarHBondContact O-N 3.4Å; I194-N198 VanDerWaalsContact O-N 3.14Å
195	S	69.3	Low	73	Confident	70 Å²	70	70.9 Å²	70.9	49%	0.49	39%	0.387	S	S	.	.	H	α-helix	trans	-62.8	-31.9	174.3	-57.1	0	0	0	0	112.2	H193 M199	H193-S195 VanDerWaalsContact C-N 3.32Å; H193-S195 PolarHBondContact O-N 2.78Å; S195-M199 WeakPolarHBondContact O-CG 3.31Å; S195-M199 PolarHBondContact O-N 3.2Å; S195-M199 VanDerWaalsContact O-N 3.14Å
196	M	62.8	Low	70.9	Confident	80 Å²	80	78.7 Å²	78.7	39%	0.394	41%	0.411	S	S	.	.	H	α-helix	trans	-72.4	-38	179.3	-63.2	175	64.7	0	0	112.1	H193 I194 K200	H193-M196 WeakPolarHBondContact O-CB 3.08Å; H193-M196 PolarHBondContact O-N 2.88Å; H193-M196 VanDerWaalsContact O-N 3.11Å; I194-M196 PolarHBondContact O-N 3.41Å; M196-K200 PolarHBondContact O-N 3.11Å; M196-K200 VanDerWaalsContact O-N 3.16Å
197	E	60.4	Low	68.9	Low	20 Å²	20	82 Å²	82	9%	0.093	43%	0.434	C	S	.	.	H	α-helix	trans	-66.7	-45.3	174.5	-73.9	-64.3	147.7	0	0	111.1	L50 Q71 H193 I194 M199 K200 G201	L50-E197 HydrophobicContact CD2-CG 4.27Å; Q71-E197 PolarHBondContact NE2-OE1 2.77Å; Q71-E197 PolarHBondContact NE2-OE2 2.75Å; Q71-E197 PolarHBondContact OE1-OE1 2.74Å; H193-E197 PolarHBondContact O-N 2.84Å; I194-E197 PolarHBondContact O-N 3.47Å; E197-M199 VanDerWaalsContact C-N 3.28Å; E197-M199 PolarHBondContact O-N 2.89Å; E197-K200 PolarHBondContact O-N 3.16Å; E197-K200 VanDerWaalsContact O-N 3.11Å; E197-G201 PolarHBondContact O-N 3.14Å
198	N	58.7	Low	67.2	Low	106 Å²	106	90.2 Å²	90.2	57%	0.567	46%	0.464	S	S	*	.	H	α-helix	trans	-59.6	-37.2	176.8	-73.8	-22.2	0	0	0	112.4	I194 S202	I194-N198 PolarHBondContact O-N 3.4Å; I194-N198 VanDerWaalsContact O-N 3.14Å; N198-S202 PolarHBondContact O-N 3.14Å
199	M	55.2	Low	65.6	Low	140 Å²	140	89.1 Å²	89.1	69%	0.69	47%	0.466	S	S	*	.	H	α-helix	trans	-68.7	-37.8	175	-74.3	179	103.1	0	0	113	S195 E197 Q203	S195-M199 WeakPolarHBondContact O-CG 3.31Å; S195-M199 PolarHBondContact O-N 3.2Å; S195-M199 VanDerWaalsContact O-N 3.14Å; E197-M199 VanDerWaalsContact C-N 3.28Å; E197-M199 PolarHBondContact O-N 2.89Å; M199-Q203 PolarHBondContact O-N 3.34Å
200	K	54.9	Low	64.1	Low	84 Å²	84	92.7 Å²	92.7	37%	0.365	49%	0.494	S	S	.	.	H	α-helix	trans	-71.3	-38.9	176.1	-80.8	176.8	175.7	170.2	0	112.6	M196 E197 S202 Q203 T204	M196-K200 PolarHBondContact O-N 3.11Å; M196-K200 VanDerWaalsContact O-N 3.16Å; E197-K200 PolarHBondContact O-N 3.16Å; E197-K200 VanDerWaalsContact O-N 3.11Å; K200-S202 VanDerWaalsContact C-N 3.28Å; K200-S202 PolarHBondContact O-N 3.3Å; K200-Q203 PolarHBondContact O-N 3.41Å; K200-Q203 VanDerWaalsContact O-N 3.15Å; K200-T204 PolarHBondContact O-N 3.39Å; K200-T204 PolarHBondContact O-OG1 3.34Å
201	G	53	Low	63.1	Low	45 Å²	45	98.5 Å²	98.5	46%	0.464	53%	0.525	S	S	.	.	H	α-helix	trans	-62	-33.7	174.7	0	0	0	0	0	113.2	E197 T204	E197-G201 PolarHBondContact O-N 3.14Å; G201-T204 PolarHBondContact O-OG1 3.11Å
202	S	46.1	Very low	62.3	Low	91 Å²	91	97.1 Å²	97.1	64%	0.636	52%	0.523	S	S	*	.	H	α-helix	trans	-67.3	-39.1	171.9	175.9	0	0	0	0	112.6	N198 K200 T204	N198-S202 PolarHBondContact O-N 3.14Å; K200-S202 VanDerWaalsContact C-N 3.28Å; K200-S202 PolarHBondContact O-N 3.3Å; S202-T204 PolarHBondContact O-N 3.1Å
203	Q	47.1	Very low	61.6	Low	161 Å²	161	96 Å²	96	75%	0.752	52%	0.523	S	S	*	.	H	α-helix	trans	-73.4	-24.5	-179.7	-75.1	-170	-21.3	0	0	114.4	M199 K200 S205	M199-Q203 PolarHBondContact O-N 3.34Å; K200-Q203 PolarHBondContact O-N 3.41Å; K200-Q203 VanDerWaalsContact O-N 3.15Å; Q203-S205 VanDerWaalsContact C-N 3.34Å
204	T	46.8	Very low	61	Low	118 Å²	118	98 Å²	98	72%	0.724	54%	0.544	S	S	*	.	H	α-helix	trans	-82.5	-8.3	178.8	47.6	0	0	0	0	114	K200 G201 S202 R206	K200-T204 PolarHBondContact O-N 3.39Å; K200-T204 PolarHBondContact O-OG1 3.34Å; G201-T204 PolarHBondContact O-OG1 3.11Å; S202-T204 PolarHBondContact O-N 3.1Å; T204-R206 PolarHBondContact O-N 3.38Å
205	S	45.5	Very low	61	Low	97 Å²	97	102.1 Å²	102.1	68%	0.678	57%	0.57	S	S	*	*			trans	-76.2	57.2	166	179	0	0	0	0	111.3	Q203 S207	Q203-S205 VanDerWaalsContact C-N 3.34Å; S205-S207 PolarHBondContact O-N 2.94Å; S205-S207 VanDerWaalsContact O-N 3.08Å
206	R	51.3	Low	61.7	Low	222 Å²	222	103 Å²	103	84%	0.838	57%	0.569	S	S	*	*			trans	-75.2	101.7	170	-146.4	174.7	-168.4	165.6	2.8	107.6	T204 Y208	T204-R206 PolarHBondContact O-N 3.38Å; R206-Y208 PolarHBondContact O-N 3.34Å
207	S	55.2	Low	62.7	Low	73 Å²	73	103.1 Å²	103.1	51%	0.51	57%	0.574	S	S	.	*			trans	-51.9	113.1	-176.9	-169.9	0	0	0	0	111.8	S205 T209	S205-S207 PolarHBondContact O-N 2.94Å; S205-S207 VanDerWaalsContact O-N 3.08Å; S207-T209 PolarHBondContact O-N 3.12Å; S207-T209 WeakPolarHBondContact OG-CB 3.25Å; S207-T209 VanDerWaalsContact OG-CG2 3.31Å; S207-T209 WeakPolarHBondContact OG-CG2 3.46Å; S207-T209 PolarHBondContact OG-OG1 3.37Å
208	Y	60.7	Low	63.8	Low	187 Å²	187	103.7 Å²	103.7	73%	0.733	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-6.6	173.7	-73.9	-87.5	0	0	0	113	R206 S210 L211 V212	R206-Y208 PolarHBondContact O-N 3.34Å; Y208-S210 VanDerWaalsContact C-N 3.26Å; Y208-S210 PolarHBondContact O-N 2.94Å; Y208-L211 PolarHBondContact O-N 3.31Å; Y208-V212 WeakPolarHBondContact O-CG2 3.4Å; Y208-V212 PolarHBondContact O-N 2.94Å
209	T	60.7	Low	65	Low	99 Å²	99	101.3 Å²	101.3	61%	0.607	58%	0.577	S	S	*	*	H	α-helix	trans	-57.3	-35.7	177.5	55.1	0	0	0	0	113.2	S207 L213	S207-T209 PolarHBondContact O-N 3.12Å; S207-T209 WeakPolarHBondContact OG-CB 3.25Å; S207-T209 VanDerWaalsContact OG-CG2 3.31Å; S207-T209 WeakPolarHBondContact OG-CG2 3.46Å; S207-T209 PolarHBondContact OG-OG1 3.37Å; T209-L213 VanDerWaalsContact O-CB 3.25Å; T209-L213 WeakPolarHBondContact O-CB 3.15Å; T209-L213 PolarHBondContact O-N 3.49Å
210	S	65.8	Low	66.4	Low	96 Å²	96	101.9 Å²	101.9	67%	0.671	58%	0.576	S	S	*	*	H	α-helix	trans	-70	-38.8	178.9	-171.3	0	0	0	0	112.2	Y208 G214	Y208-S210 VanDerWaalsContact C-N 3.26Å; Y208-S210 PolarHBondContact O-N 2.94Å; S210-G214 PolarHBondContact O-N 2.95Å
211	L	73.4	Confident	67.9	Low	122 Å²	122	103.2 Å²	103.2	64%	0.639	59%	0.586	S	S	*	*	H	α-helix	trans	-69.7	-44.3	177.4	-165.9	100.7	0	0	0	111.2	Y208 G214 V215	Y208-L211 PolarHBondContact O-N 3.31Å; L211-G214 PolarHBondContact O-N 3.37Å; L211-V215 WeakPolarHBondContact O-CG2 3.36Å; L211-V215 PolarHBondContact O-N 3.5Å
212	V	74.7	Confident	69.4	Low	78 Å²	78	107 Å²	107	47%	0.473	59%	0.594	S	S	.	*	H	α-helix	trans	-64.1	-41.9	178.4	174.5	0	0	0	0	111	Y208 G214 V215 L216	Y208-V212 WeakPolarHBondContact O-CG2 3.4Å; Y208-V212 PolarHBondContact O-N 2.94Å; V212-G214 VanDerWaalsContact C-N 3.34Å; V212-G214 PolarHBondContact O-N 2.98Å; V212-V215 PolarHBondContact O-N 3.29Å; V212-L216 HydrophobicContact CG1-CD1 4.11Å; V212-L216 WeakPolarHBondContact O-CG 3.36Å; V212-L216 PolarHBondContact O-N 3.24Å
213	L	78.9	Confident	71.2	Confident	113 Å²	113	105.1 Å²	105.1	59%	0.592	58%	0.584	S	S	*	*	H	α-helix	trans	-62.6	-41.9	175.3	-169.8	68.9	0	0	0	111.4	T209 V215 L216 V217	T209-L213 VanDerWaalsContact O-CB 3.25Å; T209-L213 WeakPolarHBondContact O-CB 3.15Å; T209-L213 PolarHBondContact O-N 3.49Å; L213-V215 PolarHBondContact O-N 3.32Å; L213-L216 PolarHBondContact O-N 3.04Å; L213-V217 VanDerWaalsContact O-CG2 3.31Å; L213-V217 WeakPolarHBondContact O-CG2 3.35Å; L213-V217 PolarHBondContact O-N 3.36Å
214	G	77.1	Confident	72.8	Confident	45 Å²	45	99.7 Å²	99.7	46%	0.464	57%	0.571	S	S	.	*	H	α-helix	trans	-60.6	-43.1	175.6	0	0	0	0	0	113.3	S210 L211 V212 G218	S210-G214 PolarHBondContact O-N 2.95Å; L211-G214 PolarHBondContact O-N 3.37Å; V212-G214 VanDerWaalsContact C-N 3.34Å; V212-G214 PolarHBondContact O-N 2.98Å; G214-G218 PolarHBondContact O-N 3Å
215	V	83.6	Confident	74.7	Confident	97 Å²	97	98.1 Å²	98.1	59%	0.588	56%	0.561	S	S	*	*	H	α-helix	trans	-67.2	-40.5	177.9	173.6	0	0	0	0	111.6	L211 V212 L213 G218 S219	L211-V215 WeakPolarHBondContact O-CG2 3.36Å; L211-V215 PolarHBondContact O-N 3.5Å; V212-V215 PolarHBondContact O-N 3.29Å; L213-V215 PolarHBondContact O-N 3.32Å; V215-G218 PolarHBondContact O-N 3.45Å; V215-S219 WeakPolarHBondContact O-CB 3.28Å; V215-S219 PolarHBondContact O-N 3.38Å; V215-S219 PolarHBondContact O-OG 2.89Å
216	L	84.1	Confident	76.4	Confident	88 Å²	88	96.2 Å²	96.2	46%	0.461	55%	0.552	S	S	.	*	H	α-helix	trans	-64.5	-48.4	176.4	-72.7	172.4	0	0	0	111.4	V212 L213 G218 S219 F220	V212-L216 HydrophobicContact CG1-CD1 4.11Å; V212-L216 WeakPolarHBondContact O-CG 3.36Å; V212-L216 PolarHBondContact O-N 3.24Å; L213-L216 PolarHBondContact O-N 3.04Å; L216-G218 VanDerWaalsContact C-N 3.34Å; L216-G218 PolarHBondContact O-N 3.22Å; L216-S219 WeakPolarHBondContact CA-OG 3.32Å; L216-S219 PolarHBondContact O-N 2.98Å; L216-S219 PolarHBondContact O-OG 3.42Å; L216-F220 WeakPolarHBondContact O-CD2 3.42Å; L216-F220 PolarHBondContact O-N 3.29Å; L216-F220 VanDerWaalsContact O-N 3.13Å
217	V	84.3	Confident	77.8	Confident	84 Å²	84	89.7 Å²	89.7	51%	0.509	54%	0.536	S	S	.	.	H	α-helix	trans	-61.4	-44.7	177.7	174.6	0	0	0	0	110.7	L213 S219 F220 I221	L213-V217 VanDerWaalsContact O-CG2 3.31Å; L213-V217 WeakPolarHBondContact O-CG2 3.35Å; L213-V217 PolarHBondContact O-N 3.36Å; V217-S219 PolarHBondContact O-N 3.11Å; V217-F220 PolarHBondContact O-N 3.2Å; V217-I221 WeakPolarHBondContact O-CG1 3.45Å; V217-I221 PolarHBondContact O-N 2.92Å
218	G	82.6	Confident	78.8	Confident	32 Å²	32	87.7 Å²	87.7	33%	0.33	53%	0.527	S	S	.	.	H	α-helix	trans	-59.6	-42.5	177.7	0	0	0	0	0	113.3	G214 V215 L216 I221 I222	G214-G218 PolarHBondContact O-N 3Å; V215-G218 PolarHBondContact O-N 3.45Å; L216-G218 VanDerWaalsContact C-N 3.34Å; L216-G218 PolarHBondContact O-N 3.22Å; G218-I221 PolarHBondContact O-N 2.9Å; G218-I222 WeakPolarHBondContact O-CG1 3.22Å; G218-I222 PolarHBondContact O-N 2.91Å; G218-I222 VanDerWaalsContact O-N 3.15Å
219	S	84.8	Confident	79.8	Confident	56 Å²	56	83.5 Å²	83.5	39%	0.392	52%	0.516	S	S	.	.	H	α-helix	trans	-67.1	-36.2	179	49.8	0	0	0	0	113.2	V215 L216 V217 I222 A223	V215-S219 WeakPolarHBondContact O-CB 3.28Å; V215-S219 PolarHBondContact O-N 3.38Å; V215-S219 PolarHBondContact O-OG 2.89Å; L216-S219 WeakPolarHBondContact CA-OG 3.32Å; L216-S219 PolarHBondContact O-N 2.98Å; L216-S219 PolarHBondContact O-OG 3.42Å; V217-S219 PolarHBondContact O-N 3.11Å; S219-I222 PolarHBondContact O-N 2.63Å; S219-A223 WeakPolarHBondContact O-CB 3.35Å; S219-A223 PolarHBondContact O-N 3.15Å
220	F	84.7	Confident	80.5	Confident	151 Å²	151	85.7 Å²	85.7	66%	0.662	52%	0.517	S	S	*	.	H	α-helix	trans	-65.6	-38.8	173.8	-78.3	-65.6	0	0	0	113.1	L216 V217 A223 G224	L216-F220 WeakPolarHBondContact O-CD2 3.42Å; L216-F220 PolarHBondContact O-N 3.29Å; L216-F220 VanDerWaalsContact O-N 3.13Å; V217-F220 PolarHBondContact O-N 3.2Å; F220-A223 PolarHBondContact O-N 3.19Å; F220-G224 PolarHBondContact O-N 3.14Å
221	I	85.8	Confident	80.9	Confident	113 Å²	113	87 Å²	87	58%	0.579	52%	0.516	S	S	*	.	H	α-helix	trans	-63.8	-45.4	176.6	-62.4	-61.3	0	0	0	110.7	V217 G218 A223 G224 V225	V217-I221 WeakPolarHBondContact O-CG1 3.45Å; V217-I221 PolarHBondContact O-N 2.92Å; G218-I221 PolarHBondContact O-N 2.9Å; I221-A223 PolarHBondContact O-N 3.35Å; I221-G224 PolarHBondContact O-N 3.06Å; I221-V225 WeakPolarHBondContact O-CG2 3.46Å; I221-V225 PolarHBondContact O-N 3.25Å
222	I	85.1	Confident	80.7	Confident	124 Å²	124	86.6 Å²	86.6	64%	0.636	52%	0.522	S	S	*	.	H	α-helix	trans	-62.3	-44.6	179.1	-65.3	167	0	0	0	110.8	G218 S219 G224 V225 A226	G218-I222 WeakPolarHBondContact O-CG1 3.22Å; G218-I222 PolarHBondContact O-N 2.91Å; G218-I222 VanDerWaalsContact O-N 3.15Å; S219-I222 PolarHBondContact O-N 2.63Å; I222-G224 PolarHBondContact O-N 2.84Å; I222-V225 PolarHBondContact O-N 3.27Å; I222-A226 WeakPolarHBondContact O-CB 3.37Å; I222-A226 PolarHBondContact O-N 2.98Å
223	A	83	Confident	80.4	Confident	52 Å²	52	88 Å²	88	43%	0.43	53%	0.532	S	S	.	.	H	α-helix	trans	-62.2	-42.6	176.8	0	0	0	0	0	111.9	S219 F220 I221 V225 A226 V227	S219-A223 WeakPolarHBondContact O-CB 3.35Å; S219-A223 PolarHBondContact O-N 3.15Å; F220-A223 PolarHBondContact O-N 3.19Å; I221-A223 PolarHBondContact O-N 3.35Å; A223-V225 PolarHBondContact O-N 2.94Å; A223-A226 PolarHBondContact O-N 2.78Å; A223-V227 WeakPolarHBondContact O-CG2 3.27Å; A223-V227 PolarHBondContact O-N 3.47Å
224	G	81.5	Confident	79.6	Confident	46 Å²	46	85 Å²	85	47%	0.474	53%	0.527	S	S	.	.	H	α-helix	trans	-61	-43.2	176.6	0	0	0	0	0	112.9	F220 I221 I222 V227 G228	F220-G224 PolarHBondContact O-N 3.14Å; I221-G224 PolarHBondContact O-N 3.06Å; I222-G224 PolarHBondContact O-N 2.84Å; G224-V227 PolarHBondContact O-N 2.97Å; G224-G228 PolarHBondContact O-N 3.13Å
225	V	85	Confident	78.7	Confident	85 Å²	85	86 Å²	86	52%	0.515	54%	0.537	S	S	.	.	H	α-helix	trans	-64.1	-44	175.8	173	0	0	0	0	111.1	I221 I222 A223 V227 G228 I229	I221-V225 WeakPolarHBondContact O-CG2 3.46Å; I221-V225 PolarHBondContact O-N 3.25Å; I222-V225 PolarHBondContact O-N 3.27Å; A223-V225 PolarHBondContact O-N 2.94Å; V225-V227 PolarHBondContact O-N 3.5Å; V225-G228 PolarHBondContact O-N 3.12Å; V225-I229 HydrophobicContact CG1-CD1 3.8Å; V225-I229 HydrophobicContact CG1-CG1 4.41Å; V225-I229 VanDerWaalsContact O-CG1 3.31Å; V225-I229 WeakPolarHBondContact O-CG1 3.31Å; V225-I229 PolarHBondContact O-N 3.31Å
226	A	81.8	Confident	77.4	Confident	58 Å²	58	93.1 Å²	93.1	48%	0.479	55%	0.554	S	S	.	*	H	α-helix	trans	-61.7	-43.4	178.3	0	0	0	0	0	112.3	I222 A223 I229 F230	I222-A226 WeakPolarHBondContact O-CB 3.37Å; I222-A226 PolarHBondContact O-N 2.98Å; A223-A226 PolarHBondContact O-N 2.78Å; A226-I229 PolarHBondContact O-N 2.85Å; A226-F230 WeakPolarHBondContact O-CB 3.38Å; A226-F230 PolarHBondContact O-N 3.11Å
227	V	81.7	Confident	76	Confident	85 Å²	85	100.6 Å²	100.6	52%	0.515	58%	0.576	S	S	.	*	H	α-helix	trans	-65.4	-42.2	175.4	172.8	0	0	0	0	111.1	A223 G224 V225 I229 F230 L231	A223-V227 WeakPolarHBondContact O-CG2 3.27Å; A223-V227 PolarHBondContact O-N 3.47Å; G224-V227 PolarHBondContact O-N 2.97Å; V225-V227 PolarHBondContact O-N 3.5Å; V227-I229 PolarHBondContact O-N 2.82Å; V227-F230 PolarHBondContact O-N 3.37Å; V227-L231 HydrophobicContact CG1-CD1 3.82Å; V227-L231 HydrophobicContact CG1-CG 4.29Å; V227-L231 WeakPolarHBondContact O-CB 3.36Å; V227-L231 WeakPolarHBondContact O-CG 3.41Å; V227-L231 PolarHBondContact O-N 2.97Å
228	G	76.3	Confident	74.2	Confident	30 Å²	30	106.4 Å²	106.4	31%	0.309	62%	0.618	S	S	.	*	H	α-helix	trans	-59.8	-45.7	176	0	0	0	0	0	112.5	G224 V225 L231 C232	G224-G228 PolarHBondContact O-N 3.13Å; V225-G228 PolarHBondContact O-N 3.12Å; G228-L231 PolarHBondContact O-N 2.99Å; G228-C232 VanDerWaalsContact O-CB 3.27Å; G228-C232 WeakPolarHBondContact O-CB 3.44Å; G228-C232 PolarHBondContact O-N 3.1Å; G228-C232 PolarHBondContact O-SG 3.41Å
229	I	80.5	Confident	73.7	Confident	100 Å²	100	110.2 Å²	110.2	51%	0.513	63%	0.632	S	S	.	*	H	α-helix	trans	-61.7	-46.1	175	-66.7	166.9	0	0	0	110.2	V225 A226 V227 L231 C232 T233	V225-I229 HydrophobicContact CG1-CD1 3.8Å; V225-I229 HydrophobicContact CG1-CG1 4.41Å; V225-I229 VanDerWaalsContact O-CG1 3.31Å; V225-I229 WeakPolarHBondContact O-CG1 3.31Å; V225-I229 PolarHBondContact O-N 3.31Å; A226-I229 PolarHBondContact O-N 2.85Å; V227-I229 PolarHBondContact O-N 2.82Å; I229-L231 VanDerWaalsContact C-N 3.35Å; I229-L231 PolarHBondContact O-N 3.49Å; I229-C232 PolarHBondContact O-N 3.13Å; I229-T233 HydrophobicContact CG2-CG2 4.3Å; I229-T233 WeakPolarHBondContact O-CB 3.39Å; I229-T233 WeakPolarHBondContact O-CG2 3.45Å; I229-T233 PolarHBondContact O-N 2.89Å; I229-T233 PolarHBondContact O-OG1 2.86Å
230	F	75.1	Confident	73.2	Confident	145 Å²	145	113 Å²	113	64%	0.636	65%	0.645	S	S	*	*	H	α-helix	trans	-60.8	-41.8	179.8	-175	-97.2	0	0	0	112.4	A226 V227 G234	A226-F230 WeakPolarHBondContact O-CB 3.38Å; A226-F230 PolarHBondContact O-N 3.11Å; V227-F230 PolarHBondContact O-N 3.37Å; F230-G234 WeakPolarHBondContact O-CA 3.36Å; F230-G234 PolarHBondContact O-N 3.21Å
231	L	74.4	Confident	72.5	Confident	122 Å²	122	110.9 Å²	110.9	64%	0.639	64%	0.644	S	S	*	*	H	α-helix	trans	-70.8	-38.9	177	-68.4	172.7	0	0	0	112.5	V227 G228 I229	V227-L231 HydrophobicContact CG1-CD1 3.82Å; V227-L231 HydrophobicContact CG1-CG 4.29Å; V227-L231 WeakPolarHBondContact O-CB 3.36Å; V227-L231 WeakPolarHBondContact O-CG 3.41Å; V227-L231 PolarHBondContact O-N 2.97Å; G228-L231 PolarHBondContact O-N 2.99Å; I229-L231 VanDerWaalsContact C-N 3.35Å; I229-L231 PolarHBondContact O-N 3.49Å
232	C	69.8	Low	71.7	Confident	114 Å²	114	110.8 Å²	110.8	77%	0.77	65%	0.648	S	S	*	*	H	α-helix	trans	-74.1	-25.1	179.7	-70	0	0	0	0	113.4	G228 I229	G228-C232 VanDerWaalsContact O-CB 3.27Å; G228-C232 WeakPolarHBondContact O-CB 3.44Å; G228-C232 PolarHBondContact O-N 3.1Å; G228-C232 PolarHBondContact O-SG 3.41Å; I229-C232 PolarHBondContact O-N 3.13Å
233	T	68.3	Low	70.9	Confident	109 Å²	109	109.9 Å²	109.9	67%	0.669	65%	0.649	S	S	*	*	H	α-helix	trans	-110.1	-17.7	-176.9	61.2	0	0	0	0	114.2	I229	I229-T233 HydrophobicContact CG2-CG2 4.3Å; I229-T233 WeakPolarHBondContact O-CB 3.39Å; I229-T233 WeakPolarHBondContact O-CG2 3.45Å; I229-T233 PolarHBondContact O-N 2.89Å; I229-T233 PolarHBondContact O-OG1 2.86Å
234	G	62.1	Low	70.1	Confident	49 Å²	49	113.8 Å²	113.8	51%	0.505	66%	0.663	S	S	.	*	S	Bend	trans	-107.7	22.4	-171.2	0	0	0	0	0	115.8	F230	F230-G234 WeakPolarHBondContact O-CA 3.36Å; F230-G234 PolarHBondContact O-N 3.21Å
235	G	57.5	Low	69.3	Low	65 Å²	65	118.6 Å²	118.6	67%	0.67	68%	0.677	S	S	*	*			trans	-115.2	34.5	-176.7	0	0	0	0	0	115.5
236	R	56.6	Low	68.1	Low	248 Å²	248	121.2 Å²	121.2	94%	0.936	69%	0.689	S	S	*	*			trans	-115.7	83.2	161.4	-77	178.7	89.1	152.5	2.4	109
237	R	55.6	Low	66.9	Low	244 Å²	244	126.5 Å²	126.5	92%	0.921	71%	0.707	S	S	*	*			trans	-85.6	137.5	150	-72.8	-177.5	178.1	178.8	-0.5	106.7
238	C	45.3	Very low	65.6	Low	207 Å²	207	130.3 Å²	130.3	100%	1.399	72%	0.724	S	S	*	*			trans	-45.5	0	171.7	-61.2	0	0	0	0	112.5

Retrieved 238 of 238 residues in 198.3 ms (Link to these results)

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