A0A077S6N1_CAVPO Loading...

lysozyme

AlphaFold DB , UniProt , Accession A0A077S6N1, Species CAVPO (Cavia porcellus, Guinea pig), Gene LYZF1, Length 148 aa.

						>A0A077S6N1_CAVPO|A0A077S6N1|LYZF1
MKALLLLGLLILSVTVQGKVFKRCQLARTLKRLGMDGYHGISLANWTCLVRWESKYNTKATKYNPGNKGTNYGIFQINSRSWCEDGKTPGAVNGCGISCNVLLQNDITKAVACAKKVVKDPKGIKEWEAWKNHCQKQDVSQYLRGCQV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.2	Very low	52.4	Low	242 Å²	242	154.5 Å²	154.5	100%	1.192	84%	0.838	S	S	*	*				0	96.4	0	-69.3	179.1	-81.8	0	0	109.1
2	K	45.8	Very low	52.2	Low	219 Å²	219	154.4 Å²	154.4	95%	0.952	84%	0.835	S	S	*	*			trans	-135	68	165.8	-74.2	-173.3	178	-178.2	0	106
3	A	47.9	Very low	52.2	Low	80 Å²	80	149.7 Å²	149.7	66%	0.661	82%	0.821	S	S	*	*			trans	-76.2	130.4	175.7	0	0	0	0	0	108.6
4	L	55.8	Low	52.3	Low	151 Å²	151	147.4 Å²	147.4	79%	0.791	81%	0.813	S	S	*	*			trans	58.3	116.7	135.1	-54.2	160.9	0	0	0	114.4
5	L	52	Low	52.3	Low	149 Å²	149	145.3 Å²	145.3	78%	0.78	81%	0.806	S	S	*	*				-177.7	98.1	72.3	-77.4	161	0	0	0	107.3
6	L	52	Low	52.7	Low	183 Å²	183	141.1 Å²	141.1	96%	0.958	79%	0.786	S	S	*	*			trans	-107.3	44.4	159.7	-72.8	174.4	0	0	0	109.3
7	L	56.6	Low	53.9	Low	167 Å²	167	142.4 Å²	142.4	87%	0.874	78%	0.784	S	S	*	*			trans	-121.1	101.1	170	-105.6	96.2	0	0	0	108.5
8	G	54.6	Low	55.2	Low	71 Å²	71	136.1 Å²	136.1	73%	0.732	76%	0.757	S	S	*	*			trans	156.5	110	175.3	0	0	0	0	0	107.3
9	L	56.3	Low	57.3	Low	146 Å²	146	132.3 Å²	132.3	76%	0.764	73%	0.732	S	S	*	*			cis	-158.1	101.7	31.9	-163.2	75.7	0	0	0	105.9	I11	L9-I11 HydrophobicContact CB-CG1 4.43Å; L9-I11 HydrophobicContact CD2-CD1 4.02Å; L9-I11 HydrophobicContact CD2-CG1 3.61Å; L9-I11 HydrophobicContact CG-CG1 3.89Å; L9-I11 PolarHBondContact O-N 2.99Å
10	L	53.1	Low	59.3	Low	172 Å²	172	130.2 Å²	130.2	90%	0.901	72%	0.723	S	S	*	*			trans	-68.7	88.4	159.9	-104.5	145.8	0	0	0	105.3	L12	L10-L12 PolarHBondContact O-N 2.66Å
11	I	58.9	Low	61.2	Low	120 Å²	120	124.3 Å²	124.3	62%	0.615	69%	0.69	S	S	*	*			trans	-61.7	98.6	166.7	-58	174.8	0	0	0	104.4	L9 S13	L9-I11 HydrophobicContact CB-CG1 4.43Å; L9-I11 HydrophobicContact CD2-CD1 4.02Å; L9-I11 HydrophobicContact CD2-CG1 3.61Å; L9-I11 HydrophobicContact CG-CG1 3.89Å; L9-I11 PolarHBondContact O-N 2.99Å; I11-S13 PolarHBondContact O-N 3.09Å
12	L	50.7	Low	63.8	Low	153 Å²	153	120.8 Å²	120.8	80%	0.801	67%	0.668	S	S	*	*			trans	-60	87.1	161.6	-81.2	157.5	0	0	0	105.4	L10 V14	L10-L12 PolarHBondContact O-N 2.66Å; L12-V14 PolarHBondContact O-N 2.94Å
13	S	51.5	Low	66.3	Low	93 Å²	93	114.1 Å²	114.1	65%	0.65	64%	0.637	S	S	*	*			trans	-60.3	88.1	162	-56.6	0	0	0	0	104.9	I11 T15	I11-S13 PolarHBondContact O-N 3.09Å; S13-T15 PolarHBondContact O-N 2.95Å
14	V	53.9	Low	68.7	Low	117 Å²	117	111.4 Å²	111.4	71%	0.709	61%	0.613	S	S	*	*			trans	-63.2	93	167.3	-177.5	0	0	0	0	103.8	L12 V16	L12-V14 PolarHBondContact O-N 2.94Å; V14-V16 HydrophobicContact CG1-CG2 4.21Å; V14-V16 PolarHBondContact O-N 3.43Å
15	T	52.2	Low	70.7	Confident	116 Å²	116	107.7 Å²	107.7	71%	0.712	59%	0.591	S	S	*	*			trans	-62.6	98.3	167.1	47.1	0	0	0	0	104.1	S13 Q17	S13-T15 PolarHBondContact O-N 2.95Å; T15-Q17 PolarHBondContact O-N 3.18Å
16	V	58.5	Low	73	Confident	79 Å²	79	100.6 Å²	100.6	48%	0.479	55%	0.554	S	S	.	*			trans	-69.1	82.6	172.5	179.1	0	0	0	0	105.5	V14 G18 K59	V14-V16 HydrophobicContact CG1-CG2 4.21Å; V14-V16 PolarHBondContact O-N 3.43Å; V16-G18 PolarHBondContact O-N 2.05Å; V16-K59 VanDerWaalsContact O-CE 3.23Å; V16-K59 WeakPolarHBondContact O-CE 3.37Å
17	Q	72.9	Confident	75.2	Confident	163 Å²	163	91.9 Å²	91.9	76%	0.762	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-61.5	126.1	178.3	-158.9	164.3	0.1	0	0	107	T15 K19 N105	T15-Q17 PolarHBondContact O-N 3.18Å; Q17-K19 PolarHBondContact O-N 2.67Å; Q17-N105 PolarHBondContact O-ND2 2.95Å; Q17-N105 PolarHBondContact O-OD1 2.99Å
18	G	77.3	Confident	77.2	Confident	29 Å²	29	89.8 Å²	89.8	30%	0.299	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-62.6	131.7	-175.2	0	0	0	0	0	111.7	V16	V16-G18 PolarHBondContact O-N 2.05Å
19	K	94.8	Very high	79.3	Confident	64 Å²	64	87.2 Å²	87.2	28%	0.278	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-77.1	123.9	172.3	-178	173.8	179.2	-179.7	0	110.1	Q17 F21 T58 N105	Q17-K19 PolarHBondContact O-N 2.67Å; K19-F21 HydrophobicContact CD-CD2 3.95Å; K19-F21 HydrophobicContact CD-CE1 4.3Å; K19-F21 HydrophobicContact CD-CE2 3.52Å; K19-F21 HydrophobicContact CD-CZ 3.73Å; K19-F21 VanDerWaalsContact CE-CE1 3.46Å; K19-F21 VanDerWaalsContact CE-CZ 3.4Å; K19-F21 HydrophobicContact CG-CD2 3.9Å; K19-F21 HydrophobicContact CG-CE2 3.92Å; K19-F21 VanDerWaalsContact NZ-CZ 3.28Å; K19-T58 HydrophobicContact CB-CG2 4.26Å; K19-T58 PolarHBondContact N-OG1 3.23Å; K19-T58 WeakPolarHBondContact O-CG2 3.09Å; K19-T58 PolarHBondContact O-N 3.03Å; K19-T58 PolarHBondContact O-OG1 3.37Å; K19-N105 HydrophobicContact CB-CB 3.98Å; K19-N105 WeakPolarHBondContact CB-OD1 3.27Å; K19-N105 HydrophobicContact CD-CB 4.43Å; K19-N105 PolarHBondContact N-OD1 3.12Å
20	V	98.1	Very high	81.3	Confident	90 Å²	90	80.3 Å²	80.3	55%	0.545	42%	0.423	S	S	.	.	B	Isolated β-bridge	trans	-100.4	112.2	162.9	-176	0	0	0	0	107.8	Y56 N57	V20-Y56 WeakPolarHBondContact CA-O 3.09Å; V20-N57 HydrophobicContact CG2-CB 4.07Å
21	F	98.4	Very high	83.5	Confident	6 Å²	6	76 Å²	76	3%	0.026	40%	0.397	C	S	.	.			trans	-71.9	141.9	-179.9	-79.2	-106.5	0	0	0	111.4	K19 Q25 L26 T29 Y56 T58 I74 I107	K19-F21 HydrophobicContact CD-CD2 3.95Å; K19-F21 HydrophobicContact CD-CE1 4.3Å; K19-F21 HydrophobicContact CD-CE2 3.52Å; K19-F21 HydrophobicContact CD-CZ 3.73Å; K19-F21 VanDerWaalsContact CE-CE1 3.46Å; K19-F21 VanDerWaalsContact CE-CZ 3.4Å; K19-F21 HydrophobicContact CG-CD2 3.9Å; K19-F21 HydrophobicContact CG-CE2 3.92Å; K19-F21 VanDerWaalsContact NZ-CZ 3.28Å; F21-Q25 HydrophobicContact CD1-CB 4.38Å; F21-Q25 HydrophobicContact CD1-CG 3.93Å; F21-Q25 HydrophobicContact CE1-CG 4.41Å; F21-L26 HydrophobicContact CB-CB 3.89Å; F21-L26 HydrophobicContact CD1-CB 4.17Å; F21-L26 HydrophobicContact CD1-CD1 4.29Å; F21-L26 HydrophobicContact CG-CB 4.28Å; F21-L26 HydrophobicContact CG-CD1 4.27Å; F21-T29 HydrophobicContact CE1-CG2 4.27Å; F21-Y56 PolarHBondContact N-O 3.3Å; F21-Y56 VanDerWaalsContact O-CB 3.25Å; F21-Y56 WeakPolarHBondContact O-CB 3.23Å; F21-T58 HydrophobicContact CD2-CG2 4.1Å; F21-T58 HydrophobicContact CE2-CG2 3.69Å; F21-I74 HydrophobicContact CD2-CD1 3.84Å; F21-I74 HydrophobicContact CE2-CD1 4.09Å; F21-I107 HydrophobicContact CE2-CG2 3.82Å; F21-I107 HydrophobicContact CZ-CD1 4.2Å; F21-I107 HydrophobicContact CZ-CG1 4.38Å; F21-I107 HydrophobicContact CZ-CG2 4.1Å
22	K	98.4	Very high	85.4	Confident	169 Å²	169	80 Å²	80	74%	0.735	40%	0.404	S	S	*	.			trans	-69.7	146.1	159.5	-64.4	-176	-179.4	-179.1	0	109.1	C24 Q25 L26	K22-C24 PolarHBondContact O-N 2.88Å; K22-Q25 HydrophobicContact CB-CB 4.15Å; K22-Q25 WeakPolarHBondContact O-CA 3.02Å; K22-Q25 WeakPolarHBondContact O-CB 3.29Å; K22-Q25 PolarHBondContact O-N 2.94Å; K22-L26 PolarHBondContact O-N 2.82Å
23	R	98.4	Very high	87.7	Confident	79 Å²	79	74.6 Å²	74.6	30%	0.298	38%	0.376	S	S	.	.	H	α-helix	trans	-47.3	-55.2	-177.2	-178.4	175.9	61.5	80.4	-1.4	113.6	Q25 L26 A27 T47 Y56 Q141 Y142 R144 C146	R23-Q25 PolarHBondContact O-N 3.36Å; R23-L26 WeakPolarHBondContact O-CB 3.29Å; R23-L26 PolarHBondContact O-N 3.41Å; R23-A27 PolarHBondContact O-N 2.99Å; R23-T47 HydrophobicContact CG-CG2 4.23Å; R23-Y56 HydrophobicContact CB-CE2 4.42Å; R23-Q141 PolarHBondContact NH1-O 3.35Å; R23-Y142 VanDerWaalsContact CD-O 3.3Å; R23-Y142 WeakPolarHBondContact CD-O 3.46Å; R23-Y142 VanDerWaalsContact CG-O 3.31Å; R23-Y142 WeakPolarHBondContact CG-O 3.5Å; R23-Y142 VanDerWaalsContact NH1-C 3.29Å; R23-Y142 PolarHBondContact NH1-O 2.8Å; R23-R144 PolarHBondContact NH1-O 2.92Å; R23-R144 PolarHBondContact NH2-O 3.27Å; R23-C146 PolarHBondContact NH1-SG 2.99Å
24	C	98.7	Very high	90	Very high	23 Å²	23	71.9 Å²	71.9	16%	0.155	36%	0.363	C	S	.	.	H	α-helix	trans	-72.7	-26.7	-179.1	-62.8	0	0	0	0	114.1	K22 L26 R28 C146	K22-C24 PolarHBondContact O-N 2.88Å; C24-L26 VanDerWaalsContact C-N 3.34Å; C24-R28 PolarHBondContact O-N 2.9Å; C24-R28 VanDerWaalsContact O-N 3.09Å; C24-C146 WeakPolarHBondContact CA-SG 3.34Å; C24-C146 HydrophobicContact CB-CB 3.57Å; C24-C146 WeakPolarHBondContact CB-SG 3.49Å; C24-C146 WeakPolarHBondContact SG-CA 3.07Å; C24-C146 WeakPolarHBondContact SG-CB 3.21Å; C24-C146 CovalentContact SG-SG 2.05Å; C24-C146 PolarHBondContact SG-SG 3.36Å
25	Q	98.6	Very high	92.1	Very high	73 Å²	73	66.3 Å²	66.3	34%	0.341	33%	0.329	S	S	.	.	H	α-helix	trans	-64.9	-42.9	171.5	-173.9	-170.4	17.1	0	0	110.3	F21 K22 R23 T29	F21-Q25 HydrophobicContact CD1-CB 4.38Å; F21-Q25 HydrophobicContact CD1-CG 3.93Å; F21-Q25 HydrophobicContact CE1-CG 4.41Å; K22-Q25 HydrophobicContact CB-CB 4.15Å; K22-Q25 WeakPolarHBondContact O-CA 3.02Å; K22-Q25 WeakPolarHBondContact O-CB 3.29Å; K22-Q25 PolarHBondContact O-N 2.94Å; R23-Q25 PolarHBondContact O-N 3.36Å; Q25-T29 WeakPolarHBondContact O-CB 3.3Å; Q25-T29 PolarHBondContact O-N 3.34Å; Q25-T29 VanDerWaalsContact O-N 3.08Å; Q25-T29 PolarHBondContact O-OG1 2.89Å
26	L	98.7	Very high	94.3	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.5	-50.1	174.9	-179.6	65	0	0	0	111.2	F21 K22 R23 C24 R28 T29 L30 V50 Y56 I74 I107	F21-L26 HydrophobicContact CB-CB 3.89Å; F21-L26 HydrophobicContact CD1-CB 4.17Å; F21-L26 HydrophobicContact CD1-CD1 4.29Å; F21-L26 HydrophobicContact CG-CB 4.28Å; F21-L26 HydrophobicContact CG-CD1 4.27Å; K22-L26 PolarHBondContact O-N 2.82Å; R23-L26 WeakPolarHBondContact O-CB 3.29Å; R23-L26 PolarHBondContact O-N 3.41Å; C24-L26 VanDerWaalsContact C-N 3.34Å; L26-R28 VanDerWaalsContact C-N 3.35Å; L26-R28 PolarHBondContact O-N 3.08Å; L26-T29 CarbonylContact O-C 3.54Å; L26-T29 WeakPolarHBondContact O-CA 3.47Å; L26-T29 WeakPolarHBondContact O-CB 3.45Å; L26-T29 PolarHBondContact O-N 2.98Å; L26-L30 HydrophobicContact CD1-CD1 4.02Å; L26-L30 HydrophobicContact CD1-CD2 4.19Å; L26-L30 HydrophobicContact CD1-CG 3.85Å; L26-L30 HydrophobicContact CD2-CD1 4.24Å; L26-L30 HydrophobicContact CG-CD1 3.76Å; L26-L30 HydrophobicContact CG-CG 4.02Å; L26-L30 WeakPolarHBondContact O-CG 3.32Å; L26-L30 PolarHBondContact O-N 2.83Å; L26-V50 HydrophobicContact CD2-CB 3.74Å; L26-V50 HydrophobicContact CD2-CG1 3.46Å; L26-V50 VanDerWaalsContact CD2-CG1 3.46Å; L26-V50 HydrophobicContact CD2-CG2 4.2Å; L26-Y56 HydrophobicContact CD2-CD1 3.5Å; L26-Y56 VanDerWaalsContact CD2-CD1 3.5Å; L26-Y56 HydrophobicContact CD2-CE1 3.99Å; L26-Y56 HydrophobicContact CD2-CG 4.49Å; L26-I74 HydrophobicContact CD1-CD1 3.67Å; L26-I107 HydrophobicContact CD1-CD1 3.9Å
27	A	98.8	Very high	96.2	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-53.4	-49.4	-179.8	0	0	0	0	0	112.2	R23 T29 L30 K31 L143 C146 V148	R23-A27 PolarHBondContact O-N 2.99Å; A27-T29 VanDerWaalsContact C-N 3.33Å; A27-T29 PolarHBondContact O-N 3.26Å; A27-L30 PolarHBondContact O-N 2.75Å; A27-K31 WeakPolarHBondContact O-CB 3.41Å; A27-K31 PolarHBondContact O-N 2.75Å; A27-L143 HydrophobicContact CB-CD2 3.74Å; A27-C146 HydrophobicContact CB-CB 4.4Å; A27-V148 HydrophobicContact CB-CG2 4.26Å
28	R	98.8	Very high	97.5	Very high	122 Å²	122	57.1 Å²	57.1	46%	0.46	29%	0.285	S	S	.	.	H	α-helix	trans	-61.3	-39.9	175	-74.6	-174.8	-69.4	-95.1	9	112.7	C24 L26 R32 C146 V148	C24-R28 PolarHBondContact O-N 2.9Å; C24-R28 VanDerWaalsContact O-N 3.09Å; L26-R28 VanDerWaalsContact C-N 3.35Å; L26-R28 PolarHBondContact O-N 3.08Å; R28-R32 WeakPolarHBondContact O-CB 3.48Å; R28-R32 PolarHBondContact O-N 3.49Å; R28-C146 PolarHBondContact NH1-O 2.72Å; R28-V148 HydrophobicContact CB-CG1 4.28Å; R28-V148 HydrophobicContact CG-CG1 3.37Å
29	T	98.8	Very high	98.4	Very high	18 Å²	18	61 Å²	61	11%	0.11	30%	0.296	C	S	.	.	H	α-helix	trans	-64.2	-47.3	178	-56.7	0	0	0	0	111.2	F21 Q25 L26 A27 R32 L33 I107	F21-T29 HydrophobicContact CE1-CG2 4.27Å; Q25-T29 WeakPolarHBondContact O-CB 3.3Å; Q25-T29 PolarHBondContact O-N 3.34Å; Q25-T29 VanDerWaalsContact O-N 3.08Å; Q25-T29 PolarHBondContact O-OG1 2.89Å; L26-T29 CarbonylContact O-C 3.54Å; L26-T29 WeakPolarHBondContact O-CA 3.47Å; L26-T29 WeakPolarHBondContact O-CB 3.45Å; L26-T29 PolarHBondContact O-N 2.98Å; A27-T29 VanDerWaalsContact C-N 3.33Å; A27-T29 PolarHBondContact O-N 3.26Å; T29-R32 PolarHBondContact O-N 2.92Å; T29-L33 HydrophobicContact CG2-CD1 3.95Å; T29-L33 VanDerWaalsContact O-CG 3.3Å; T29-L33 WeakPolarHBondContact O-CG 3.38Å; T29-L33 PolarHBondContact O-N 2.71Å; T29-I107 HydrophobicContact CG2-CD1 3.82Å; T29-I107 HydrophobicContact CG2-CG1 4.05Å
30	L	98.9	Very high	98.6	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-64	-42	178.6	-67.1	177.7	0	0	0	111.7	L26 A27 L33 G34 M35 L43 W46 F75 I107 V111	L26-L30 HydrophobicContact CD1-CD1 4.02Å; L26-L30 HydrophobicContact CD1-CD2 4.19Å; L26-L30 HydrophobicContact CD1-CG 3.85Å; L26-L30 HydrophobicContact CD2-CD1 4.24Å; L26-L30 HydrophobicContact CG-CD1 3.76Å; L26-L30 HydrophobicContact CG-CG 4.02Å; L26-L30 WeakPolarHBondContact O-CG 3.32Å; L26-L30 PolarHBondContact O-N 2.83Å; A27-L30 PolarHBondContact O-N 2.75Å; L30-L33 CarbonylContact O-C 3.58Å; L30-L33 PolarHBondContact O-N 3.04Å; L30-G34 PolarHBondContact O-N 2.97Å; L30-M35 HydrophobicContact CB-CB 4.14Å; L30-M35 HydrophobicContact CB-CG 4.34Å; L30-M35 HydrophobicContact CD2-CG 4.23Å; L30-M35 VanDerWaalsContact O-CB 3.32Å; L30-M35 WeakPolarHBondContact O-CB 3.47Å; L30-M35 PolarHBondContact O-N 3.02Å; L30-L43 HydrophobicContact CB-CD1 3.6Å; L30-W46 HydrophobicContact CD1-CB 4.03Å; L30-F75 HydrophobicContact CD2-CE1 4.31Å; L30-F75 HydrophobicContact CD2-CZ 3.75Å; L30-I107 HydrophobicContact CD2-CD1 4.08Å; L30-V111 HydrophobicContact CD2-CG2 3.99Å
31	K	98.8	Very high	98.6	Very high	82 Å²	82	58 Å²	58	36%	0.357	30%	0.298	S	S	.	.	H	α-helix	trans	-59	-49.4	174.6	-168.2	175.1	-176.7	99.8	0	111.2	A27 L33 G34 D36 L43 V148	A27-K31 WeakPolarHBondContact O-CB 3.41Å; A27-K31 PolarHBondContact O-N 2.75Å; K31-L33 VanDerWaalsContact C-N 3.25Å; K31-L33 PolarHBondContact O-N 3.39Å; K31-G34 WeakPolarHBondContact O-CA 3.25Å; K31-G34 PolarHBondContact O-N 3.46Å; K31-D36 HydrophobicContact CG-CB 4.28Å; K31-D36 IonicContact NZ-OD2 2.81Å; K31-D36 PolarHBondContact NZ-OD2 3.13Å; K31-L43 HydrophobicContact CB-CD1 4.22Å; K31-L43 HydrophobicContact CB-CD2 3.83Å; K31-L43 HydrophobicContact CD-CD2 4.21Å; K31-L43 HydrophobicContact CG-CD2 4.26Å; K31-V148 HydrophobicContact CD-CB 3.91Å; K31-V148 HydrophobicContact CD-CG1 4.13Å; K31-V148 VanDerWaalsContact CE-OXT 3.27Å; K31-V148 WeakPolarHBondContact CE-OXT 3.4Å; K31-V148 PolarHBondContact NZ-OXT 3.46Å
32	R	98.8	Very high	98.6	Very high	203 Å²	203	59.8 Å²	59.8	77%	0.766	31%	0.311	S	S	*	.	H	α-helix	trans	-60	-34	177.1	-176.8	177.8	61.6	160	2	112.9	R28 T29 G34	R28-R32 WeakPolarHBondContact O-CB 3.48Å; R28-R32 PolarHBondContact O-N 3.49Å; T29-R32 PolarHBondContact O-N 2.92Å; R32-G34 PolarHBondContact O-N 2.75Å
33	L	98.8	Very high	98.7	Very high	40 Å²	40	51.8 Å²	51.8	21%	0.209	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	10.1	175.7	-64.3	173.1	0	0	0	113.2	T29 L30 K31 I107 T108 V111 K115	T29-L33 HydrophobicContact CG2-CD1 3.95Å; T29-L33 VanDerWaalsContact O-CG 3.3Å; T29-L33 WeakPolarHBondContact O-CG 3.38Å; T29-L33 PolarHBondContact O-N 2.71Å; L30-L33 CarbonylContact O-C 3.58Å; L30-L33 PolarHBondContact O-N 3.04Å; K31-L33 VanDerWaalsContact C-N 3.25Å; K31-L33 PolarHBondContact O-N 3.39Å; L33-I107 HydrophobicContact CD1-CD1 4.4Å; L33-I107 HydrophobicContact CD1-CG1 3.96Å; L33-T108 HydrophobicContact CD2-CG2 4.47Å; L33-V111 HydrophobicContact CB-CG1 4.04Å; L33-V111 HydrophobicContact CB-CG2 4.44Å; L33-V111 HydrophobicContact CD1-CB 4.24Å; L33-V111 HydrophobicContact CD1-CG2 3.72Å; L33-K115 PolarHBondContact O-NZ 3.4Å
34	G	98.8	Very high	98.7	Very high	37 Å²	37	48.5 Å²	48.5	38%	0.381	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.2	41.7	173.7	0	0	0	0	0	113.2	L30 K31 R32 K115	L30-G34 PolarHBondContact O-N 2.97Å; K31-G34 WeakPolarHBondContact O-CA 3.25Å; K31-G34 PolarHBondContact O-N 3.46Å; R32-G34 PolarHBondContact O-N 2.75Å; G34-K115 VanDerWaalsContact O-CE 3.24Å; G34-K115 WeakPolarHBondContact O-CE 3.42Å; G34-K115 PolarHBondContact O-NZ 3.14Å
35	M	98.8	Very high	98.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.266	C	S	.	.			trans	-92.1	-19.5	175.6	-67.1	-70.5	-85.7	0	0	112.9	L30 G37 Y38 W46 F75 V111 A114 K115	L30-M35 HydrophobicContact CB-CB 4.14Å; L30-M35 HydrophobicContact CB-CG 4.34Å; L30-M35 HydrophobicContact CD2-CG 4.23Å; L30-M35 VanDerWaalsContact O-CB 3.32Å; L30-M35 WeakPolarHBondContact O-CB 3.47Å; L30-M35 PolarHBondContact O-N 3.02Å; M35-G37 PolarHBondContact O-N 3.42Å; M35-Y38 PolarHBondContact O-N 3.4Å; M35-W46 HydrophobicContact CB-CG 4.33Å; M35-W46 HydrophobicContact CE-CD2 3.34Å; M35-W46 HydrophobicContact CE-CE3 3.5Å; M35-W46 HydrophobicContact CE-CG 3.95Å; M35-W46 HydrophobicContact CE-CH2 3.62Å; M35-W46 HydrophobicContact CE-CZ2 3.5Å; M35-W46 HydrophobicContact CE-CZ3 3.65Å; M35-W46 PolarHBondContact O-NE1 3.28Å; M35-W46 VanDerWaalsContact O-NE1 3.07Å; M35-W46 HydrophobicContact SD-CZ2 4.35Å; M35-F75 HydrophobicContact CE-CE1 4.43Å; M35-F75 HydrophobicContact CE-CZ 4.27Å; M35-V111 HydrophobicContact CE-CG1 4.5Å; M35-V111 HydrophobicContact CG-CG1 3.9Å; M35-V111 HydrophobicContact CG-CG2 4.47Å; M35-V111 HydrophobicContact SD-CG1 3.61Å; M35-A114 HydrophobicContact CE-CB 4.48Å; M35-K115 HydrophobicContact SD-CD 4.26Å; M35-K115 VanDerWaalsContact SD-CE 3.55Å; M35-K115 HydrophobicContact SD-CG 3.79Å
36	D	98.8	Very high	98.7	Very high	73 Å²	73	45.4 Å²	45.4	39%	0.39	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	112.8	-179.9	-163.5	10.4	0	0	0	110.7	K31 Y38 L43	K31-D36 HydrophobicContact CG-CB 4.28Å; K31-D36 IonicContact NZ-OD2 2.81Å; K31-D36 PolarHBondContact NZ-OD2 3.13Å; D36-Y38 VanDerWaalsContact C-N 3.28Å; D36-Y38 PolarHBondContact O-N 2.92Å; D36-L43 HydrophobicContact CB-CB 3.92Å; D36-L43 VanDerWaalsContact OD1-CB 3.3Å; D36-L43 WeakPolarHBondContact OD1-CB 3.4Å; D36-L43 PolarHBondContact OD1-N 2.84Å; D36-L43 VanDerWaalsContact OD1-N 3.15Å
37	G	98.6	Very high	98.7	Very high	44 Å²	44	45.4 Å²	45.4	45%	0.454	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	0.4	-177.2	0	0	0	0	0	115	M35 H39 G40 I41	M35-G37 PolarHBondContact O-N 3.42Å; G37-H39 PolarHBondContact O-N 3.18Å; G37-G40 PolarHBondContact O-N 2.79Å; G37-I41 CarbonylContact C-O 3.53Å; G37-I41 VanDerWaalsContact CA-O 3.27Å; G37-I41 WeakPolarHBondContact CA-O 3.28Å; G37-I41 PolarHBondContact N-O 2.83Å
38	Y	98.8	Very high	98.7	Very high	47 Å²	47	45.4 Å²	45.4	18%	0.184	25%	0.25	C	S	.	.	B	Isolated β-bridge	trans	-62.9	122.7	-178.2	-176	-93.8	0	0	0	110.9	M35 D36 G40 I41 K115 V118 K119	M35-Y38 PolarHBondContact O-N 3.4Å; D36-Y38 VanDerWaalsContact C-N 3.28Å; D36-Y38 PolarHBondContact O-N 2.92Å; Y38-G40 PolarHBondContact O-N 3.31Å; Y38-I41 PolarHBondContact N-O 3.44Å; Y38-I41 WeakPolarHBondContact O-CB 3.24Å; Y38-I41 PolarHBondContact O-N 2.96Å; Y38-I41 VanDerWaalsContact O-N 3.1Å; Y38-K115 HydrophobicContact CD1-CB 4.45Å; Y38-K115 HydrophobicContact CD1-CD 4.46Å; Y38-K115 HydrophobicContact CD1-CG 3.84Å; Y38-K115 HydrophobicContact CD2-CD 4.14Å; Y38-K115 HydrophobicContact CD2-CG 4.4Å; Y38-K115 HydrophobicContact CE1-CB 3.61Å; Y38-K115 HydrophobicContact CE1-CD 4.14Å; Y38-K115 HydrophobicContact CE1-CG 3.47Å; Y38-K115 VanDerWaalsContact CE1-CG 3.47Å; Y38-K115 WeakPolarHBondContact CE1-O 3.38Å; Y38-K115 HydrophobicContact CE2-CB 4.49Å; Y38-K115 HydrophobicContact CE2-CD 3.79Å; Y38-K115 HydrophobicContact CE2-CG 4.08Å; Y38-K115 HydrophobicContact CG-CD 4.45Å; Y38-K115 HydrophobicContact CG-CG 4.29Å; Y38-K115 WeakPolarHBondContact OH-CB 3.3Å; Y38-K115 PolarHBondContact OH-O 3.17Å; Y38-K115 VanDerWaalsContact OH-O 3.07Å; Y38-V118 HydrophobicContact CD1-CG2 3.86Å; Y38-V118 HydrophobicContact CE1-CG2 3.59Å; Y38-K119 WeakPolarHBondContact OH-CE 3.34Å
39	H	97.8	Very high	98.7	Very high	111 Å²	111	39.6 Å²	39.6	51%	0.514	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	35.4	-171.9	-84.5	-96.1	0	0	0	113.6	G37 I41 V118 K119	G37-H39 PolarHBondContact O-N 3.18Å; H39-I41 HydrophobicContact CB-CD1 4.5Å; H39-I41 PolarHBondContact O-N 3.35Å; H39-V118 HydrophobicContact CB-CG2 4.32Å; H39-K119 WeakPolarHBondContact NE2-CE 3.32Å; H39-K119 VanDerWaalsContact NE2-CG 3.33Å; H39-K119 WeakPolarHBondContact NE2-CG 3.31Å
40	G	98	Very high	98.7	Very high	78 Å²	78	38.7 Å²	38.7	80%	0.804	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.4	10	179.4	0	0	0	0	0	114.3	G37 Y38	G37-G40 PolarHBondContact O-N 2.79Å; Y38-G40 PolarHBondContact O-N 3.31Å
41	I	98.8	Very high	98.7	Very high	13 Å²	13	44 Å²	44	7%	0.067	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-99	117.5	-178.8	-57.7	157.3	0	0	0	109.3	G37 Y38 H39 N45 W46 V118 I124	G37-I41 CarbonylContact C-O 3.53Å; G37-I41 VanDerWaalsContact CA-O 3.27Å; G37-I41 WeakPolarHBondContact CA-O 3.28Å; G37-I41 PolarHBondContact N-O 2.83Å; Y38-I41 PolarHBondContact N-O 3.44Å; Y38-I41 WeakPolarHBondContact O-CB 3.24Å; Y38-I41 PolarHBondContact O-N 2.96Å; Y38-I41 VanDerWaalsContact O-N 3.1Å; H39-I41 HydrophobicContact CB-CD1 4.5Å; H39-I41 PolarHBondContact O-N 3.35Å; I41-N45 HydrophobicContact CG2-CB 3.71Å; I41-W46 HydrophobicContact CB-CZ2 4.37Å; I41-W46 HydrophobicContact CD1-CH2 4.36Å; I41-W46 HydrophobicContact CD1-CZ2 3.73Å; I41-W46 HydrophobicContact CG2-CD2 4.07Å; I41-W46 HydrophobicContact CG2-CG 4.15Å; I41-W46 HydrophobicContact CG2-CZ2 4.22Å; I41-V118 HydrophobicContact CD1-CB 3.87Å; I41-V118 HydrophobicContact CD1-CG1 3.67Å; I41-V118 HydrophobicContact CD1-CG2 4.23Å; I41-I124 HydrophobicContact CD1-CB 3.8Å; I41-I124 HydrophobicContact CD1-CD1 4.35Å; I41-I124 HydrophobicContact CD1-CG2 4.38Å; I41-I124 HydrophobicContact CG1-CB 4.24Å; I41-I124 HydrophobicContact CG1-CD1 4.46Å; I41-I124 HydrophobicContact CG1-CG2 4.33Å; I41-I124 HydrophobicContact CG2-CD1 3.51Å
42	S	98.8	Very high	98.7	Very high	44 Å²	44	45.7 Å²	45.7	31%	0.308	25%	0.247	S	C	.	.			trans	-68.4	155.8	179.6	68.6	0	0	0	0	113.2	A44 N45 W46	S42-A44 PolarHBondContact O-N 2.89Å; S42-N45 WeakPolarHBondContact O-CB 3.27Å; S42-N45 PolarHBondContact O-N 2.99Å; S42-N45 PolarHBondContact OG-ND2 3.03Å; S42-W46 PolarHBondContact O-N 3.38Å
43	L	98.9	Very high	98.7	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-55.6	-33.8	175.3	-176.3	64.1	0	0	0	113.7	L30 K31 D36 W46 T47 L143 V148	L30-L43 HydrophobicContact CB-CD1 3.6Å; K31-L43 HydrophobicContact CB-CD1 4.22Å; K31-L43 HydrophobicContact CB-CD2 3.83Å; K31-L43 HydrophobicContact CD-CD2 4.21Å; K31-L43 HydrophobicContact CG-CD2 4.26Å; D36-L43 HydrophobicContact CB-CB 3.92Å; D36-L43 VanDerWaalsContact OD1-CB 3.3Å; D36-L43 WeakPolarHBondContact OD1-CB 3.4Å; D36-L43 PolarHBondContact OD1-N 2.84Å; D36-L43 VanDerWaalsContact OD1-N 3.15Å; L43-W46 PolarHBondContact O-N 3.27Å; L43-T47 PolarHBondContact O-N 2.99Å; L43-T47 PolarHBondContact O-OG1 3.07Å; L43-L143 HydrophobicContact CB-CD1 4.12Å; L43-L143 HydrophobicContact CD2-CD1 4.17Å; L43-L143 HydrophobicContact CD2-CD2 4.18Å; L43-L143 HydrophobicContact CG-CD1 4.2Å; L43-L143 HydrophobicContact CG-CD2 4.03Å; L43-V148 HydrophobicContact CD2-CB 3.99Å; L43-V148 HydrophobicContact CD2-CG2 3.83Å
44	A	98.8	Very high	98.7	Very high	9 Å²	9	36.2 Å²	36.2	7%	0.074	21%	0.211	C	C	.	.	H	α-helix	trans	-64.3	-40.6	177.2	0	0	0	0	0	111.9	S42 T47 C48 V139 L143	S42-A44 PolarHBondContact O-N 2.89Å; A44-T47 PolarHBondContact O-N 3.21Å; A44-C48 WeakPolarHBondContact O-CB 3.49Å; A44-C48 PolarHBondContact O-N 2.81Å; A44-V139 HydrophobicContact CB-CB 4.07Å; A44-V139 HydrophobicContact CB-CG2 3.64Å; A44-L143 HydrophobicContact CB-CD1 3.8Å; A44-L143 HydrophobicContact CB-CG 3.92Å
45	N	98.9	Very high	98.7	Very high	31 Å²	31	41.9 Å²	41.9	17%	0.166	23%	0.226	C	C	.	.	H	α-helix	trans	-63.2	-44.6	175.8	-85.5	-71.5	0	0	0	111.9	I41 S42 T47 C48 L49 I124 W130	I41-N45 HydrophobicContact CG2-CB 3.71Å; S42-N45 WeakPolarHBondContact O-CB 3.27Å; S42-N45 PolarHBondContact O-N 2.99Å; S42-N45 PolarHBondContact OG-ND2 3.03Å; N45-T47 VanDerWaalsContact C-N 3.33Å; N45-T47 PolarHBondContact O-N 2.94Å; N45-C48 PolarHBondContact O-N 3.12Å; N45-L49 WeakPolarHBondContact O-CB 3.4Å; N45-L49 PolarHBondContact O-N 3.18Å; N45-I124 HydrophobicContact CB-CD1 4.27Å; N45-W130 PolarHBondContact OD1-NE1 3.42Å
46	W	98.9	Very high	98.7	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61.7	-41.3	175.3	-72.2	117.3	0	0	0	112.8	L30 M35 I41 S42 L43 L49 V50 F75 A114 V118 W127	L30-W46 HydrophobicContact CD1-CB 4.03Å; M35-W46 HydrophobicContact CB-CG 4.33Å; M35-W46 HydrophobicContact CE-CD2 3.34Å; M35-W46 HydrophobicContact CE-CE3 3.5Å; M35-W46 HydrophobicContact CE-CG 3.95Å; M35-W46 HydrophobicContact CE-CH2 3.62Å; M35-W46 HydrophobicContact CE-CZ2 3.5Å; M35-W46 HydrophobicContact CE-CZ3 3.65Å; M35-W46 PolarHBondContact O-NE1 3.28Å; M35-W46 VanDerWaalsContact O-NE1 3.07Å; M35-W46 HydrophobicContact SD-CZ2 4.35Å; I41-W46 HydrophobicContact CB-CZ2 4.37Å; I41-W46 HydrophobicContact CD1-CH2 4.36Å; I41-W46 HydrophobicContact CD1-CZ2 3.73Å; I41-W46 HydrophobicContact CG2-CD2 4.07Å; I41-W46 HydrophobicContact CG2-CG 4.15Å; I41-W46 HydrophobicContact CG2-CZ2 4.22Å; S42-W46 PolarHBondContact O-N 3.38Å; L43-W46 PolarHBondContact O-N 3.27Å; W46-L49 HydrophobicContact CE3-CD1 4.17Å; W46-L49 HydrophobicContact CZ3-CD1 4.14Å; W46-L49 PolarHBondContact O-N 3.49Å; W46-V50 WeakPolarHBondContact O-CG2 3.42Å; W46-V50 PolarHBondContact O-N 3.27Å; W46-V50 VanDerWaalsContact O-N 3.1Å; W46-F75 HydrophobicContact CE3-CE1 4.33Å; W46-A114 HydrophobicContact CH2-CB 4.41Å; W46-A114 HydrophobicContact CZ3-CB 4.32Å; W46-V118 HydrophobicContact CH2-CB 4.45Å; W46-V118 HydrophobicContact CH2-CG1 3.41Å; W46-V118 VanDerWaalsContact CH2-CG1 3.41Å; W46-V118 HydrophobicContact CH2-CG2 4.25Å; W46-V118 HydrophobicContact CZ2-CG1 3.94Å; W46-V118 HydrophobicContact CZ2-CG2 4.22Å; W46-V118 HydrophobicContact CZ3-CG1 4.38Å; W46-W127 HydrophobicContact CZ3-CH2 4.38Å
47	T	98.8	Very high	98.7	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-68.7	-37.8	179	-51.6	0	0	0	0	111.5	R23 L43 A44 N45 R51	R23-T47 HydrophobicContact CG-CG2 4.23Å; L43-T47 PolarHBondContact O-N 2.99Å; L43-T47 PolarHBondContact O-OG1 3.07Å; A44-T47 PolarHBondContact O-N 3.21Å; N45-T47 VanDerWaalsContact C-N 3.33Å; N45-T47 PolarHBondContact O-N 2.94Å; T47-R51 PolarHBondContact O-N 2.75Å
48	C	98.9	Very high	98.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-62.3	-49.5	172.4	-176.2	0	0	0	0	111.8	A44 N45 V50 R51 W52 C134 V139 Y142	A44-C48 WeakPolarHBondContact O-CB 3.49Å; A44-C48 PolarHBondContact O-N 2.81Å; N45-C48 PolarHBondContact O-N 3.12Å; C48-V50 VanDerWaalsContact C-N 3.34Å; C48-V50 PolarHBondContact O-N 3.05Å; C48-R51 WeakPolarHBondContact O-CB 3.21Å; C48-R51 PolarHBondContact O-N 2.85Å; C48-R51 VanDerWaalsContact O-N 3.12Å; C48-W52 VanDerWaalsContact O-CD1 3.26Å; C48-W52 PolarHBondContact O-N 3.45Å; C48-C134 HydrophobicContact CB-CB 3.87Å; C48-C134 WeakPolarHBondContact CB-SG 3.5Å; C48-C134 VanDerWaalsContact SG-CA 3.53Å; C48-C134 WeakPolarHBondContact SG-CB 3.37Å; C48-C134 CovalentContact SG-SG 2.03Å; C48-C134 PolarHBondContact SG-SG 3.36Å; C48-V139 HydrophobicContact CB-CB 4.49Å; C48-V139 HydrophobicContact CB-CG1 4Å; C48-Y142 HydrophobicContact CB-CD1 4.29Å; C48-Y142 HydrophobicContact CB-CD2 3.52Å; C48-Y142 HydrophobicContact CB-CE1 4.22Å; C48-Y142 HydrophobicContact CB-CE2 3.47Å; C48-Y142 VanDerWaalsContact CB-CE2 3.47Å; C48-Y142 HydrophobicContact CB-CG 3.96Å; C48-Y142 WeakPolarHBondContact SG-CE2 3.49Å
49	L	98.8	Very high	98.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-53	-52.4	177.8	-179.6	161.9	0	0	0	110.7	N45 W46 R51 W52 E53 F75 I124 W127 W130	N45-L49 WeakPolarHBondContact O-CB 3.4Å; N45-L49 PolarHBondContact O-N 3.18Å; W46-L49 HydrophobicContact CE3-CD1 4.17Å; W46-L49 HydrophobicContact CZ3-CD1 4.14Å; W46-L49 PolarHBondContact O-N 3.49Å; L49-R51 VanDerWaalsContact C-N 3.28Å; L49-R51 PolarHBondContact O-N 2.99Å; L49-W52 PolarHBondContact O-N 3.32Å; L49-W52 VanDerWaalsContact O-N 3.16Å; L49-E53 HydrophobicContact CD2-CB 4.45Å; L49-E53 HydrophobicContact CD2-CG 3.81Å; L49-E53 HydrophobicContact CG-CG 4.24Å; L49-E53 WeakPolarHBondContact O-CB 3.3Å; L49-E53 WeakPolarHBondContact O-CG 3.49Å; L49-E53 PolarHBondContact O-N 3.15Å; L49-F75 HydrophobicContact CD2-CD1 3.99Å; L49-I124 HydrophobicContact CD1-CD1 3.86Å; L49-I124 HydrophobicContact CD1-CG1 3.79Å; L49-W127 HydrophobicContact CD1-CB 3.99Å; L49-W127 HydrophobicContact CD1-CD2 3.69Å; L49-W127 HydrophobicContact CD1-CE3 4Å; L49-W127 HydrophobicContact CD1-CG 3.71Å; L49-W127 HydrophobicContact CD2-CG 4.35Å; L49-W127 HydrophobicContact CG-CB 4.29Å; L49-W127 HydrophobicContact CG-CG 4.11Å; L49-W130 HydrophobicContact CB-CB 4.33Å; L49-W130 HydrophobicContact CD1-CB 4.2Å; L49-W130 HydrophobicContact CG-CB 4.22Å
50	V	98.8	Very high	98.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-62.9	-34.5	-178.3	176.2	0	0	0	0	112.4	L26 W46 C48 W52 S54 K55 Y56 I74 F75	L26-V50 HydrophobicContact CD2-CB 3.74Å; L26-V50 HydrophobicContact CD2-CG1 3.46Å; L26-V50 VanDerWaalsContact CD2-CG1 3.46Å; L26-V50 HydrophobicContact CD2-CG2 4.2Å; W46-V50 WeakPolarHBondContact O-CG2 3.42Å; W46-V50 PolarHBondContact O-N 3.27Å; W46-V50 VanDerWaalsContact O-N 3.1Å; C48-V50 VanDerWaalsContact C-N 3.34Å; C48-V50 PolarHBondContact O-N 3.05Å; V50-W52 VanDerWaalsContact C-N 3.33Å; V50-W52 PolarHBondContact O-N 2.84Å; V50-S54 PolarHBondContact O-N 3.05Å; V50-S54 VanDerWaalsContact O-N 3.11Å; V50-S54 PolarHBondContact O-OG 3.17Å; V50-K55 PolarHBondContact O-N 2.81Å; V50-Y56 HydrophobicContact CB-CD1 4.41Å; V50-Y56 HydrophobicContact CG1-CD1 3.79Å; V50-Y56 PolarHBondContact O-N 2.93Å; V50-I74 HydrophobicContact CG1-CD1 3.93Å; V50-I74 HydrophobicContact CG1-CG1 3.33Å; V50-I74 HydrophobicContact CG2-CG1 4.36Å; V50-F75 HydrophobicContact CG2-CD1 3.53Å; V50-F75 HydrophobicContact CG2-CE1 3.37Å; V50-F75 HydrophobicContact CG2-CZ 4.36Å
51	R	98.8	Very high	98.6	Very high	111 Å²	111	36.3 Å²	36.3	42%	0.419	18%	0.175	S	C	.	.	H	α-helix	trans	-58	-48.4	175.6	172.1	56.8	173.7	-163.8	-2.3	111	T47 C48 L49 K55 Y56 Y142	T47-R51 PolarHBondContact O-N 2.75Å; C48-R51 WeakPolarHBondContact O-CB 3.21Å; C48-R51 PolarHBondContact O-N 2.85Å; C48-R51 VanDerWaalsContact O-N 3.12Å; L49-R51 VanDerWaalsContact C-N 3.28Å; L49-R51 PolarHBondContact O-N 2.99Å; R51-K55 VanDerWaalsContact O-CA 3.27Å; R51-K55 WeakPolarHBondContact O-CA 3.06Å; R51-K55 PolarHBondContact O-N 3.27Å; R51-K55 VanDerWaalsContact O-N 3.08Å; R51-Y56 HydrophobicContact CB-CE1 3.69Å; R51-Y142 HydrophobicContact CB-CD1 4.39Å; R51-Y142 HydrophobicContact CB-CE1 3.88Å; R51-Y142 HydrophobicContact CG-CE1 3.96Å
52	W	98.7	Very high	98.6	Very high	117 Å²	117	42.4 Å²	42.4	44%	0.443	20%	0.201	S	C	.	.	H	α-helix	trans	-83.1	-27.9	-172.7	-69.9	104.4	0	0	0	113.5	C48 L49 V50 A129 H133 Y142	C48-W52 VanDerWaalsContact O-CD1 3.26Å; C48-W52 PolarHBondContact O-N 3.45Å; L49-W52 PolarHBondContact O-N 3.32Å; L49-W52 VanDerWaalsContact O-N 3.16Å; V50-W52 VanDerWaalsContact C-N 3.33Å; V50-W52 PolarHBondContact O-N 2.84Å; W52-A129 HydrophobicContact CB-CB 3.93Å; W52-H133 HydrophobicContact CB-CB 4.31Å; W52-H133 HydrophobicContact CD2-CB 3.58Å; W52-H133 AromaticContact CD2-CD2 3.61Å; W52-H133 AromaticContact CD2-CG 3.42Å; W52-H133 VanDerWaalsContact CD2-CG 3.42Å; W52-H133 AromaticContact CD2-ND1 3.88Å; W52-H133 AromaticContact CE2-CG 3.71Å; W52-H133 AromaticContact CE2-ND1 3.99Å; W52-H133 HydrophobicContact CE3-CB 4.33Å; W52-H133 AromaticContact CE3-CD2 3.59Å; W52-H133 AromaticContact CE3-CE1 3.76Å; W52-H133 AromaticContact CE3-CG 3.66Å; W52-H133 AromaticContact CE3-ND1 3.77Å; W52-H133 AromaticContact CE3-NE2 3.66Å; W52-H133 HydrophobicContact CG-CB 3.52Å; W52-H133 AromaticContact CG-CD2 3.76Å; W52-H133 AromaticContact CG-CG 3.72Å; W52-H133 AromaticContact CH2-ND1 3.88Å; W52-H133 HydrophobicContact CZ2-CB 4.23Å; W52-H133 AromaticContact CZ2-ND1 4Å; W52-H133 AromaticContact CZ3-CE1 3.71Å; W52-H133 AromaticContact CZ3-ND1 3.77Å; W52-Y142 AromaticContact NE1-CZ 3.94Å; W52-Y142 PolarHBondContact NE1-OH 3.08Å
53	E	98.5	Very high	98.6	Very high	35 Å²	35	46.5 Å²	46.5	16%	0.164	21%	0.211	C	C	.	.	H	α-helix	trans	-75.5	-50.1	176.7	-74.1	-62	169.5	0	0	112.4	L49 Q76 A129	L49-E53 HydrophobicContact CD2-CB 4.45Å; L49-E53 HydrophobicContact CD2-CG 3.81Å; L49-E53 HydrophobicContact CG-CG 4.24Å; L49-E53 WeakPolarHBondContact O-CB 3.3Å; L49-E53 WeakPolarHBondContact O-CG 3.49Å; L49-E53 PolarHBondContact O-N 3.15Å; E53-Q76 HydrophobicContact CB-CB 3.98Å; E53-Q76 HydrophobicContact CB-CG 3.67Å; E53-Q76 HydrophobicContact CG-CB 4.3Å; E53-Q76 HydrophobicContact CG-CG 4.48Å; E53-Q76 VanDerWaalsContact O-CG 3.27Å; E53-Q76 WeakPolarHBondContact O-CG 3.33Å; E53-Q76 VanDerWaalsContact OE2-CB 3.25Å; E53-Q76 WeakPolarHBondContact OE2-CB 3.39Å; E53-Q76 WeakPolarHBondContact OE2-CG 3.23Å; E53-A129 HydrophobicContact CG-CB 4.07Å; E53-A129 WeakPolarHBondContact OE1-CB 3.29Å
54	S	98.6	Very high	98.3	Very high	9 Å²	9	49.4 Å²	49.4	6%	0.063	23%	0.226	C	C	.	.	H	α-helix	trans	-129.5	-1	-167.6	65.8	0	0	0	0	114.9	V50 Y56 N57 I74	V50-S54 PolarHBondContact O-N 3.05Å; V50-S54 VanDerWaalsContact O-N 3.11Å; V50-S54 PolarHBondContact O-OG 3.17Å; S54-Y56 PolarHBondContact O-N 3.34Å; S54-Y56 PolarHBondContact OG-N 3.03Å; S54-N57 VanDerWaalsContact O-CB 3.23Å; S54-N57 WeakPolarHBondContact O-CB 3.5Å; S54-N57 PolarHBondContact O-N 2.84Å; S54-I74 WeakPolarHBondContact CB-O 3.48Å; S54-I74 PolarHBondContact OG-O 3.02Å
55	K	98.6	Very high	98	Very high	157 Å²	157	53.5 Å²	53.5	68%	0.683	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	37.5	-167.4	-57.4	178.1	-178.1	177.5	0	111.7	V50 R51 N57	V50-K55 PolarHBondContact O-N 2.81Å; R51-K55 VanDerWaalsContact O-CA 3.27Å; R51-K55 WeakPolarHBondContact O-CA 3.06Å; R51-K55 PolarHBondContact O-N 3.27Å; R51-K55 VanDerWaalsContact O-N 3.08Å; K55-N57 VanDerWaalsContact C-N 3.26Å; K55-N57 PolarHBondContact O-N 2.93Å
56	Y	98.6	Very high	97.7	Very high	18 Å²	18	55.6 Å²	55.6	7%	0.071	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	68	14	-178	-39.4	-62.5	0	0	0	115.7	V20 F21 R23 L26 V50 R51 S54	V20-Y56 WeakPolarHBondContact CA-O 3.09Å; F21-Y56 PolarHBondContact N-O 3.3Å; F21-Y56 VanDerWaalsContact O-CB 3.25Å; F21-Y56 WeakPolarHBondContact O-CB 3.23Å; R23-Y56 HydrophobicContact CB-CE2 4.42Å; L26-Y56 HydrophobicContact CD2-CD1 3.5Å; L26-Y56 VanDerWaalsContact CD2-CD1 3.5Å; L26-Y56 HydrophobicContact CD2-CE1 3.99Å; L26-Y56 HydrophobicContact CD2-CG 4.49Å; V50-Y56 HydrophobicContact CB-CD1 4.41Å; V50-Y56 HydrophobicContact CG1-CD1 3.79Å; V50-Y56 PolarHBondContact O-N 2.93Å; R51-Y56 HydrophobicContact CB-CE1 3.69Å; S54-Y56 PolarHBondContact O-N 3.34Å; S54-Y56 PolarHBondContact OG-N 3.03Å
57	N	98.6	Very high	97.4	Very high	49 Å²	49	57.8 Å²	57.8	26%	0.262	29%	0.293	S	S	.	.	B	Isolated β-bridge	trans	-90.9	118.6	-177.3	-175.3	-0.3	0	0	0	112.1	V20 S54 K55 K59 A60	V20-N57 HydrophobicContact CG2-CB 4.07Å; S54-N57 VanDerWaalsContact O-CB 3.23Å; S54-N57 WeakPolarHBondContact O-CB 3.5Å; S54-N57 PolarHBondContact O-N 2.84Å; K55-N57 VanDerWaalsContact C-N 3.26Å; K55-N57 PolarHBondContact O-N 2.93Å; N57-K59 VanDerWaalsContact C-N 3.25Å; N57-K59 PolarHBondContact O-N 3.1Å; N57-K59 PolarHBondContact OD1-N 2.91Å; N57-A60 HydrophobicContact CB-CB 4.27Å; N57-A60 WeakPolarHBondContact O-CB 3.23Å; N57-A60 PolarHBondContact O-N 2.72Å
58	T	98.6	Very high	97.2	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-19.8	177	53.3	0	0	0	0	114.3	K19 F21 G73 I74 L103 N105 I107	K19-T58 HydrophobicContact CB-CG2 4.26Å; K19-T58 PolarHBondContact N-OG1 3.23Å; K19-T58 WeakPolarHBondContact O-CG2 3.09Å; K19-T58 PolarHBondContact O-N 3.03Å; K19-T58 PolarHBondContact O-OG1 3.37Å; F21-T58 HydrophobicContact CD2-CG2 4.1Å; F21-T58 HydrophobicContact CE2-CG2 3.69Å; T58-G73 WeakPolarHBondContact O-CA 3.34Å; T58-I74 HydrophobicContact CG2-CB 4.39Å; T58-I74 HydrophobicContact CG2-CD1 4.25Å; T58-L103 WeakPolarHBondContact O-CA 3.36Å; T58-N105 PolarHBondContact OG1-OD1 3.3Å; T58-I107 HydrophobicContact CG2-CG2 3.72Å
59	K	97.8	Very high	97.2	Very high	67 Å²	67	63.7 Å²	63.7	29%	0.291	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	6.7	178.2	-66.2	-66.1	-171.7	-176.1	0	113.9	V16 N57 T61 L103	V16-K59 VanDerWaalsContact O-CE 3.23Å; V16-K59 WeakPolarHBondContact O-CE 3.37Å; N57-K59 VanDerWaalsContact C-N 3.25Å; N57-K59 PolarHBondContact O-N 3.1Å; N57-K59 PolarHBondContact OD1-N 2.91Å; K59-T61 PolarHBondContact O-N 3.03Å; K59-L103 HydrophobicContact CD-CB 3.98Å; K59-L103 WeakPolarHBondContact CD-O 3.41Å; K59-L103 WeakPolarHBondContact CE-O 3.25Å; K59-L103 PolarHBondContact NZ-O 3.43Å
60	A	98.3	Very high	97.2	Very high	19 Å²	19	64.1 Å²	64.1	16%	0.157	32%	0.321	C	S	.	.			trans	-61.9	130.5	-179.9	0	0	0	0	0	110.9	N57 G73 Q76	N57-A60 HydrophobicContact CB-CB 4.27Å; N57-A60 WeakPolarHBondContact O-CB 3.23Å; N57-A60 PolarHBondContact O-N 2.72Å; A60-G73 PolarHBondContact O-N 3.1Å; A60-Q76 PolarHBondContact O-NE2 3.43Å
61	T	98.3	Very high	97.1	Very high	82 Å²	82	65.3 Å²	65.3	50%	0.503	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	141.2	172	56.5	0	0	0	0	110.3	K59 N71 Y72 L103	K59-T61 PolarHBondContact O-N 3.03Å; T61-N71 VanDerWaalsContact CA-O 3.23Å; T61-N71 WeakPolarHBondContact CA-O 3.44Å; T61-Y72 HydrophobicContact CG2-CD1 3.94Å; T61-Y72 HydrophobicContact CG2-CE1 4.21Å; T61-L103 HydrophobicContact CG2-CD1 4.32Å; T61-L103 HydrophobicContact CG2-CD2 3.79Å
62	K	98.1	Very high	97.2	Very high	141 Å²	141	60.7 Å²	60.7	61%	0.613	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.4	116.9	177.1	-177.5	-179.4	177.2	-176.5	0	110.4	N71	K62-N71 HydrophobicContact CB-CB 4.34Å; K62-N71 PolarHBondContact N-O 3.29Å; K62-N71 PolarHBondContact O-N 2.92Å
63	Y	97.9	Very high	97.1	Very high	130 Å²	130	55.1 Å²	55.1	51%	0.51	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	139.1	173	-179.9	-112.4	0	0	0	110.5	P65	Y63-P65 HydrophobicContact CD1-CG 4.01Å; Y63-P65 HydrophobicContact CE1-CB 4.18Å; Y63-P65 HydrophobicContact CE1-CG 3.91Å
64	N	93.8	Very high	97.2	Very high	62 Å²	62	53.5 Å²	53.5	33%	0.332	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	102.1	176.7	-174	-20.2	0	0	0	109.8	G66 N67 K68 G69	N64-G66 PolarHBondContact O-N 3.07Å; N64-G66 PolarHBondContact OD1-N 3.23Å; N64-N67 WeakPolarHBondContact CB-OD1 3.47Å; N64-N67 PolarHBondContact O-N 3.05Å; N64-N67 PolarHBondContact O-OD1 3.33Å; N64-K68 WeakPolarHBondContact O-CA 3.44Å; N64-K68 PolarHBondContact O-N 3.4Å; N64-G69 WeakPolarHBondContact CA-O 3.33Å; N64-G69 WeakPolarHBondContact CB-O 3.48Å; N64-G69 PolarHBondContact N-O 3.27Å
65	P	92.6	Very high	97.2	Very high	95 Å²	95	53.1 Å²	53.1	62%	0.617	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-31.3	179.6	-24.5	33.7	0	0	0	114	Y63 N67	Y63-P65 HydrophobicContact CD1-CG 4.01Å; Y63-P65 HydrophobicContact CE1-CB 4.18Å; Y63-P65 HydrophobicContact CE1-CG 3.91Å; P65-N67 VanDerWaalsContact C-N 3.34Å; P65-N67 PolarHBondContact O-N 3.34Å
66	G	91.2	Very high	97.2	Very high	76 Å²	76	46.1 Å²	46.1	78%	0.784	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-30.7	-173.6	0	0	0	0	0	114.1	N64	N64-G66 PolarHBondContact O-N 3.07Å; N64-G66 PolarHBondContact OD1-N 3.23Å
67	N	92.3	Very high	97.2	Very high	46 Å²	46	45.5 Å²	45.5	25%	0.246	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.8	4.9	176.4	72.8	1	0	0	0	113.6	N64 P65 G69 N78 R80	N64-N67 WeakPolarHBondContact CB-OD1 3.47Å; N64-N67 PolarHBondContact O-N 3.05Å; N64-N67 PolarHBondContact O-OD1 3.33Å; P65-N67 VanDerWaalsContact C-N 3.34Å; P65-N67 PolarHBondContact O-N 3.34Å; N67-G69 PolarHBondContact O-N 2.89Å; N67-G69 VanDerWaalsContact O-N 3.08Å; N67-G69 WeakPolarHBondContact OD1-CA 3.16Å; N67-G69 PolarHBondContact OD1-N 3.26Å; N67-N78 PolarHBondContact ND2-ND2 3Å; N67-N78 PolarHBondContact ND2-OD1 2.74Å; N67-N78 VanDerWaalsContact ND2-OD1 3.15Å; N67-R80 HydrophobicContact CB-CG 4.31Å; N67-R80 PolarHBondContact O-NH1 3.09Å
68	K	96	Very high	97.2	Very high	124 Å²	124	43.9 Å²	43.9	54%	0.539	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	9.9	-175.6	-52.3	-179.9	-179.5	-178.8	0	114.6	N64	N64-K68 WeakPolarHBondContact O-CA 3.44Å; N64-K68 PolarHBondContact O-N 3.4Å
69	G	97.6	Very high	97.2	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	167.1	176.8	0	0	0	0	0	112.1	N64 N67 S79	N64-G69 WeakPolarHBondContact CA-O 3.33Å; N64-G69 WeakPolarHBondContact CB-O 3.48Å; N64-G69 PolarHBondContact N-O 3.27Å; N67-G69 PolarHBondContact O-N 2.89Å; N67-G69 VanDerWaalsContact O-N 3.08Å; N67-G69 WeakPolarHBondContact OD1-CA 3.16Å; N67-G69 PolarHBondContact OD1-N 3.26Å; G69-S79 WeakPolarHBondContact CA-OG 3.39Å
70	T	98.7	Very high	97.2	Very high	9 Å²	9	45 Å²	45	6%	0.055	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	137.5	173.4	-56.6	0	0	0	0	109	Y72 N78 S79	T70-Y72 HydrophobicContact CG2-CD2 4.26Å; T70-Y72 HydrophobicContact CG2-CE1 4.27Å; T70-Y72 HydrophobicContact CG2-CE2 3.66Å; T70-Y72 WeakPolarHBondContact O-CD2 3.07Å; T70-Y72 WeakPolarHBondContact O-CE2 3.36Å; T70-N78 WeakPolarHBondContact O-CA 3.47Å; T70-S79 PolarHBondContact N-OG 3.44Å; T70-S79 PolarHBondContact O-N 3.1Å; T70-S79 PolarHBondContact O-OG 2.9Å
71	N	98.7	Very high	97.2	Very high	25 Å²	25	46.2 Å²	46.2	13%	0.134	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	135.3	171.3	-71.3	-6.8	0	0	0	109.9	T61 K62 Q76 N78	T61-N71 VanDerWaalsContact CA-O 3.23Å; T61-N71 WeakPolarHBondContact CA-O 3.44Å; K62-N71 HydrophobicContact CB-CB 4.34Å; K62-N71 PolarHBondContact N-O 3.29Å; K62-N71 PolarHBondContact O-N 2.92Å; N71-Q76 HydrophobicContact CB-CB 3.88Å; N71-Q76 HydrophobicContact CB-CG 4.44Å; N71-Q76 WeakPolarHBondContact CB-O 3.48Å; N71-Q76 VanDerWaalsContact CG-O 3.31Å; N71-N78 VanDerWaalsContact OD1-CB 3.27Å; N71-N78 WeakPolarHBondContact OD1-CB 3.37Å; N71-N78 PolarHBondContact OD1-ND2 3.17Å
72	Y	98.8	Very high	97.2	Very high	14 Å²	14	43.3 Å²	43.3	6%	0.055	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	136.6	-174.9	-69	-94.4	0	0	0	113.4	T61 T70 Q76 I77 D85 C99 L103	T61-Y72 HydrophobicContact CG2-CD1 3.94Å; T61-Y72 HydrophobicContact CG2-CE1 4.21Å; T70-Y72 HydrophobicContact CG2-CD2 4.26Å; T70-Y72 HydrophobicContact CG2-CE1 4.27Å; T70-Y72 HydrophobicContact CG2-CE2 3.66Å; T70-Y72 WeakPolarHBondContact O-CD2 3.07Å; T70-Y72 WeakPolarHBondContact O-CE2 3.36Å; Y72-Q76 WeakPolarHBondContact O-CA 3.4Å; Y72-Q76 PolarHBondContact O-N 3.36Å; Y72-I77 PolarHBondContact N-O 3.41Å; Y72-I77 PolarHBondContact O-N 3.25Å; Y72-D85 HydrophobicContact CE2-CB 4.19Å; Y72-D85 WeakPolarHBondContact OH-CB 3.46Å; Y72-D85 PolarHBondContact OH-OD2 3.22Å; Y72-C99 HydrophobicContact CD1-CB 3.81Å; Y72-C99 HydrophobicContact CD2-CB 3.63Å; Y72-C99 HydrophobicContact CE1-CB 3.86Å; Y72-C99 HydrophobicContact CE2-CB 3.68Å; Y72-C99 HydrophobicContact CG-CB 3.71Å; Y72-L103 HydrophobicContact CD1-CD1 4.04Å; Y72-L103 HydrophobicContact CD1-CD2 4.12Å; Y72-L103 HydrophobicContact CD1-CG 4.11Å; Y72-L103 HydrophobicContact CE1-CD1 4.44Å
73	G	98.6	Very high	97.2	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	74	-163.8	162.3	0	0	0	0	0	114.7	T58 A60 F75 Q76 L102	T58-G73 WeakPolarHBondContact O-CA 3.34Å; A60-G73 PolarHBondContact O-N 3.1Å; G73-F75 PolarHBondContact O-N 3.27Å; G73-F75 VanDerWaalsContact O-N 3.17Å; G73-Q76 PolarHBondContact O-N 3.02Å; G73-Q76 PolarHBondContact O-NE2 3.2Å; G73-L102 WeakPolarHBondContact CA-O 3.08Å
74	I	98.8	Very high	97.2	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-30.2	-169.9	-165.4	163.8	0	0	0	113.5	F21 L26 V50 S54 T58 I107 A110	F21-I74 HydrophobicContact CD2-CD1 3.84Å; F21-I74 HydrophobicContact CE2-CD1 4.09Å; L26-I74 HydrophobicContact CD1-CD1 3.67Å; V50-I74 HydrophobicContact CG1-CD1 3.93Å; V50-I74 HydrophobicContact CG1-CG1 3.33Å; V50-I74 HydrophobicContact CG2-CG1 4.36Å; S54-I74 WeakPolarHBondContact CB-O 3.48Å; S54-I74 PolarHBondContact OG-O 3.02Å; T58-I74 HydrophobicContact CG2-CB 4.39Å; T58-I74 HydrophobicContact CG2-CD1 4.25Å; I74-I107 HydrophobicContact CB-CG2 4.5Å; I74-I107 HydrophobicContact CD1-CD1 4.38Å; I74-I107 HydrophobicContact CD1-CG2 4.08Å; I74-I107 HydrophobicContact CG2-CB 4.36Å; I74-I107 HydrophobicContact CG2-CG2 3.98Å; I74-A110 HydrophobicContact CG2-CB 4.24Å
75	F	98.8	Very high	97.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	2.5	177.5	-60.5	-67.9	0	0	0	113.4	L30 M35 W46 L49 V50 G73 I77 A110 V111 A114 W127	L30-F75 HydrophobicContact CD2-CE1 4.31Å; L30-F75 HydrophobicContact CD2-CZ 3.75Å; M35-F75 HydrophobicContact CE-CE1 4.43Å; M35-F75 HydrophobicContact CE-CZ 4.27Å; W46-F75 HydrophobicContact CE3-CE1 4.33Å; L49-F75 HydrophobicContact CD2-CD1 3.99Å; V50-F75 HydrophobicContact CG2-CD1 3.53Å; V50-F75 HydrophobicContact CG2-CE1 3.37Å; V50-F75 HydrophobicContact CG2-CZ 4.36Å; G73-F75 PolarHBondContact O-N 3.27Å; G73-F75 VanDerWaalsContact O-N 3.17Å; F75-I77 VanDerWaalsContact C-N 3.28Å; F75-I77 HydrophobicContact CB-CD1 4.03Å; F75-I77 HydrophobicContact CB-CG1 3.89Å; F75-I77 HydrophobicContact CD2-CD1 4.49Å; F75-I77 PolarHBondContact O-N 3.3Å; F75-A110 HydrophobicContact CD2-CB 3.95Å; F75-A110 HydrophobicContact CE2-CB 4.09Å; F75-V111 HydrophobicContact CE2-CB 4.48Å; F75-V111 HydrophobicContact CE2-CG2 3.76Å; F75-V111 HydrophobicContact CZ-CG2 3.8Å; F75-A114 HydrophobicContact CD1-CB 4.48Å; F75-A114 HydrophobicContact CD2-CB 3.98Å; F75-A114 HydrophobicContact CE2-CB 4.22Å; F75-A114 HydrophobicContact CG-CB 4.14Å; F75-W127 PolarHBondContact O-NE1 3.26Å
76	Q	98.8	Very high	97.7	Very high	10 Å²	10	31.2 Å²	31.2	5%	0.047	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	42.9	-178.2	-69.5	-61.5	-79.7	0	0	114	E53 A60 N71 Y72 G73 N78	E53-Q76 HydrophobicContact CB-CB 3.98Å; E53-Q76 HydrophobicContact CB-CG 3.67Å; E53-Q76 HydrophobicContact CG-CB 4.3Å; E53-Q76 HydrophobicContact CG-CG 4.48Å; E53-Q76 VanDerWaalsContact O-CG 3.27Å; E53-Q76 WeakPolarHBondContact O-CG 3.33Å; E53-Q76 VanDerWaalsContact OE2-CB 3.25Å; E53-Q76 WeakPolarHBondContact OE2-CB 3.39Å; E53-Q76 WeakPolarHBondContact OE2-CG 3.23Å; A60-Q76 PolarHBondContact O-NE2 3.43Å; N71-Q76 HydrophobicContact CB-CB 3.88Å; N71-Q76 HydrophobicContact CB-CG 4.44Å; N71-Q76 WeakPolarHBondContact CB-O 3.48Å; N71-Q76 VanDerWaalsContact CG-O 3.31Å; Y72-Q76 WeakPolarHBondContact O-CA 3.4Å; Y72-Q76 PolarHBondContact O-N 3.36Å; G73-Q76 PolarHBondContact O-N 3.02Å; G73-Q76 PolarHBondContact O-NE2 3.2Å; Q76-N78 PolarHBondContact O-N 2.92Å
77	I	98.6	Very high	98	Very high	5 Å²	5	34.2 Å²	34.2	3%	0.026	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	129	-178.6	-69	167.9	0	0	0	109.8	Y72 F75 W82 L102 C113 A114 W127	Y72-I77 PolarHBondContact N-O 3.41Å; Y72-I77 PolarHBondContact O-N 3.25Å; F75-I77 VanDerWaalsContact C-N 3.28Å; F75-I77 HydrophobicContact CB-CD1 4.03Å; F75-I77 HydrophobicContact CB-CG1 3.89Å; F75-I77 HydrophobicContact CD2-CD1 4.49Å; F75-I77 PolarHBondContact O-N 3.3Å; I77-W82 HydrophobicContact CG2-CB 3.27Å; I77-W82 HydrophobicContact CG2-CG 3.87Å; I77-L102 HydrophobicContact CB-CD1 3.89Å; I77-L102 HydrophobicContact CD1-CD2 4.2Å; I77-L102 HydrophobicContact CG2-CD1 3.94Å; I77-C113 HydrophobicContact CD1-CB 3.94Å; I77-A114 HydrophobicContact CD1-CB 4.34Å; I77-W127 HydrophobicContact CG1-CZ2 4.46Å
78	N	98.5	Very high	98.3	Very high	16 Å²	16	32.5 Å²	32.5	9%	0.086	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	133.3	-170.4	-168.1	-85.6	0	0	0	113.2	N67 T70 N71 Q76 R80 S81 W82	N67-N78 PolarHBondContact ND2-ND2 3Å; N67-N78 PolarHBondContact ND2-OD1 2.74Å; N67-N78 VanDerWaalsContact ND2-OD1 3.15Å; T70-N78 WeakPolarHBondContact O-CA 3.47Å; N71-N78 VanDerWaalsContact OD1-CB 3.27Å; N71-N78 WeakPolarHBondContact OD1-CB 3.37Å; N71-N78 PolarHBondContact OD1-ND2 3.17Å; Q76-N78 PolarHBondContact O-N 2.92Å; N78-R80 VanDerWaalsContact C-N 3.26Å; N78-R80 PolarHBondContact O-N 3.21Å; N78-R80 WeakPolarHBondContact OD1-CA 3.38Å; N78-R80 WeakPolarHBondContact OD1-CB 3.41Å; N78-R80 PolarHBondContact OD1-N 2.88Å; N78-S81 PolarHBondContact O-N 2.8Å; N78-W82 PolarHBondContact O-N 2.89Å
79	S	98.6	Very high	98.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-20.9	178.2	56.3	0	0	0	0	114.6	G69 T70 S81 C83 D85 T88 A91	G69-S79 WeakPolarHBondContact CA-OG 3.39Å; T70-S79 PolarHBondContact N-OG 3.44Å; T70-S79 PolarHBondContact O-N 3.1Å; T70-S79 PolarHBondContact O-OG 2.9Å; S79-S81 PolarHBondContact O-N 3.36Å; S79-C83 CarbonylContact C-O 3.53Å; S79-C83 WeakPolarHBondContact CA-O 3.05Å; S79-D85 PolarHBondContact OG-OD2 3.49Å; S79-T88 WeakPolarHBondContact CB-OG1 3.36Å; S79-T88 PolarHBondContact OG-OG1 3.34Å; S79-A91 WeakPolarHBondContact O-CB 3.38Å
80	R	98.1	Very high	98.1	Very high	91 Å²	91	33.3 Å²	33.3	34%	0.343	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-34.1	177.4	-173.5	59.8	-179.2	-117.4	5.4	112	N67 N78 T88 A91 V92	N67-R80 HydrophobicContact CB-CG 4.31Å; N67-R80 PolarHBondContact O-NH1 3.09Å; N78-R80 VanDerWaalsContact C-N 3.26Å; N78-R80 PolarHBondContact O-N 3.21Å; N78-R80 WeakPolarHBondContact OD1-CA 3.38Å; N78-R80 WeakPolarHBondContact OD1-CB 3.41Å; N78-R80 PolarHBondContact OD1-N 2.88Å; R80-T88 HydrophobicContact CB-CG2 4.28Å; R80-A91 WeakPolarHBondContact O-CA 3.34Å; R80-V92 PolarHBondContact O-N 3.47Å
81	S	97.9	Very high	98	Very high	43 Å²	43	34.2 Å²	34.2	30%	0.301	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.6	-36.5	-173.5	-53.5	0	0	0	0	113.3	N78 S79 N93 G94	N78-S81 PolarHBondContact O-N 2.8Å; S79-S81 PolarHBondContact O-N 3.36Å; S81-N93 PolarHBondContact O-N 3.16Å; S81-G94 PolarHBondContact O-N 3.29Å
82	W	98.5	Very high	97.9	Very high	22 Å²	22	38.4 Å²	38.4	8%	0.083	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-26	-156.5	-63.9	111.8	0	0	0	115.7	I77 N78 C95 V117 D120	I77-W82 HydrophobicContact CG2-CB 3.27Å; I77-W82 HydrophobicContact CG2-CG 3.87Å; N78-W82 PolarHBondContact O-N 2.89Å; W82-C95 WeakPolarHBondContact O-CB 3.39Å; W82-C95 PolarHBondContact O-N 3.35Å; W82-V117 HydrophobicContact CD2-CB 4.42Å; W82-V117 HydrophobicContact CD2-CG2 3.43Å; W82-V117 VanDerWaalsContact CD2-CG2 3.43Å; W82-V117 VanDerWaalsContact CE2-CG2 3.49Å; W82-V117 HydrophobicContact CE3-CG2 3.74Å; W82-V117 HydrophobicContact CG-CG2 3.88Å; W82-V117 HydrophobicContact CH2-CB 4.24Å; W82-V117 HydrophobicContact CH2-CG1 4.44Å; W82-V117 HydrophobicContact CH2-CG2 4.16Å; W82-V117 HydrophobicContact CZ2-CB 3.97Å; W82-V117 HydrophobicContact CZ2-CG1 3.75Å; W82-V117 HydrophobicContact CZ2-CG2 3.88Å; W82-V117 HydrophobicContact CZ3-CG2 4.09Å; W82-D120 HydrophobicContact CH2-CB 4.48Å; W82-D120 VanDerWaalsContact CH2-OD2 3.26Å; W82-D120 WeakPolarHBondContact CH2-OD2 3.41Å
83	C	98.8	Very high	97.9	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	24%	0.242	C	C	.	.			trans	-144.7	159.2	-179	64.6	0	0	0	0	111.6	S79 N93 I97 C99 L102	S79-C83 CarbonylContact C-O 3.53Å; S79-C83 WeakPolarHBondContact CA-O 3.05Å; C83-N93 WeakPolarHBondContact CA-OD1 3.37Å; C83-I97 WeakPolarHBondContact CA-O 3.47Å; C83-I97 HydrophobicContact CB-CG1 4.12Å; C83-C99 HydrophobicContact CB-CB 3.98Å; C83-C99 WeakPolarHBondContact CB-SG 3.03Å; C83-C99 PolarHBondContact O-SG 2.98Å; C83-C99 VanDerWaalsContact O-SG 3.33Å; C83-C99 VanDerWaalsContact SG-CA 3.5Å; C83-C99 WeakPolarHBondContact SG-CB 3.13Å; C83-C99 CovalentContact SG-SG 2.04Å; C83-C99 PolarHBondContact SG-SG 3.33Å; C83-L102 HydrophobicContact CB-CD1 4Å; C83-L102 VanDerWaalsContact SG-CD1 3.57Å
84	E	98.4	Very high	97.9	Very high	73 Å²	73	41.5 Å²	41.5	34%	0.341	26%	0.26	S	S	.	.	B	Isolated β-bridge	trans	-94.8	126	179.1	-177.4	56.2	-111.5	0	0	111.9	G86 N93 I97 S98 C99	E84-G86 WeakPolarHBondContact OE1-CA 3.36Å; E84-G86 PolarHBondContact OE1-N 3.38Å; E84-N93 HydrophobicContact CB-CB 4.41Å; E84-I97 PolarHBondContact N-O 3.19Å; E84-S98 CarbonylContact O-C 3.58Å; E84-S98 WeakPolarHBondContact O-CA 3.4Å; E84-C99 VanDerWaalsContact C-SG 3.5Å; E84-C99 PolarHBondContact O-N 3.12Å
85	D	98.4	Very high	97.9	Very high	32 Å²	32	41.9 Å²	41.9	17%	0.171	26%	0.263	C	S	.	.			trans	-118.8	0.9	176.9	73.4	-7.6	0	0	0	114.4	Y72 S79 K87 T88 C99	Y72-D85 HydrophobicContact CE2-CB 4.19Å; Y72-D85 WeakPolarHBondContact OH-CB 3.46Å; Y72-D85 PolarHBondContact OH-OD2 3.22Å; S79-D85 PolarHBondContact OG-OD2 3.49Å; D85-K87 HydrophobicContact CB-CG 4.37Å; D85-K87 VanDerWaalsContact CG-CG 3.45Å; D85-K87 PolarHBondContact O-N 3.19Å; D85-K87 WeakPolarHBondContact OD1-CG 3.23Å; D85-K87 PolarHBondContact OD1-N 3.33Å; D85-K87 VanDerWaalsContact OD1-N 3.11Å; D85-K87 WeakPolarHBondContact OD2-CE 3.39Å; D85-K87 WeakPolarHBondContact OD2-CG 3.28Å; D85-T88 VanDerWaalsContact OD1-CB 3.27Å; D85-T88 WeakPolarHBondContact OD1-CB 3.27Å; D85-T88 PolarHBondContact OD1-N 3.33Å; D85-T88 PolarHBondContact OD1-OG1 3.34Å; D85-T88 PolarHBondContact OD2-OG1 3.08Å; D85-C99 HydrophobicContact CB-CB 4.09Å
86	G	97.6	Very high	97.8	Very high	69 Å²	69	44.7 Å²	44.7	71%	0.711	29%	0.291	S	S	*	.	S	Bend	trans	74.2	1.3	177.5	0	0	0	0	0	114.7	E84	E84-G86 WeakPolarHBondContact OE1-CA 3.36Å; E84-G86 PolarHBondContact OE1-N 3.38Å
87	K	97.1	Very high	97.8	Very high	138 Å²	138	46.1 Å²	46.1	60%	0.6	30%	0.299	S	S	*	.			trans	-135.7	-13.5	-174.1	63	177.3	-179.1	176.1	0	114.4	D85 P89	D85-K87 HydrophobicContact CB-CG 4.37Å; D85-K87 VanDerWaalsContact CG-CG 3.45Å; D85-K87 PolarHBondContact O-N 3.19Å; D85-K87 WeakPolarHBondContact OD1-CG 3.23Å; D85-K87 PolarHBondContact OD1-N 3.33Å; D85-K87 VanDerWaalsContact OD1-N 3.11Å; D85-K87 WeakPolarHBondContact OD2-CE 3.39Å; D85-K87 WeakPolarHBondContact OD2-CG 3.28Å; K87-P89 VanDerWaalsContact O-CD 3.27Å; K87-P89 WeakPolarHBondContact O-CD 3.38Å
88	T	98.1	Very high	97.8	Very high	10 Å²	10	48.4 Å²	48.4	6%	0.061	32%	0.316	C	S	.	.	S	Bend	trans	-82	113.5	178.6	-57.8	0	0	0	0	110.5	S79 R80 D85 G90 A91	S79-T88 WeakPolarHBondContact CB-OG1 3.36Å; S79-T88 PolarHBondContact OG-OG1 3.34Å; R80-T88 HydrophobicContact CB-CG2 4.28Å; D85-T88 VanDerWaalsContact OD1-CB 3.27Å; D85-T88 WeakPolarHBondContact OD1-CB 3.27Å; D85-T88 PolarHBondContact OD1-N 3.33Å; D85-T88 PolarHBondContact OD1-OG1 3.34Å; D85-T88 PolarHBondContact OD2-OG1 3.08Å; T88-G90 PolarHBondContact O-N 3.11Å; T88-A91 HydrophobicContact CG2-CB 4.27Å
89	P	94.8	Very high	97.8	Very high	78 Å²	78	47.7 Å²	47.7	51%	0.506	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	132.3	-177.4	-19.6	33.6	0	0	0	112.1	K87	K87-P89 VanDerWaalsContact O-CD 3.27Å; K87-P89 WeakPolarHBondContact O-CD 3.38Å
90	G	95.8	Very high	97.8	Very high	64 Å²	64	53 Å²	53	66%	0.66	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.7	35.2	176.3	0	0	0	0	0	114.2	T88	T88-G90 PolarHBondContact O-N 3.11Å
91	A	97	Very high	97.8	Very high	28 Å²	28	49.8 Å²	49.8	23%	0.231	33%	0.331	C	S	.	.			trans	-72.2	148.7	176	0	0	0	0	0	112.5	S79 R80 T88	S79-A91 WeakPolarHBondContact O-CB 3.38Å; R80-A91 WeakPolarHBondContact O-CA 3.34Å; T88-A91 HydrophobicContact CG2-CB 4.27Å
92	V	96.6	Very high	97.8	Very high	113 Å²	113	47.9 Å²	47.9	69%	0.685	32%	0.317	S	S	*	.			trans	-96.6	-30.3	-178.4	-179.1	0	0	0	0	113	R80	R80-V92 PolarHBondContact O-N 3.47Å
93	N	98	Very high	97.8	Very high	42 Å²	42	48 Å²	48	23%	0.225	32%	0.319	C	S	.	.			trans	54.6	51.3	-175	-170.8	13.1	0	0	0	114.1	S81 C83 E84 C95 G96 I97	S81-N93 PolarHBondContact O-N 3.16Å; C83-N93 WeakPolarHBondContact CA-OD1 3.37Å; E84-N93 HydrophobicContact CB-CB 4.41Å; N93-C95 PolarHBondContact O-N 3.23Å; N93-G96 PolarHBondContact O-N 3.17Å; N93-G96 WeakPolarHBondContact OD1-CA 3.47Å; N93-G96 PolarHBondContact OD1-N 2.92Å; N93-G96 VanDerWaalsContact OD1-N 3.12Å; N93-I97 PolarHBondContact OD1-N 2.87Å; N93-I97 PolarHBondContact OD1-O 2.87Å; N93-I97 VanDerWaalsContact OD1-O 3.12Å
94	G	98.1	Very high	97.8	Very high	37 Å²	37	52 Å²	52	38%	0.381	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-21.3	-177.1	0	0	0	0	0	115.7	S81	S81-G94 PolarHBondContact O-N 3.29Å
95	C	98.5	Very high	97.7	Very high	9 Å²	9	51.2 Å²	51.2	6%	0.061	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-16.9	172.8	-65.1	0	0	0	0	114	W82 N93 I97 C113 K116	W82-C95 WeakPolarHBondContact O-CB 3.39Å; W82-C95 PolarHBondContact O-N 3.35Å; N93-C95 PolarHBondContact O-N 3.23Å; C95-I97 HydrophobicContact CB-CD1 3.96Å; C95-I97 HydrophobicContact CB-CG1 3.82Å; C95-C113 HydrophobicContact CB-CB 3.8Å; C95-C113 WeakPolarHBondContact CB-SG 3.23Å; C95-C113 WeakPolarHBondContact SG-CA 3.4Å; C95-C113 WeakPolarHBondContact SG-CB 3.5Å; C95-C113 CovalentContact SG-SG 2.03Å; C95-C113 PolarHBondContact SG-SG 3.37Å; C95-K116 HydrophobicContact CB-CD 4.34Å; C95-K116 PolarHBondContact O-NZ 3.12Å
96	G	98.4	Very high	97.7	Very high	58 Å²	58	54.4 Å²	54.4	60%	0.598	35%	0.353	S	S	*	.			trans	70.5	37.4	-178.1	0	0	0	0	0	113	N93	N93-G96 PolarHBondContact O-N 3.17Å; N93-G96 WeakPolarHBondContact OD1-CA 3.47Å; N93-G96 PolarHBondContact OD1-N 2.92Å; N93-G96 VanDerWaalsContact OD1-N 3.12Å
97	I	98.6	Very high	97.8	Very high	41 Å²	41	51.2 Å²	51.2	21%	0.21	32%	0.32	C	S	.	.	S	Bend	trans	-139.2	154.4	-173.8	62.4	177.1	0	0	0	111.9	C83 E84 N93 C95 L102 C113	C83-I97 WeakPolarHBondContact CA-O 3.47Å; C83-I97 HydrophobicContact CB-CG1 4.12Å; E84-I97 PolarHBondContact N-O 3.19Å; N93-I97 PolarHBondContact OD1-N 2.87Å; N93-I97 PolarHBondContact OD1-O 2.87Å; N93-I97 VanDerWaalsContact OD1-O 3.12Å; C95-I97 HydrophobicContact CB-CD1 3.96Å; C95-I97 HydrophobicContact CB-CG1 3.82Å; I97-L102 HydrophobicContact CD1-CD2 3.73Å; I97-L102 HydrophobicContact CD1-CG 4.13Å; I97-C113 HydrophobicContact CD1-CB 4.09Å
98	S	98.6	Very high	97.8	Very high	53 Å²	53	47.7 Å²	47.7	37%	0.371	31%	0.31	S	S	.	.	B	Isolated β-bridge	trans	-68.3	138.3	164.8	174.3	0	0	0	0	110.7	E84 N100 V101	E84-S98 CarbonylContact O-C 3.58Å; E84-S98 WeakPolarHBondContact O-CA 3.4Å; S98-N100 PolarHBondContact O-N 3.04Å; S98-N100 VanDerWaalsContact O-N 3.14Å; S98-N100 PolarHBondContact OG-N 3.19Å; S98-V101 VanDerWaalsContact O-CB 3.23Å; S98-V101 WeakPolarHBondContact O-CB 3.34Å; S98-V101 WeakPolarHBondContact O-CG2 3.04Å; S98-V101 PolarHBondContact O-N 2.92Å
99	C	98.7	Very high	97.9	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-59.4	-24.4	175.2	-62.9	0	0	0	0	113.1	Y72 C83 E84 D85 V101 L102	Y72-C99 HydrophobicContact CD1-CB 3.81Å; Y72-C99 HydrophobicContact CD2-CB 3.63Å; Y72-C99 HydrophobicContact CE1-CB 3.86Å; Y72-C99 HydrophobicContact CE2-CB 3.68Å; Y72-C99 HydrophobicContact CG-CB 3.71Å; C83-C99 HydrophobicContact CB-CB 3.98Å; C83-C99 WeakPolarHBondContact CB-SG 3.03Å; C83-C99 PolarHBondContact O-SG 2.98Å; C83-C99 VanDerWaalsContact O-SG 3.33Å; C83-C99 VanDerWaalsContact SG-CA 3.5Å; C83-C99 WeakPolarHBondContact SG-CB 3.13Å; C83-C99 CovalentContact SG-SG 2.04Å; C83-C99 PolarHBondContact SG-SG 3.33Å; E84-C99 VanDerWaalsContact C-SG 3.5Å; E84-C99 PolarHBondContact O-N 3.12Å; D85-C99 HydrophobicContact CB-CB 4.09Å; C99-V101 PolarHBondContact O-N 2.94Å; C99-L102 WeakPolarHBondContact O-CB 3.1Å; C99-L102 PolarHBondContact O-N 3.23Å
100	N	98.1	Very high	98.1	Very high	112 Å²	112	49.3 Å²	49.3	60%	0.599	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-61.6	-26.1	175	-73	-26.3	0	0	0	113	S98 L102 L103	S98-N100 PolarHBondContact O-N 3.04Å; S98-N100 VanDerWaalsContact O-N 3.14Å; S98-N100 PolarHBondContact OG-N 3.19Å; N100-L102 VanDerWaalsContact C-N 3.26Å; N100-L102 PolarHBondContact O-N 3.01Å; N100-L103 WeakPolarHBondContact O-CB 3.34Å; N100-L103 PolarHBondContact O-N 3.12Å
101	V	98.2	Very high	98.2	Very high	24 Å²	24	46.5 Å²	46.5	15%	0.145	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-65	-33.2	175	173.6	0	0	0	0	111.6	S98 C99 L103 Q104 K109	S98-V101 VanDerWaalsContact O-CB 3.23Å; S98-V101 WeakPolarHBondContact O-CB 3.34Å; S98-V101 WeakPolarHBondContact O-CG2 3.04Å; S98-V101 PolarHBondContact O-N 2.92Å; C99-V101 PolarHBondContact O-N 2.94Å; V101-L103 PolarHBondContact O-N 2.89Å; V101-Q104 WeakPolarHBondContact O-CG 3.14Å; V101-Q104 PolarHBondContact O-N 2.03Å; V101-K109 HydrophobicContact CG1-CB 3.47Å; V101-K109 VanDerWaalsContact CG1-CB 3.47Å; V101-K109 HydrophobicContact CG1-CD 3.26Å; V101-K109 HydrophobicContact CG1-CG 3.98Å
102	L	98.6	Very high	98.3	Very high	3 Å²	3	47.7 Å²	47.7	2%	0.016	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-71	-13.4	179.1	-58.3	174.6	0	0	0	112.7	G73 I77 C83 I97 C99 N100 A110 C113	G73-L102 WeakPolarHBondContact CA-O 3.08Å; I77-L102 HydrophobicContact CB-CD1 3.89Å; I77-L102 HydrophobicContact CD1-CD2 4.2Å; I77-L102 HydrophobicContact CG2-CD1 3.94Å; C83-L102 HydrophobicContact CB-CD1 4Å; C83-L102 VanDerWaalsContact SG-CD1 3.57Å; I97-L102 HydrophobicContact CD1-CD2 3.73Å; I97-L102 HydrophobicContact CD1-CG 4.13Å; C99-L102 WeakPolarHBondContact O-CB 3.1Å; C99-L102 PolarHBondContact O-N 3.23Å; N100-L102 VanDerWaalsContact C-N 3.26Å; N100-L102 PolarHBondContact O-N 3.01Å; L102-A110 HydrophobicContact CD2-CB 3.98Å; L102-C113 HydrophobicContact CD2-CB 4.22Å
103	L	98.5	Very high	98.4	Very high	23 Å²	23	42.4 Å²	42.4	12%	0.12	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-93	8.3	178.4	-59	179	0	0	0	113	T58 K59 T61 Y72 N100 V101	T58-L103 WeakPolarHBondContact O-CA 3.36Å; K59-L103 HydrophobicContact CD-CB 3.98Å; K59-L103 WeakPolarHBondContact CD-O 3.41Å; K59-L103 WeakPolarHBondContact CE-O 3.25Å; K59-L103 PolarHBondContact NZ-O 3.43Å; T61-L103 HydrophobicContact CG2-CD1 4.32Å; T61-L103 HydrophobicContact CG2-CD2 3.79Å; Y72-L103 HydrophobicContact CD1-CD1 4.04Å; Y72-L103 HydrophobicContact CD1-CD2 4.12Å; Y72-L103 HydrophobicContact CD1-CG 4.11Å; Y72-L103 HydrophobicContact CE1-CD1 4.44Å; N100-L103 WeakPolarHBondContact O-CB 3.34Å; N100-L103 PolarHBondContact O-N 3.12Å; V101-L103 PolarHBondContact O-N 2.89Å
104	Q	97.7	Very high	98.4	Very high	85 Å²	85	40.4 Å²	40.4	40%	0.397	25%	0.246	S	C	.	.	S	Bend	trans	-79.1	151.4	179	-66.1	-176.2	4.9	0	0	112	V101 D106	V101-Q104 WeakPolarHBondContact O-CG 3.14Å; V101-Q104 PolarHBondContact O-N 2.03Å; Q104-D106 VanDerWaalsContact C-N 3.28Å; Q104-D106 PolarHBondContact O-N 3.14Å
105	N	97.3	Very high	98.5	Very high	56 Å²	56	40.7 Å²	40.7	30%	0.299	24%	0.236	S	C	.	.	S	Bend	trans	-68.6	-30.7	176.5	-72	-11.2	0	0	0	112	Q17 K19 T58	Q17-N105 PolarHBondContact O-ND2 2.95Å; Q17-N105 PolarHBondContact O-OD1 2.99Å; K19-N105 HydrophobicContact CB-CB 3.98Å; K19-N105 WeakPolarHBondContact CB-OD1 3.27Å; K19-N105 HydrophobicContact CD-CB 4.43Å; K19-N105 PolarHBondContact N-OD1 3.12Å; T58-N105 PolarHBondContact OG1-OD1 3.3Å
106	D	97.6	Very high	98.5	Very high	99 Å²	99	44.8 Å²	44.8	53%	0.529	25%	0.253	S	S	.	.	S	Bend	trans	-78.9	116.6	164.9	-177.4	-5.7	0	0	0	109.3	Q104 T108	Q104-D106 VanDerWaalsContact C-N 3.28Å; Q104-D106 PolarHBondContact O-N 3.14Å; D106-T108 VanDerWaalsContact C-N 3.33Å; D106-T108 VanDerWaalsContact OD1-CB 3.29Å; D106-T108 WeakPolarHBondContact OD1-CB 2.99Å; D106-T108 PolarHBondContact OD1-N 2.81Å; D106-T108 PolarHBondContact OD1-OG1 3.19Å
107	I	98.7	Very high	98.5	Very high	3 Å²	3	42.1 Å²	42.1	2%	0.015	23%	0.226	C	C	.	.			trans	-90.1	7.4	-175.4	65.7	171.6	0	0	0	113.2	F21 L26 T29 L30 L33 T58 I74 K109 A110 V111	F21-I107 HydrophobicContact CE2-CG2 3.82Å; F21-I107 HydrophobicContact CZ-CD1 4.2Å; F21-I107 HydrophobicContact CZ-CG1 4.38Å; F21-I107 HydrophobicContact CZ-CG2 4.1Å; L26-I107 HydrophobicContact CD1-CD1 3.9Å; T29-I107 HydrophobicContact CG2-CD1 3.82Å; T29-I107 HydrophobicContact CG2-CG1 4.05Å; L30-I107 HydrophobicContact CD2-CD1 4.08Å; L33-I107 HydrophobicContact CD1-CD1 4.4Å; L33-I107 HydrophobicContact CD1-CG1 3.96Å; T58-I107 HydrophobicContact CG2-CG2 3.72Å; I74-I107 HydrophobicContact CB-CG2 4.5Å; I74-I107 HydrophobicContact CD1-CD1 4.38Å; I74-I107 HydrophobicContact CD1-CG2 4.08Å; I74-I107 HydrophobicContact CG2-CB 4.36Å; I74-I107 HydrophobicContact CG2-CG2 3.98Å; I107-K109 PolarHBondContact O-N 2.86Å; I107-A110 HydrophobicContact CB-CB 4.43Å; I107-A110 WeakPolarHBondContact O-CB 3.36Å; I107-A110 PolarHBondContact O-N 2.04Å; I107-A110 VanDerWaalsContact O-N 3.12Å; I107-V111 HydrophobicContact CD1-CG2 4.33Å; I107-V111 HydrophobicContact CG1-CG2 4.35Å; I107-V111 WeakPolarHBondContact O-CG2 3.26Å; I107-V111 PolarHBondContact O-N 3.04Å
108	T	98.8	Very high	98.5	Very high	64 Å²	64	40.5 Å²	40.5	39%	0.393	22%	0.217	S	C	.	.	H	α-helix	trans	-55.8	-47.5	-176.7	-61.2	0	0	0	0	112.2	L33 D106 V111 A112	L33-T108 HydrophobicContact CD2-CG2 4.47Å; D106-T108 VanDerWaalsContact C-N 3.33Å; D106-T108 VanDerWaalsContact OD1-CB 3.29Å; D106-T108 WeakPolarHBondContact OD1-CB 2.99Å; D106-T108 PolarHBondContact OD1-N 2.81Å; D106-T108 PolarHBondContact OD1-OG1 3.19Å; T108-V111 PolarHBondContact O-N 3.33Å; T108-A112 PolarHBondContact O-N 3.24Å
109	K	98.7	Very high	98.5	Very high	117 Å²	117	44 Å²	44	51%	0.509	23%	0.226	S	C	.	.	H	α-helix	trans	-70.6	-33.1	177.9	-66.7	-174	179.2	-179.2	0	112.5	V101 I107 A112 C113	V101-K109 HydrophobicContact CG1-CB 3.47Å; V101-K109 VanDerWaalsContact CG1-CB 3.47Å; V101-K109 HydrophobicContact CG1-CD 3.26Å; V101-K109 HydrophobicContact CG1-CG 3.98Å; I107-K109 PolarHBondContact O-N 2.86Å; K109-A112 PolarHBondContact O-N 3.25Å; K109-C113 PolarHBondContact O-N 3.26Å
110	A	98.8	Very high	98.3	Very high	4 Å²	4	47.9 Å²	47.9	3%	0.033	25%	0.247	C	C	.	.	H	α-helix	trans	-65.9	-40.9	173.8	0	0	0	0	0	111.7	I74 F75 L102 I107 C113 A114	I74-A110 HydrophobicContact CG2-CB 4.24Å; F75-A110 HydrophobicContact CD2-CB 3.95Å; F75-A110 HydrophobicContact CE2-CB 4.09Å; L102-A110 HydrophobicContact CD2-CB 3.98Å; I107-A110 HydrophobicContact CB-CB 4.43Å; I107-A110 WeakPolarHBondContact O-CB 3.36Å; I107-A110 PolarHBondContact O-N 2.04Å; I107-A110 VanDerWaalsContact O-N 3.12Å; A110-C113 PolarHBondContact O-N 2.75Å; A110-A114 PolarHBondContact O-N 2.89Å
111	V	98.9	Very high	98.2	Very high	5 Å²	5	49.2 Å²	49.2	3%	0.03	26%	0.261	C	S	.	.	H	α-helix	trans	-62.6	-45.8	173.3	163.6	0	0	0	0	110.9	L30 L33 M35 F75 I107 T108 C113 A114 K115	L30-V111 HydrophobicContact CD2-CG2 3.99Å; L33-V111 HydrophobicContact CB-CG1 4.04Å; L33-V111 HydrophobicContact CB-CG2 4.44Å; L33-V111 HydrophobicContact CD1-CB 4.24Å; L33-V111 HydrophobicContact CD1-CG2 3.72Å; M35-V111 HydrophobicContact CE-CG1 4.5Å; M35-V111 HydrophobicContact CG-CG1 3.9Å; M35-V111 HydrophobicContact CG-CG2 4.47Å; M35-V111 HydrophobicContact SD-CG1 3.61Å; F75-V111 HydrophobicContact CE2-CB 4.48Å; F75-V111 HydrophobicContact CE2-CG2 3.76Å; F75-V111 HydrophobicContact CZ-CG2 3.8Å; I107-V111 HydrophobicContact CD1-CG2 4.33Å; I107-V111 HydrophobicContact CG1-CG2 4.35Å; I107-V111 WeakPolarHBondContact O-CG2 3.26Å; I107-V111 PolarHBondContact O-N 3.04Å; T108-V111 PolarHBondContact O-N 3.33Å; V111-C113 VanDerWaalsContact C-N 3.27Å; V111-C113 PolarHBondContact O-N 2.03Å; V111-A114 PolarHBondContact O-N 2.95Å; V111-K115 HydrophobicContact CG1-CD 4.24Å; V111-K115 HydrophobicContact CG1-CG 4.39Å; V111-K115 WeakPolarHBondContact O-CB 3.47Å; V111-K115 WeakPolarHBondContact O-CG 3.26Å; V111-K115 PolarHBondContact O-N 3.15Å
112	A	98.9	Very high	98	Very high	53 Å²	53	54.2 Å²	54.2	44%	0.438	28%	0.281	S	S	.	.	H	α-helix	trans	-58.6	-39.5	177.2	0	0	0	0	0	112.2	T108 K109 K115 K116	T108-A112 PolarHBondContact O-N 3.24Å; K109-A112 PolarHBondContact O-N 3.25Å; A112-K115 WeakPolarHBondContact O-CB 3.27Å; A112-K116 PolarHBondContact O-N 2.82Å
113	C	98.8	Very high	97.9	Very high	2 Å²	2	54.9 Å²	54.9	1%	0.014	29%	0.289	C	S	.	.	H	α-helix	trans	-71	-44.1	176.2	-174.1	0	0	0	0	112.4	I77 C95 I97 L102 K109 A110 V111 K115 K116 V117	I77-C113 HydrophobicContact CD1-CB 3.94Å; C95-C113 HydrophobicContact CB-CB 3.8Å; C95-C113 WeakPolarHBondContact CB-SG 3.23Å; C95-C113 WeakPolarHBondContact SG-CA 3.4Å; C95-C113 WeakPolarHBondContact SG-CB 3.5Å; C95-C113 CovalentContact SG-SG 2.03Å; C95-C113 PolarHBondContact SG-SG 3.37Å; I97-C113 HydrophobicContact CD1-CB 4.09Å; L102-C113 HydrophobicContact CD2-CB 4.22Å; K109-C113 PolarHBondContact O-N 3.26Å; A110-C113 PolarHBondContact O-N 2.75Å; V111-C113 VanDerWaalsContact C-N 3.27Å; V111-C113 PolarHBondContact O-N 2.03Å; C113-K115 PolarHBondContact O-N 3.33Å; C113-K116 WeakPolarHBondContact O-CA 3.23Å; C113-K116 WeakPolarHBondContact O-CB 3.34Å; C113-K116 PolarHBondContact O-N 2.94Å; C113-V117 WeakPolarHBondContact O-CG2 3.27Å; C113-V117 PolarHBondContact O-N 3.45Å
114	A	98.8	Very high	97.9	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-58	-36.6	173.8	0	0	0	0	0	112.5	M35 W46 F75 I77 A110 V111 K116 V117 V118 W127	M35-A114 HydrophobicContact CE-CB 4.48Å; W46-A114 HydrophobicContact CH2-CB 4.41Å; W46-A114 HydrophobicContact CZ3-CB 4.32Å; F75-A114 HydrophobicContact CD1-CB 4.48Å; F75-A114 HydrophobicContact CD2-CB 3.98Å; F75-A114 HydrophobicContact CE2-CB 4.22Å; F75-A114 HydrophobicContact CG-CB 4.14Å; I77-A114 HydrophobicContact CD1-CB 4.34Å; A110-A114 PolarHBondContact O-N 2.89Å; V111-A114 PolarHBondContact O-N 2.95Å; A114-K116 VanDerWaalsContact C-N 3.29Å; A114-K116 PolarHBondContact O-N 3.07Å; A114-V117 PolarHBondContact O-N 3.05Å; A114-V118 PolarHBondContact O-N 3.38Å; A114-V118 VanDerWaalsContact O-N 3.12Å; A114-W127 HydrophobicContact CB-CH2 4.42Å; A114-W127 HydrophobicContact CB-CZ2 4.42Å
115	K	98.9	Very high	97.9	Very high	43 Å²	43	56 Å²	56	19%	0.187	29%	0.292	C	S	.	.	H	α-helix	trans	-64.2	-28.9	173.5	-79.9	-172.1	166.7	178.6	0	113.8	L33 G34 M35 Y38 V111 A112 C113	L33-K115 PolarHBondContact O-NZ 3.4Å; G34-K115 VanDerWaalsContact O-CE 3.24Å; G34-K115 WeakPolarHBondContact O-CE 3.42Å; G34-K115 PolarHBondContact O-NZ 3.14Å; M35-K115 HydrophobicContact SD-CD 4.26Å; M35-K115 VanDerWaalsContact SD-CE 3.55Å; M35-K115 HydrophobicContact SD-CG 3.79Å; Y38-K115 HydrophobicContact CD1-CB 4.45Å; Y38-K115 HydrophobicContact CD1-CD 4.46Å; Y38-K115 HydrophobicContact CD1-CG 3.84Å; Y38-K115 HydrophobicContact CD2-CD 4.14Å; Y38-K115 HydrophobicContact CD2-CG 4.4Å; Y38-K115 HydrophobicContact CE1-CB 3.61Å; Y38-K115 HydrophobicContact CE1-CD 4.14Å; Y38-K115 HydrophobicContact CE1-CG 3.47Å; Y38-K115 VanDerWaalsContact CE1-CG 3.47Å; Y38-K115 WeakPolarHBondContact CE1-O 3.38Å; Y38-K115 HydrophobicContact CE2-CB 4.49Å; Y38-K115 HydrophobicContact CE2-CD 3.79Å; Y38-K115 HydrophobicContact CE2-CG 4.08Å; Y38-K115 HydrophobicContact CG-CD 4.45Å; Y38-K115 HydrophobicContact CG-CG 4.29Å; Y38-K115 WeakPolarHBondContact OH-CB 3.3Å; Y38-K115 PolarHBondContact OH-O 3.17Å; Y38-K115 VanDerWaalsContact OH-O 3.07Å; V111-K115 HydrophobicContact CG1-CD 4.24Å; V111-K115 HydrophobicContact CG1-CG 4.39Å; V111-K115 WeakPolarHBondContact O-CB 3.47Å; V111-K115 WeakPolarHBondContact O-CG 3.26Å; V111-K115 PolarHBondContact O-N 3.15Å; A112-K115 WeakPolarHBondContact O-CB 3.27Å; C113-K115 PolarHBondContact O-N 3.33Å
116	K	98.6	Very high	97.9	Very high	96 Å²	96	56.3 Å²	56.3	42%	0.417	29%	0.292	S	S	.	.	H	α-helix	trans	-74.6	-44.7	170.4	-70.8	-178.8	172.2	-171.7	0	110.5	C95 A112 C113 A114 V118 K119	C95-K116 HydrophobicContact CB-CD 4.34Å; C95-K116 PolarHBondContact O-NZ 3.12Å; A112-K116 PolarHBondContact O-N 2.82Å; C113-K116 WeakPolarHBondContact O-CA 3.23Å; C113-K116 WeakPolarHBondContact O-CB 3.34Å; C113-K116 PolarHBondContact O-N 2.94Å; A114-K116 VanDerWaalsContact C-N 3.29Å; A114-K116 PolarHBondContact O-N 3.07Å; K116-V118 VanDerWaalsContact C-N 3.34Å; K116-V118 PolarHBondContact O-N 3.26Å; K116-K119 WeakPolarHBondContact O-CB 3.42Å; K116-K119 PolarHBondContact O-N 3.02Å
117	V	98.6	Very high	97.9	Very high	2 Å²	2	52.2 Å²	52.2	1%	0.012	27%	0.269	C	S	.	.	H	α-helix	trans	-56.4	-45.5	-179.6	179.1	0	0	0	0	112.3	W82 C113 A114 K119 D120 E126 W127	W82-V117 HydrophobicContact CD2-CB 4.42Å; W82-V117 HydrophobicContact CD2-CG2 3.43Å; W82-V117 VanDerWaalsContact CD2-CG2 3.43Å; W82-V117 VanDerWaalsContact CE2-CG2 3.49Å; W82-V117 HydrophobicContact CE3-CG2 3.74Å; W82-V117 HydrophobicContact CG-CG2 3.88Å; W82-V117 HydrophobicContact CH2-CB 4.24Å; W82-V117 HydrophobicContact CH2-CG1 4.44Å; W82-V117 HydrophobicContact CH2-CG2 4.16Å; W82-V117 HydrophobicContact CZ2-CB 3.97Å; W82-V117 HydrophobicContact CZ2-CG1 3.75Å; W82-V117 HydrophobicContact CZ2-CG2 3.88Å; W82-V117 HydrophobicContact CZ3-CG2 4.09Å; C113-V117 WeakPolarHBondContact O-CG2 3.27Å; C113-V117 PolarHBondContact O-N 3.45Å; A114-V117 PolarHBondContact O-N 3.05Å; V117-K119 PolarHBondContact O-N 2.81Å; V117-D120 WeakPolarHBondContact O-CB 3.41Å; V117-D120 PolarHBondContact O-N 2.96Å; V117-D120 VanDerWaalsContact O-N 3.13Å; V117-E126 HydrophobicContact CG1-CB 4.06Å; V117-E126 HydrophobicContact CG1-CG 3.8Å; V117-W127 HydrophobicContact CB-CH2 3.53Å; V117-W127 HydrophobicContact CB-CZ2 4.23Å; V117-W127 HydrophobicContact CB-CZ3 4.13Å; V117-W127 HydrophobicContact CG1-CE3 4.36Å; V117-W127 HydrophobicContact CG1-CH2 3.31Å; V117-W127 HydrophobicContact CG1-CZ2 3.97Å; V117-W127 HydrophobicContact CG1-CZ3 3.5Å; V117-W127 HydrophobicContact CG2-CH2 4.26Å
118	V	98.5	Very high	97.8	Very high	6 Å²	6	57.1 Å²	57.1	4%	0.036	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-5.2	-179.1	-63.3	0	0	0	0	114.9	Y38 H39 I41 W46 A114 K116 D120 I124 W127	Y38-V118 HydrophobicContact CD1-CG2 3.86Å; Y38-V118 HydrophobicContact CE1-CG2 3.59Å; H39-V118 HydrophobicContact CB-CG2 4.32Å; I41-V118 HydrophobicContact CD1-CB 3.87Å; I41-V118 HydrophobicContact CD1-CG1 3.67Å; I41-V118 HydrophobicContact CD1-CG2 4.23Å; W46-V118 HydrophobicContact CH2-CB 4.45Å; W46-V118 HydrophobicContact CH2-CG1 3.41Å; W46-V118 VanDerWaalsContact CH2-CG1 3.41Å; W46-V118 HydrophobicContact CH2-CG2 4.25Å; W46-V118 HydrophobicContact CZ2-CG1 3.94Å; W46-V118 HydrophobicContact CZ2-CG2 4.22Å; W46-V118 HydrophobicContact CZ3-CG1 4.38Å; A114-V118 PolarHBondContact O-N 3.38Å; A114-V118 VanDerWaalsContact O-N 3.12Å; K116-V118 VanDerWaalsContact C-N 3.34Å; K116-V118 PolarHBondContact O-N 3.26Å; V118-D120 VanDerWaalsContact C-N 3.33Å; V118-I124 HydrophobicContact CG1-CB 4.42Å; V118-W127 HydrophobicContact CG1-CH2 3.99Å; V118-W127 HydrophobicContact CG1-CZ3 3.57Å
119	K	97.9	Very high	97.7	Very high	126 Å²	126	54.9 Å²	54.9	55%	0.548	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-20.9	170.3	-75.4	171.3	164	174.7	0	112.1	Y38 H39 K116 V117	Y38-K119 WeakPolarHBondContact OH-CE 3.34Å; H39-K119 WeakPolarHBondContact NE2-CE 3.32Å; H39-K119 VanDerWaalsContact NE2-CG 3.33Å; H39-K119 WeakPolarHBondContact NE2-CG 3.31Å; K116-K119 WeakPolarHBondContact O-CB 3.42Å; K116-K119 PolarHBondContact O-N 3.02Å; V117-K119 PolarHBondContact O-N 2.81Å
120	D	95.4	Very high	97.7	Very high	82 Å²	82	50.3 Å²	50.3	44%	0.439	26%	0.259	S	S	.	.	S	Bend	trans	-65.8	155.7	173.3	-83.9	18.1	0	0	0	110.8	W82 V117 V118 K122 G123	W82-D120 HydrophobicContact CH2-CB 4.48Å; W82-D120 VanDerWaalsContact CH2-OD2 3.26Å; W82-D120 WeakPolarHBondContact CH2-OD2 3.41Å; V117-D120 WeakPolarHBondContact O-CB 3.41Å; V117-D120 PolarHBondContact O-N 2.96Å; V117-D120 VanDerWaalsContact O-N 3.13Å; V118-D120 VanDerWaalsContact C-N 3.33Å; D120-K122 PolarHBondContact O-N 3.13Å; D120-G123 PolarHBondContact O-N 3.36Å
121	P	95.1	Very high	97.7	Very high	140 Å²	140	53.2 Å²	53.2	91%	0.909	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-25.4	-174.3	-29.3	36.1	0	0	0	115.7	G123	P121-G123 VanDerWaalsContact C-N 3.31Å
122	K	95.4	Very high	97.6	Very high	130 Å²	130	57.9 Å²	57.9	57%	0.565	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-22.6	176.3	-66	175.7	-176.9	178.6	0	112.7	D120 K125 E126	D120-K122 PolarHBondContact O-N 3.13Å; K122-K125 VanDerWaalsContact O-CB 3.23Å; K122-K125 WeakPolarHBondContact O-CB 3.26Å; K122-K125 PolarHBondContact O-N 2.82Å; K122-K125 VanDerWaalsContact O-N 3.08Å; K122-E126 HydrophobicContact CB-CB 4.44Å; K122-E126 WeakPolarHBondContact CD-OE2 3.15Å; K122-E126 WeakPolarHBondContact CE-OE2 3.35Å; K122-E126 IonicContact NZ-OE2 2.61Å; K122-E126 PolarHBondContact NZ-OE2 2.77Å
123	G	97.1	Very high	97.6	Very high	17 Å²	17	59 Å²	59	18%	0.175	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	55.8	-137.3	-175	0	0	0	0	0	111.9	D120 P121 K125 E126	D120-G123 PolarHBondContact O-N 3.36Å; P121-G123 VanDerWaalsContact C-N 3.31Å; G123-K125 PolarHBondContact O-N 3.01Å; G123-K125 VanDerWaalsContact O-N 3.15Å; G123-E126 PolarHBondContact O-N 3.32Å
124	I	98.1	Very high	97.6	Very high	17 Å²	17	59 Å²	59	9%	0.087	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-65.6	-13.9	176.8	-166.1	159.8	0	0	0	114	I41 N45 L49 V118 E126 W127 W130	I41-I124 HydrophobicContact CD1-CB 3.8Å; I41-I124 HydrophobicContact CD1-CD1 4.35Å; I41-I124 HydrophobicContact CD1-CG2 4.38Å; I41-I124 HydrophobicContact CG1-CB 4.24Å; I41-I124 HydrophobicContact CG1-CD1 4.46Å; I41-I124 HydrophobicContact CG1-CG2 4.33Å; I41-I124 HydrophobicContact CG2-CD1 3.51Å; N45-I124 HydrophobicContact CB-CD1 4.27Å; L49-I124 HydrophobicContact CD1-CD1 3.86Å; L49-I124 HydrophobicContact CD1-CG1 3.79Å; V118-I124 HydrophobicContact CG1-CB 4.42Å; I124-E126 PolarHBondContact O-N 3.15Å; I124-W127 HydrophobicContact CG1-CE3 4.38Å; I124-W127 PolarHBondContact O-N 3.08Å; I124-W130 HydrophobicContact CB-CD2 4.46Å; I124-W130 HydrophobicContact CD1-CD2 4.11Å; I124-W130 HydrophobicContact CD1-CG 3.98Å; I124-W130 HydrophobicContact CG1-CB 4.45Å; I124-W130 HydrophobicContact CG1-CD2 3.76Å; I124-W130 HydrophobicContact CG1-CE3 4.31Å; I124-W130 HydrophobicContact CG1-CG 3.79Å; I124-W130 HydrophobicContact CG2-CD2 3.99Å; I124-W130 HydrophobicContact CG2-CE3 3.96Å; I124-W130 HydrophobicContact CG2-CH2 3.62Å; I124-W130 HydrophobicContact CG2-CZ2 3.64Å; I124-W130 HydrophobicContact CG2-CZ3 3.8Å
125	K	97.6	Very high	97.6	Very high	115 Å²	115	61.8 Å²	61.8	50%	0.5	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-71.9	-6	178	-59	171.2	-178.8	172.9	0	113.2	K122 G123 W127 W130 K131	K122-K125 VanDerWaalsContact O-CB 3.23Å; K122-K125 WeakPolarHBondContact O-CB 3.26Å; K122-K125 PolarHBondContact O-N 2.82Å; K122-K125 VanDerWaalsContact O-N 3.08Å; G123-K125 PolarHBondContact O-N 3.01Å; G123-K125 VanDerWaalsContact O-N 3.15Å; K125-W127 PolarHBondContact O-N 3.11Å; K125-W130 HydrophobicContact CG-CZ3 3.83Å; K125-K131 HydrophobicContact CB-CD 4.21Å; K125-K131 HydrophobicContact CB-CG 4.36Å; K125-K131 VanDerWaalsContact O-CE 3.26Å; K125-K131 WeakPolarHBondContact O-CE 3.33Å
126	E	96.6	Very high	97.5	Very high	62 Å²	62	69.3 Å²	69.3	29%	0.29	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-61.4	-26.6	169.3	-177.5	64.5	-179	0	0	111.9	V117 K122 G123 I124	V117-E126 HydrophobicContact CG1-CB 4.06Å; V117-E126 HydrophobicContact CG1-CG 3.8Å; K122-E126 HydrophobicContact CB-CB 4.44Å; K122-E126 WeakPolarHBondContact CD-OE2 3.15Å; K122-E126 WeakPolarHBondContact CE-OE2 3.35Å; K122-E126 IonicContact NZ-OE2 2.61Å; K122-E126 PolarHBondContact NZ-OE2 2.77Å; G123-E126 PolarHBondContact O-N 3.32Å; I124-E126 PolarHBondContact O-N 3.15Å
127	W	98	Very high	97.5	Very high	13 Å²	13	70.4 Å²	70.4	5%	0.049	34%	0.344	C	S	.	.			trans	-90.1	109.9	176.7	-71.4	-92.5	0	0	0	112	W46 L49 F75 I77 A114 V117 V118 I124 K125 A129 W130 K131	W46-W127 HydrophobicContact CZ3-CH2 4.38Å; L49-W127 HydrophobicContact CD1-CB 3.99Å; L49-W127 HydrophobicContact CD1-CD2 3.69Å; L49-W127 HydrophobicContact CD1-CE3 4Å; L49-W127 HydrophobicContact CD1-CG 3.71Å; L49-W127 HydrophobicContact CD2-CG 4.35Å; L49-W127 HydrophobicContact CG-CB 4.29Å; L49-W127 HydrophobicContact CG-CG 4.11Å; F75-W127 PolarHBondContact O-NE1 3.26Å; I77-W127 HydrophobicContact CG1-CZ2 4.46Å; A114-W127 HydrophobicContact CB-CH2 4.42Å; A114-W127 HydrophobicContact CB-CZ2 4.42Å; V117-W127 HydrophobicContact CB-CH2 3.53Å; V117-W127 HydrophobicContact CB-CZ2 4.23Å; V117-W127 HydrophobicContact CB-CZ3 4.13Å; V117-W127 HydrophobicContact CG1-CE3 4.36Å; V117-W127 HydrophobicContact CG1-CH2 3.31Å; V117-W127 HydrophobicContact CG1-CZ2 3.97Å; V117-W127 HydrophobicContact CG1-CZ3 3.5Å; V117-W127 HydrophobicContact CG2-CH2 4.26Å; V118-W127 HydrophobicContact CG1-CH2 3.99Å; V118-W127 HydrophobicContact CG1-CZ3 3.57Å; I124-W127 HydrophobicContact CG1-CE3 4.38Å; I124-W127 PolarHBondContact O-N 3.08Å; K125-W127 PolarHBondContact O-N 3.11Å; W127-A129 VanDerWaalsContact C-N 3.29Å; W127-A129 PolarHBondContact O-N 2.84Å; W127-W130 HydrophobicContact CB-CB 3.96Å; W127-W130 PolarHBondContact O-N 3.36Å; W127-W130 VanDerWaalsContact O-N 3.15Å; W127-K131 PolarHBondContact O-N 2.74Å; W127-K131 VanDerWaalsContact O-N 3.17Å
128	E	96.2	Very high	97.4	Very high	106 Å²	106	75.1 Å²	75.1	50%	0.495	37%	0.369	S	S	.	.	H	α-helix	trans	-59.6	-39.2	178.2	-153	66.1	-142.5	0	0	112.1	W130 K131 N132	E128-W130 VanDerWaalsContact C-N 3.29Å; E128-W130 PolarHBondContact O-N 2.87Å; E128-K131 PolarHBondContact O-N 2.87Å; E128-K131 WeakPolarHBondContact OE1-CE 3.27Å; E128-K131 IonicContact OE1-NZ 2.88Å; E128-K131 PolarHBondContact OE1-NZ 2.69Å; E128-K131 WeakPolarHBondContact OE2-CE 3.42Å; E128-K131 IonicContact OE2-NZ 2.75Å; E128-K131 PolarHBondContact OE2-NZ 3.31Å; E128-N132 VanDerWaalsContact O-CG 3.31Å; E128-N132 PolarHBondContact O-N 2.89Å; E128-N132 PolarHBondContact O-ND2 3.37Å
129	A	96.8	Very high	97.4	Very high	16 Å²	16	75.7 Å²	75.7	13%	0.132	37%	0.372	C	S	.	.	H	α-helix	trans	-65.8	-34.1	179.1	0	0	0	0	0	111.8	W52 E53 W127 N132 H133	W52-A129 HydrophobicContact CB-CB 3.93Å; E53-A129 HydrophobicContact CG-CB 4.07Å; E53-A129 WeakPolarHBondContact OE1-CB 3.29Å; W127-A129 VanDerWaalsContact C-N 3.29Å; W127-A129 PolarHBondContact O-N 2.84Å; A129-N132 PolarHBondContact O-N 3.47Å; A129-H133 WeakPolarHBondContact O-CB 3.44Å; A129-H133 PolarHBondContact O-CD2 3.5Å; A129-H133 VanDerWaalsContact O-CD2 3.26Å; A129-H133 PolarHBondContact O-N 2.73Å
130	W	98.6	Very high	97.4	Very high	22 Å²	22	72.4 Å²	72.4	8%	0.083	37%	0.366	C	S	.	.	H	α-helix	trans	-66.2	-43.6	173.7	178.4	87.4	0	0	0	111.5	N45 L49 I124 K125 W127 E128 N132 C134 Q135	N45-W130 PolarHBondContact OD1-NE1 3.42Å; L49-W130 HydrophobicContact CB-CB 4.33Å; L49-W130 HydrophobicContact CD1-CB 4.2Å; L49-W130 HydrophobicContact CG-CB 4.22Å; I124-W130 HydrophobicContact CB-CD2 4.46Å; I124-W130 HydrophobicContact CD1-CD2 4.11Å; I124-W130 HydrophobicContact CD1-CG 3.98Å; I124-W130 HydrophobicContact CG1-CB 4.45Å; I124-W130 HydrophobicContact CG1-CD2 3.76Å; I124-W130 HydrophobicContact CG1-CE3 4.31Å; I124-W130 HydrophobicContact CG1-CG 3.79Å; I124-W130 HydrophobicContact CG2-CD2 3.99Å; I124-W130 HydrophobicContact CG2-CE3 3.96Å; I124-W130 HydrophobicContact CG2-CH2 3.62Å; I124-W130 HydrophobicContact CG2-CZ2 3.64Å; I124-W130 HydrophobicContact CG2-CZ3 3.8Å; K125-W130 HydrophobicContact CG-CZ3 3.83Å; W127-W130 HydrophobicContact CB-CB 3.96Å; W127-W130 PolarHBondContact O-N 3.36Å; W127-W130 VanDerWaalsContact O-N 3.15Å; E128-W130 VanDerWaalsContact C-N 3.29Å; E128-W130 PolarHBondContact O-N 2.87Å; W130-N132 VanDerWaalsContact C-N 3.29Å; W130-N132 PolarHBondContact O-N 3.34Å; W130-C134 HydrophobicContact CD2-CB 4.38Å; W130-C134 HydrophobicContact CG-CB 3.86Å; W130-C134 WeakPolarHBondContact O-CA 3.17Å; W130-C134 VanDerWaalsContact O-CB 3.26Å; W130-C134 WeakPolarHBondContact O-CB 3.49Å; W130-C134 PolarHBondContact O-N 3.02Å; W130-Q135 HydrophobicContact CE3-CB 4.14Å; W130-Q135 HydrophobicContact CH2-CB 3.81Å; W130-Q135 HydrophobicContact CH2-CG 3.71Å; W130-Q135 HydrophobicContact CZ2-CB 4.27Å; W130-Q135 HydrophobicContact CZ3-CB 3.72Å; W130-Q135 HydrophobicContact CZ3-CG 3.8Å; W130-Q135 PolarHBondContact O-N 3.37Å
131	K	98.3	Very high	97.6	Very high	65 Å²	65	73.2 Å²	73.2	28%	0.283	37%	0.367	S	S	.	.	H	α-helix	trans	-57.6	-43.5	175.5	-71.6	-173.5	-74.5	167	0	111.8	K125 W127 E128 Q135	K125-K131 HydrophobicContact CB-CD 4.21Å; K125-K131 HydrophobicContact CB-CG 4.36Å; K125-K131 VanDerWaalsContact O-CE 3.26Å; K125-K131 WeakPolarHBondContact O-CE 3.33Å; W127-K131 PolarHBondContact O-N 2.74Å; W127-K131 VanDerWaalsContact O-N 3.17Å; E128-K131 PolarHBondContact O-N 2.87Å; E128-K131 WeakPolarHBondContact OE1-CE 3.27Å; E128-K131 IonicContact OE1-NZ 2.88Å; E128-K131 PolarHBondContact OE1-NZ 2.69Å; E128-K131 WeakPolarHBondContact OE2-CE 3.42Å; E128-K131 IonicContact OE2-NZ 2.75Å; E128-K131 PolarHBondContact OE2-NZ 3.31Å; K131-Q135 WeakPolarHBondContact O-CB 3.48Å
132	N	98.3	Very high	97.7	Very high	103 Å²	103	67.7 Å²	67.7	55%	0.551	33%	0.328	S	S	*	.	H	α-helix	trans	-79.2	-28.1	-173.6	-65.4	-17.8	0	0	0	114.1	E128 A129 W130	E128-N132 VanDerWaalsContact O-CG 3.31Å; E128-N132 PolarHBondContact O-N 2.89Å; E128-N132 PolarHBondContact O-ND2 3.37Å; A129-N132 PolarHBondContact O-N 3.47Å; W130-N132 VanDerWaalsContact C-N 3.29Å; W130-N132 PolarHBondContact O-N 3.34Å
133	H	98.4	Very high	97.9	Very high	76 Å²	76	63.4 Å²	63.4	35%	0.352	31%	0.311	S	S	.	.	H	α-helix	trans	-123.6	-12.2	-169.4	-59.2	-69	0	0	0	115.5	W52 A129	W52-H133 HydrophobicContact CB-CB 4.31Å; W52-H133 HydrophobicContact CD2-CB 3.58Å; W52-H133 AromaticContact CD2-CD2 3.61Å; W52-H133 AromaticContact CD2-CG 3.42Å; W52-H133 VanDerWaalsContact CD2-CG 3.42Å; W52-H133 AromaticContact CD2-ND1 3.88Å; W52-H133 AromaticContact CE2-CG 3.71Å; W52-H133 AromaticContact CE2-ND1 3.99Å; W52-H133 HydrophobicContact CE3-CB 4.33Å; W52-H133 AromaticContact CE3-CD2 3.59Å; W52-H133 AromaticContact CE3-CE1 3.76Å; W52-H133 AromaticContact CE3-CG 3.66Å; W52-H133 AromaticContact CE3-ND1 3.77Å; W52-H133 AromaticContact CE3-NE2 3.66Å; W52-H133 HydrophobicContact CG-CB 3.52Å; W52-H133 AromaticContact CG-CD2 3.76Å; W52-H133 AromaticContact CG-CG 3.72Å; W52-H133 AromaticContact CH2-ND1 3.88Å; W52-H133 HydrophobicContact CZ2-CB 4.23Å; W52-H133 AromaticContact CZ2-ND1 4Å; W52-H133 AromaticContact CZ3-CE1 3.71Å; W52-H133 AromaticContact CZ3-ND1 3.77Å; A129-H133 WeakPolarHBondContact O-CB 3.44Å; A129-H133 PolarHBondContact O-CD2 3.5Å; A129-H133 VanDerWaalsContact O-CD2 3.26Å; A129-H133 PolarHBondContact O-N 2.73Å
134	C	98.6	Very high	97.9	Very high	2 Å²	2	70.6 Å²	70.6	1%	0.014	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.7	-37	-173.7	-52.4	0	0	0	0	112.4	C48 W130 K136 Q137 V139	C48-C134 HydrophobicContact CB-CB 3.87Å; C48-C134 WeakPolarHBondContact CB-SG 3.5Å; C48-C134 VanDerWaalsContact SG-CA 3.53Å; C48-C134 WeakPolarHBondContact SG-CB 3.37Å; C48-C134 CovalentContact SG-SG 2.03Å; C48-C134 PolarHBondContact SG-SG 3.36Å; W130-C134 HydrophobicContact CD2-CB 4.38Å; W130-C134 HydrophobicContact CG-CB 3.86Å; W130-C134 WeakPolarHBondContact O-CA 3.17Å; W130-C134 VanDerWaalsContact O-CB 3.26Å; W130-C134 WeakPolarHBondContact O-CB 3.49Å; W130-C134 PolarHBondContact O-N 3.02Å; C134-K136 PolarHBondContact O-N 3.21Å; C134-Q137 WeakPolarHBondContact O-CB 2.93Å; C134-Q137 PolarHBondContact O-N 2.8Å; C134-Q137 VanDerWaalsContact O-N 3.14Å; C134-V139 HydrophobicContact CB-CG1 4.2Å
135	Q	98.3	Very high	97.9	Very high	59 Å²	59	73.2 Å²	73.2	28%	0.276	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	129.4	-177.8	-171.8	176.7	16.2	0	0	110.8	W130 K131 Q137	W130-Q135 HydrophobicContact CE3-CB 4.14Å; W130-Q135 HydrophobicContact CH2-CB 3.81Å; W130-Q135 HydrophobicContact CH2-CG 3.71Å; W130-Q135 HydrophobicContact CZ2-CB 4.27Å; W130-Q135 HydrophobicContact CZ3-CB 3.72Å; W130-Q135 HydrophobicContact CZ3-CG 3.8Å; W130-Q135 PolarHBondContact O-N 3.37Å; K131-Q135 WeakPolarHBondContact O-CB 3.48Å; Q135-Q137 PolarHBondContact O-N 3.17Å
136	K	97.4	Very high	97.9	Very high	201 Å²	201	67.7 Å²	67.7	87%	0.874	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	19.2	-177.6	-59.4	171	-178.7	-175.9	0	114.3	C134	C134-K136 PolarHBondContact O-N 3.21Å
137	Q	97.6	Very high	97.9	Very high	118 Å²	118	73.8 Å²	73.8	55%	0.551	37%	0.368	S	S	*	.	S	Bend	trans	-103.3	157.8	174.3	-57.7	-58	-34.1	0	0	110.8	C134 Q135 V139	C134-Q137 WeakPolarHBondContact O-CB 2.93Å; C134-Q137 PolarHBondContact O-N 2.8Å; C134-Q137 VanDerWaalsContact O-N 3.14Å; Q135-Q137 PolarHBondContact O-N 3.17Å; Q137-V139 PolarHBondContact O-N 3.4Å; Q137-V139 VanDerWaalsContact O-N 3.09Å
138	D	97.9	Very high	97.7	Very high	102 Å²	102	76.3 Å²	76.3	55%	0.545	39%	0.385	S	S	.	.			trans	-71.8	102.4	164.6	-179.7	12	0	0	0	110.1	S140 Q141	D138-S140 VanDerWaalsContact CG-OG 3.25Å; D138-S140 WeakPolarHBondContact OD1-CB 3.48Å; D138-S140 PolarHBondContact OD1-N 3.43Å; D138-S140 PolarHBondContact OD1-OG 3.26Å; D138-S140 PolarHBondContact OD2-OG 2.85Å; D138-Q141 PolarHBondContact O-NE2 3.15Å
139	V	98.5	Very high	97.8	Very high	17 Å²	17	74.9 Å²	74.9	10%	0.103	38%	0.38	C	S	.	.			trans	-90.3	1	177.7	-65.4	0	0	0	0	113.3	A44 C48 C134 Q137 Q141 Y142	A44-V139 HydrophobicContact CB-CB 4.07Å; A44-V139 HydrophobicContact CB-CG2 3.64Å; C48-V139 HydrophobicContact CB-CB 4.49Å; C48-V139 HydrophobicContact CB-CG1 4Å; C134-V139 HydrophobicContact CB-CG1 4.2Å; Q137-V139 PolarHBondContact O-N 3.4Å; Q137-V139 VanDerWaalsContact O-N 3.09Å; V139-Q141 PolarHBondContact O-N 3.02Å; V139-Q141 VanDerWaalsContact O-N 3.17Å; V139-Y142 HydrophobicContact CB-CD2 3.92Å; V139-Y142 HydrophobicContact CB-CE2 4.35Å; V139-Y142 HydrophobicContact CG1-CD2 4.26Å; V139-Y142 HydrophobicContact CG1-CE2 4.23Å; V139-Y142 WeakPolarHBondContact O-CB 2.99Å; V139-Y142 VanDerWaalsContact O-CD2 3.29Å; V139-Y142 WeakPolarHBondContact O-CD2 3.27Å; V139-Y142 PolarHBondContact O-N 3.23Å
140	S	98.1	Very high	97.8	Very high	58 Å²	58	77.9 Å²	77.9	41%	0.406	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-58.2	-32.5	179.7	70.6	0	0	0	0	112.6	D138 Y142 L143 R144	D138-S140 VanDerWaalsContact CG-OG 3.25Å; D138-S140 WeakPolarHBondContact OD1-CB 3.48Å; D138-S140 PolarHBondContact OD1-N 3.43Å; D138-S140 PolarHBondContact OD1-OG 3.26Å; D138-S140 PolarHBondContact OD2-OG 2.85Å; S140-Y142 PolarHBondContact O-N 2.81Å; S140-Y142 VanDerWaalsContact O-N 3.1Å; S140-L143 PolarHBondContact O-N 2.9Å; S140-R144 PolarHBondContact O-N 2.61Å
141	Q	97.9	Very high	97.8	Very high	99 Å²	99	81.1 Å²	81.1	46%	0.463	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-55.4	-28.8	176.6	64.5	-179.3	-53.2	0	0	113.5	R23 D138 V139 L143 R144	R23-Q141 PolarHBondContact NH1-O 3.35Å; D138-Q141 PolarHBondContact O-NE2 3.15Å; V139-Q141 PolarHBondContact O-N 3.02Å; V139-Q141 VanDerWaalsContact O-N 3.17Å; Q141-L143 PolarHBondContact O-N 3.34Å; Q141-R144 PolarHBondContact O-N 2.75Å
142	Y	98.5	Very high	97.8	Very high	23 Å²	23	82 Å²	82	9%	0.09	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-70.1	-20	179.1	-66.2	-78.7	0	0	0	112.6	R23 C48 R51 W52 V139 S140	R23-Y142 VanDerWaalsContact CD-O 3.3Å; R23-Y142 WeakPolarHBondContact CD-O 3.46Å; R23-Y142 VanDerWaalsContact CG-O 3.31Å; R23-Y142 WeakPolarHBondContact CG-O 3.5Å; R23-Y142 VanDerWaalsContact NH1-C 3.29Å; R23-Y142 PolarHBondContact NH1-O 2.8Å; C48-Y142 HydrophobicContact CB-CD1 4.29Å; C48-Y142 HydrophobicContact CB-CD2 3.52Å; C48-Y142 HydrophobicContact CB-CE1 4.22Å; C48-Y142 HydrophobicContact CB-CE2 3.47Å; C48-Y142 VanDerWaalsContact CB-CE2 3.47Å; C48-Y142 HydrophobicContact CB-CG 3.96Å; C48-Y142 WeakPolarHBondContact SG-CE2 3.49Å; R51-Y142 HydrophobicContact CB-CD1 4.39Å; R51-Y142 HydrophobicContact CB-CE1 3.88Å; R51-Y142 HydrophobicContact CG-CE1 3.96Å; W52-Y142 AromaticContact NE1-CZ 3.94Å; W52-Y142 PolarHBondContact NE1-OH 3.08Å; V139-Y142 HydrophobicContact CB-CD2 3.92Å; V139-Y142 HydrophobicContact CB-CE2 4.35Å; V139-Y142 HydrophobicContact CG1-CD2 4.26Å; V139-Y142 HydrophobicContact CG1-CE2 4.23Å; V139-Y142 WeakPolarHBondContact O-CB 2.99Å; V139-Y142 VanDerWaalsContact O-CD2 3.29Å; V139-Y142 WeakPolarHBondContact O-CD2 3.27Å; V139-Y142 PolarHBondContact O-N 3.23Å; S140-Y142 PolarHBondContact O-N 2.81Å; S140-Y142 VanDerWaalsContact O-N 3.1Å
143	L	98.7	Very high	97.7	Very high	40 Å²	40	80.7 Å²	80.7	21%	0.209	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	-7.7	178.1	-57.4	-171.2	0	0	0	114	A27 L43 A44 S140 Q141 G145 C146 V148	A27-L143 HydrophobicContact CB-CD2 3.74Å; L43-L143 HydrophobicContact CB-CD1 4.12Å; L43-L143 HydrophobicContact CD2-CD1 4.17Å; L43-L143 HydrophobicContact CD2-CD2 4.18Å; L43-L143 HydrophobicContact CG-CD1 4.2Å; L43-L143 HydrophobicContact CG-CD2 4.03Å; A44-L143 HydrophobicContact CB-CD1 3.8Å; A44-L143 HydrophobicContact CB-CG 3.92Å; S140-L143 PolarHBondContact O-N 2.9Å; Q141-L143 PolarHBondContact O-N 3.34Å; L143-G145 PolarHBondContact O-N 3.01Å; L143-C146 VanDerWaalsContact O-CB 3.23Å; L143-C146 WeakPolarHBondContact O-CB 3.39Å; L143-C146 PolarHBondContact O-N 3.22Å; L143-C146 PolarHBondContact O-SG 3.38Å; L143-V148 HydrophobicContact CB-CG2 4.42Å; L143-V148 HydrophobicContact CD1-CG2 4.4Å; L143-V148 HydrophobicContact CD2-CG2 4.17Å
144	R	98.4	Very high	97.7	Very high	169 Å²	169	81 Å²	81	64%	0.638	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	123.7	-178.7	-168.7	-178.6	-61.8	157.9	2.1	111.5	R23 S140 Q141 C146	R23-R144 PolarHBondContact NH1-O 2.92Å; R23-R144 PolarHBondContact NH2-O 3.27Å; S140-R144 PolarHBondContact O-N 2.61Å; Q141-R144 PolarHBondContact O-N 2.75Å; R144-C146 VanDerWaalsContact C-N 3.31Å; R144-C146 PolarHBondContact O-N 2.83Å
145	G	98.1	Very high	97.6	Very high	71 Å²	71	86.6 Å²	86.6	73%	0.732	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	9.7	179.8	0	0	0	0	0	115.8	L143	L143-G145 PolarHBondContact O-N 3.01Å
146	C	97.9	Very high	97.6	Very high	0 Å²	0	88.8 Å²	88.8	0%	0	45%	0.454	C	S	.	.	S	Bend	trans	-89.8	-11.4	-177.1	-62	0	0	0	0	115.3	R23 C24 A27 R28 L143 R144 V148	R23-C146 PolarHBondContact NH1-SG 2.99Å; C24-C146 WeakPolarHBondContact CA-SG 3.34Å; C24-C146 HydrophobicContact CB-CB 3.57Å; C24-C146 WeakPolarHBondContact CB-SG 3.49Å; C24-C146 WeakPolarHBondContact SG-CA 3.07Å; C24-C146 WeakPolarHBondContact SG-CB 3.21Å; C24-C146 CovalentContact SG-SG 2.05Å; C24-C146 PolarHBondContact SG-SG 3.36Å; A27-C146 HydrophobicContact CB-CB 4.4Å; R28-C146 PolarHBondContact NH1-O 2.72Å; L143-C146 VanDerWaalsContact O-CB 3.23Å; L143-C146 WeakPolarHBondContact O-CB 3.39Å; L143-C146 PolarHBondContact O-N 3.22Å; L143-C146 PolarHBondContact O-SG 3.38Å; R144-C146 VanDerWaalsContact C-N 3.31Å; R144-C146 PolarHBondContact O-N 2.83Å; C146-V148 HydrophobicContact CB-CG2 3.84Å
147	Q	95.3	Very high	97.6	Very high	189 Å²	189	79.4 Å²	79.4	88%	0.883	42%	0.419	S	S	*	.			trans	54	52.1	-178.8	-59.2	171.9	-14.5	0	0	111.9
148	V	94.5	Very high	97.6	Very high	67 Å²	67	75.9 Å²	75.9	41%	0.406	41%	0.407	S	S	.	.			trans	-131.4	0	179.5	-73.9	0	0	0	0	110.8	A27 R28 K31 L43 L143 C146	A27-V148 HydrophobicContact CB-CG2 4.26Å; R28-V148 HydrophobicContact CB-CG1 4.28Å; R28-V148 HydrophobicContact CG-CG1 3.37Å; K31-V148 HydrophobicContact CD-CB 3.91Å; K31-V148 HydrophobicContact CD-CG1 4.13Å; K31-V148 VanDerWaalsContact CE-OXT 3.27Å; K31-V148 WeakPolarHBondContact CE-OXT 3.4Å; K31-V148 PolarHBondContact NZ-OXT 3.46Å; L43-V148 HydrophobicContact CD2-CB 3.99Å; L43-V148 HydrophobicContact CD2-CG2 3.83Å; L143-V148 HydrophobicContact CB-CG2 4.42Å; L143-V148 HydrophobicContact CD1-CG2 4.4Å; L143-V148 HydrophobicContact CD2-CG2 4.17Å; C146-V148 HydrophobicContact CB-CG2 3.84Å

Retrieved 148 of 148 residues in 166.4 ms (Link to these results)

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