A0A087XSZ3_POEFO Loading...

Dipeptidyl peptidase 2

Plays an important role in the degradation of some oligopeptides.

AlphaFold DB , UniProt , Accession A0A087XSZ3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 496 aa.

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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	41.1	Very low	28.7	Very low	240 Å²	240	143 Å²	143	100%	1.182	83%	0.83	S	S	*	*				0	91	0	-73.5	179.1	-172.7	0	0	107.7
2	T	30.5	Very low	28.5	Very low	146 Å²	146	140.9 Å²	140.9	90%	0.896	82%	0.821	S	S	*	*			trans	-157.7	93.2	174.9	30.3	0	0	0	0	105.7
3	A	29.6	Very low	28.3	Very low	103 Å²	103	136.5 Å²	136.5	85%	0.851	81%	0.811	S	S	*	*			trans	-102.1	118.5	170.5	0	0	0	0	0	107.3
4	G	27.4	Very low	28.3	Very low	73 Å²	73	135.1 Å²	135.1	75%	0.753	80%	0.803	S	S	*	*			trans	-75.2	137.5	179.4	0	0	0	0	0	111.8	I6	G4-I6 PolarHBondContact O-N 2.6Å
5	L	27.9	Very low	28.3	Very low	174 Å²	174	139.7 Å²	139.7	91%	0.911	81%	0.809	S	S	*	*			trans	-73.1	115.8	167.9	-119.4	81.1	0	0	0	108.6
6	I	28.8	Very low	28.4	Very low	138 Å²	138	137.9 Å²	137.9	71%	0.708	81%	0.806	S	S	*	*			trans	-92.1	116.1	170.5	-64.8	176.5	0	0	0	107.7	G4 F8	G4-I6 PolarHBondContact O-N 2.6Å; I6-F8 HydrophobicContact CG2-CD2 3.81Å; I6-F8 HydrophobicContact CG2-CE2 3.86Å; I6-F8 PolarHBondContact O-N 3.24Å
7	L	26.3	Very low	28.3	Very low	152 Å²	152	138.9 Å²	138.9	80%	0.796	81%	0.807	S	S	*	*			trans	-77	110.2	168.8	-135.3	87.7	0	0	0	107.7
8	F	25.1	Very low	28.2	Very low	178 Å²	178	136.5 Å²	136.5	78%	0.781	81%	0.806	S	S	*	*			trans	-88.8	102.8	168.4	-98.4	-87.2	0	0	0	109.2	I6 V10	I6-F8 HydrophobicContact CG2-CD2 3.81Å; I6-F8 HydrophobicContact CG2-CE2 3.86Å; I6-F8 PolarHBondContact O-N 3.24Å; F8-V10 PolarHBondContact O-N 3.2Å
9	T	26.4	Very low	28.2	Very low	119 Å²	119	138.2 Å²	138.2	73%	0.73	81%	0.81	S	S	*	*			trans	-81.3	102.5	160.5	33.3	0	0	0	0	108.3	T11	T9-T11 PolarHBondContact O-N 3.35Å
10	V	26.3	Very low	28.2	Very low	115 Å²	115	140.9 Å²	140.9	70%	0.697	81%	0.814	S	S	*	*			trans	-75.2	104.4	172.4	179.4	0	0	0	0	108.2	F8 V12	F8-V10 PolarHBondContact O-N 3.2Å; V10-V12 HydrophobicContact CG1-CG2 3.77Å; V10-V12 PolarHBondContact O-N 2.86Å
11	T	26.4	Very low	28	Very low	135 Å²	135	137.5 Å²	137.5	83%	0.828	81%	0.81	S	S	*	*			trans	-82.9	99.9	164.3	-9.8	0	0	0	0	107	T9 A13	T9-T11 PolarHBondContact O-N 3.35Å; T11-A13 PolarHBondContact O-N 3.39Å; T11-A13 VanDerWaalsContact O-N 3.14Å
12	V	26.2	Very low	27.3	Very low	118 Å²	118	134.4 Å²	134.4	72%	0.715	80%	0.797	S	S	*	*			trans	-74.2	98.9	169.6	178.6	0	0	0	0	107.1	V10 V14	V10-V12 HydrophobicContact CG1-CG2 3.77Å; V10-V12 PolarHBondContact O-N 2.86Å; V12-V14 PolarHBondContact O-N 2.83Å
13	A	26.3	Very low	27.1	Very low	84 Å²	84	132.1 Å²	132.1	69%	0.694	79%	0.787	S	S	*	*			trans	-74.1	111.4	165.1	0	0	0	0	0	108.1	T11 F15	T11-A13 PolarHBondContact O-N 3.39Å; T11-A13 VanDerWaalsContact O-N 3.14Å; A13-F15 PolarHBondContact O-N 2.82Å; A13-F15 VanDerWaalsContact O-N 3.14Å
14	V	28	Very low	27.1	Very low	116 Å²	116	136 Å²	136	70%	0.703	79%	0.787	S	S	*	*			trans	-63.6	105.7	170.6	175.3	0	0	0	0	108.2	V12	V12-V14 PolarHBondContact O-N 2.83Å
15	F	28.2	Very low	27	Very low	204 Å²	204	137.7 Å²	137.7	90%	0.895	78%	0.783	S	S	*	*			trans	-128.3	72.2	162.8	-101.8	-81.5	0	0	0	107.8	A13	A13-F15 PolarHBondContact O-N 2.82Å; A13-F15 VanDerWaalsContact O-N 3.14Å
16	C	29.4	Very low	27	Very low	112 Å²	112	138.3 Å²	138.3	76%	0.757	78%	0.781	S	S	*	*			trans	-155.2	79.8	164.7	-114.3	0	0	0	0	106
17	D	26.9	Very low	27	Very low	154 Å²	154	140.3 Å²	140.3	82%	0.824	79%	0.785	S	S	*	*			trans	-173.9	67.5	162.3	-94.1	-24.5	0	0	0	108.5
18	A	27.3	Very low	27	Very low	96 Å²	96	141.8 Å²	141.8	79%	0.793	79%	0.788	S	S	*	*	S	Bend	trans	-156.3	60.7	168.8	0	0	0	0	0	109.2
19	L	27.8	Very low	27.3	Very low	168 Å²	168	137.1 Å²	137.1	88%	0.88	78%	0.782	S	S	*	*	S	Bend	trans	-164.4	7.9	163.1	-102.2	163.6	0	0	0	113.9
20	H	27.2	Very low	27.5	Very low	192 Å²	192	138.3 Å²	138.3	89%	0.889	79%	0.79	S	S	*	*	S	Bend	trans	-105.6	26.8	172.2	-80.7	83.3	0	0	0	113
21	G	25.2	Very low	27.6	Very low	70 Å²	70	142.7 Å²	142.7	72%	0.722	80%	0.799	S	S	*	*			trans	-114.6	41.7	-173.2	0	0	0	0	0	114.4
22	L	26.2	Very low	27.8	Very low	175 Å²	175	140.8 Å²	140.8	92%	0.916	79%	0.791	S	S	*	*			trans	-101.5	85.8	154.8	-79.4	167	0	0	0	106.7	H24	L22-H24 PolarHBondContact O-N 2.71Å
23	S	26.5	Very low	28	Very low	98 Å²	98	140.5 Å²	140.5	69%	0.685	80%	0.801	S	S	*	*			trans	-45.7	130.3	170.1	-175.7	0	0	0	0	109.2	T25	S23-T25 VanDerWaalsContact C-N 3.29Å; S23-T25 PolarHBondContact O-N 3.04Å
24	H	29.9	Very low	28.4	Very low	186 Å²	186	140.4 Å²	140.4	86%	0.861	81%	0.808	S	S	*	*			trans	-45.7	101.5	154	-75.3	-84.5	0	0	0	107.3	L22 H26	L22-H24 PolarHBondContact O-N 2.71Å; H24-H26 PolarHBondContact O-N 3.4Å; H24-H26 VanDerWaalsContact O-N 3.14Å
25	T	25.4	Very low	28.9	Very low	108 Å²	108	138.9 Å²	138.9	66%	0.663	80%	0.803	S	S	*	*			trans	-70.3	109.9	170.6	35.5	0	0	0	0	105.5	S23 F27	S23-T25 VanDerWaalsContact C-N 3.29Å; S23-T25 PolarHBondContact O-N 3.04Å; T25-F27 PolarHBondContact O-N 3.3Å
26	H	27.3	Very low	29.7	Very low	186 Å²	186	133.8 Å²	133.8	86%	0.861	79%	0.793	S	S	*	*			trans	-46.7	109.2	158.2	-92.9	-55.5	0	0	0	107.5	H24 Q28	H24-H26 PolarHBondContact O-N 3.4Å; H24-H26 VanDerWaalsContact O-N 3.14Å; H26-Q28 VanDerWaalsContact C-N 3.31Å; H26-Q28 PolarHBondContact O-N 2.87Å
27	F	29.5	Very low	30.8	Very low	180 Å²	180	133.6 Å²	133.6	79%	0.789	78%	0.784	S	S	*	*			trans	-62.6	96.7	169.5	-90	-95.9	0	0	0	107.6	T25 A29	T25-F27 PolarHBondContact O-N 3.3Å; F27-A29 PolarHBondContact O-N 3.35Å
28	Q	25.4	Very low	32.2	Very low	183 Å²	183	127.5 Å²	127.5	86%	0.855	75%	0.753	S	S	*	*			trans	-83	95.7	154.4	-82.2	-176.7	-17.1	0	0	106.4	H26 T30	H26-Q28 VanDerWaalsContact C-N 3.31Å; H26-Q28 PolarHBondContact O-N 2.87Å; Q28-T30 PolarHBondContact O-N 3.36Å
29	A	32.2	Very low	34.8	Very low	81 Å²	81	130.6 Å²	130.6	67%	0.669	75%	0.751	S	S	*	*			trans	-51.8	127.3	166.2	0	0	0	0	0	108.9	F27 K31	F27-A29 PolarHBondContact O-N 3.35Å; A29-K31 PolarHBondContact O-N 2.87Å; A29-K31 VanDerWaalsContact O-N 3.11Å
30	T	29.7	Very low	38.1	Very low	144 Å²	144	123.3 Å²	123.3	88%	0.883	71%	0.712	S	S	*	*			trans	-63.1	112.5	170	29.4	0	0	0	0	108.2	Q28 S32	Q28-T30 PolarHBondContact O-N 3.36Å; T30-S32 PolarHBondContact O-N 3.14Å; T30-S32 VanDerWaalsContact O-N 3.16Å
31	K	29.4	Very low	41.5	Very low	206 Å²	206	117.9 Å²	117.9	90%	0.896	69%	0.693	S	S	*	*			trans	-50.7	115.3	179.2	-78.3	174.4	171.6	175.7	0	111.1	A29	A29-K31 PolarHBondContact O-N 2.87Å; A29-K31 VanDerWaalsContact O-N 3.11Å
32	S	30.7	Very low	44.9	Very low	95 Å²	95	118.2 Å²	118.2	66%	0.664	68%	0.676	S	S	*	*			trans	-75.6	132.3	152.8	80.2	0	0	0	0	107.8	T30 G34	T30-S32 PolarHBondContact O-N 3.14Å; T30-S32 VanDerWaalsContact O-N 3.16Å; S32-G34 PolarHBondContact O-N 2.8Å
33	A	30.2	Very low	48.4	Very low	112 Å²	112	113.9 Å²	113.9	93%	0.926	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	101.7	179.6	0	0	0	0	0	109
34	G	33.2	Very low	51.8	Low	82 Å²	82	113.7 Å²	113.7	85%	0.845	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	156.6	-20.8	164.2	0	0	0	0	0	119.2	S32	S32-G34 PolarHBondContact O-N 2.8Å
35	S	39.6	Very low	55.1	Low	85 Å²	85	105.3 Å²	105.3	59%	0.594	60%	0.597	S	S	*	*			trans	-106.9	130.4	178.1	63.4	0	0	0	0	111.5	D37	S35-D37 PolarHBondContact O-N 2.68Å
36	S	44.5	Very low	58.6	Low	96 Å²	96	104.6 Å²	104.6	67%	0.671	59%	0.593	S	S	*	*			trans	-67.5	98.3	162.4	53.5	0	0	0	0	107.4
37	D	53.2	Low	62	Low	109 Å²	109	95.8 Å²	95.8	58%	0.583	55%	0.552	S	S	*	*			trans	-52.1	132.6	174.3	-130	-1.6	0	0	0	108.8	S35 Q39	S35-D37 PolarHBondContact O-N 2.68Å; D37-Q39 PolarHBondContact O-N 3.29Å
38	P	56.8	Low	65.3	Low	25 Å²	25	89.4 Å²	89.4	16%	0.162	53%	0.528	C	S	.	.			trans	-60.4	117	-176.1	22.5	-31.1	0	0	0	109.5	F40 T101	P38-F40 HydrophobicContact CB-CD2 3.97Å; P38-F40 HydrophobicContact CB-CE2 3.63Å; P38-F40 HydrophobicContact CB-CZ 4.22Å; P38-F40 HydrophobicContact CG-CD2 4.01Å; P38-F40 HydrophobicContact CG-CE2 3.52Å; P38-F40 HydrophobicContact CG-CZ 4.4Å; P38-F40 WeakPolarHBondContact O-CD2 3.46Å; P38-F40 PolarHBondContact O-N 3.33Å; P38-T101 HydrophobicContact CB-CG2 3.96Å; P38-T101 HydrophobicContact CG-CG2 4.23Å
39	Q	82	Confident	68.7	Low	161 Å²	161	81.4 Å²	81.4	75%	0.752	49%	0.491	S	S	*	.			trans	-75.1	78.1	179.1	-165	179	29.9	0	0	108.9	D37	D37-Q39 PolarHBondContact O-N 3.29Å
40	F	96.4	Very high	71.9	Confident	16 Å²	16	78.5 Å²	78.5	7%	0.07	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-69.6	136.2	171.1	-73.7	-73.5	0	0	0	110.1	P38 L67 T69 W91 A94 T101 V111 F113	P38-F40 HydrophobicContact CB-CD2 3.97Å; P38-F40 HydrophobicContact CB-CE2 3.63Å; P38-F40 HydrophobicContact CB-CZ 4.22Å; P38-F40 HydrophobicContact CG-CD2 4.01Å; P38-F40 HydrophobicContact CG-CE2 3.52Å; P38-F40 HydrophobicContact CG-CZ 4.4Å; P38-F40 WeakPolarHBondContact O-CD2 3.46Å; P38-F40 PolarHBondContact O-N 3.33Å; F40-L67 HydrophobicContact CB-CB 4.11Å; F40-L67 HydrophobicContact CD1-CB 3.98Å; F40-L67 HydrophobicContact CG-CB 4.19Å; F40-T69 HydrophobicContact CD1-CG2 3.78Å; F40-T69 HydrophobicContact CE1-CG2 3.54Å; F40-T69 HydrophobicContact CZ-CG2 4.22Å; F40-W91 HydrophobicContact CB-CH2 3.79Å; F40-W91 HydrophobicContact CB-CZ3 3.89Å; F40-W91 HydrophobicContact CD2-CZ3 4.4Å; F40-A94 HydrophobicContact CD2-CB 4.29Å; F40-A94 HydrophobicContact CE2-CB 3.97Å; F40-A94 HydrophobicContact CZ-CB 4.39Å; F40-T101 HydrophobicContact CE2-CG2 4.35Å; F40-T101 HydrophobicContact CZ-CG2 3.79Å; F40-V111 HydrophobicContact CE1-CB 4.38Å; F40-V111 HydrophobicContact CE1-CG1 3.93Å; F40-V111 HydrophobicContact CZ-CG1 4.24Å; F40-F113 AromaticContact CE1-CD2 3.72Å; F40-F113 HydrophobicContact CE1-CD2 3.72Å; F40-F113 AromaticContact CE1-CE2 3.93Å; F40-F113 HydrophobicContact CE1-CE2 3.93Å; F40-F113 AromaticContact CZ-CD2 3.78Å; F40-F113 HydrophobicContact CZ-CD2 3.78Å; F40-F113 AromaticContact CZ-CE2 3.56Å; F40-F113 HydrophobicContact CZ-CE2 3.56Å
41	T	97.5	Very high	75.1	Confident	78 Å²	78	73.7 Å²	73.7	48%	0.479	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	123.8	166.5	-57.7	0	0	0	0	108.5	K43 I68	T41-K43 HydrophobicContact CG2-CG 4.16Å; T41-I68 PolarHBondContact N-O 2.95Å; T41-I68 PolarHBondContact O-N 3.32Å
42	E	98.4	Very high	78.4	Confident	77 Å²	77	69.4 Å²	69.4	36%	0.36	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	133.9	170.9	-170.5	176.3	82.2	0	0	110.3	F44 R65 L67 W91	E42-F44 HydrophobicContact CG-CE2 4.33Å; E42-R65 HydrophobicContact CG-CG 4.08Å; E42-R65 WeakPolarHBondContact OE2-CD 3.31Å; E42-R65 IonicContact OE2-NH1 3.12Å; E42-R65 PolarHBondContact OE2-NH1 2.9Å; E42-R65 VanDerWaalsContact OE2-NH1 3.12Å; E42-L67 HydrophobicContact CB-CD2 3.98Å; E42-L67 HydrophobicContact CG-CD2 3.96Å; E42-W91 HydrophobicContact CB-CZ2 4.15Å; E42-W91 PolarHBondContact OE2-NE1 2.88Å
43	K	98.6	Very high	81.6	Confident	84 Å²	84	68.2 Å²	68.2	37%	0.365	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	166.5	177.4	-67	-167.7	-179.7	-176.3	0	110.5	T41 R65 Y66 I68	T41-K43 HydrophobicContact CG2-CG 4.16Å; K43-R65 WeakPolarHBondContact O-CA 3.23Å; K43-Y66 HydrophobicContact CB-CD1 4.07Å; K43-Y66 HydrophobicContact CB-CD2 4.35Å; K43-Y66 HydrophobicContact CB-CE1 3.48Å; K43-Y66 VanDerWaalsContact CB-CE1 3.48Å; K43-Y66 HydrophobicContact CB-CE2 3.81Å; K43-Y66 HydrophobicContact CB-CG 4.47Å; K43-Y66 HydrophobicContact CD-CE2 4.09Å; K43-Y66 VanDerWaalsContact CD-OH 3.22Å; K43-Y66 WeakPolarHBondContact CD-OH 3.45Å; K43-Y66 HydrophobicContact CG-CE2 4.41Å; K43-Y66 PolarHBondContact N-O 3.11Å; K43-Y66 PolarHBondContact O-N 3.31Å; K43-I68 HydrophobicContact CD-CG2 3.8Å; K43-I68 HydrophobicContact CG-CG2 4.18Å
44	F	98.7	Very high	84.6	Confident	93 Å²	93	71.1 Å²	71.1	41%	0.408	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	136	175.6	-65.3	-92.5	0	0	0	109.6	E42 Q64 R65 Q121	E42-F44 HydrophobicContact CG-CE2 4.33Å; F44-Q64 CarbonylContact C-O 3.56Å; F44-Q64 WeakPolarHBondContact CA-O 3.36Å; F44-R65 HydrophobicContact CD1-CB 3.98Å; F44-R65 HydrophobicContact CD1-CG 4.44Å; F44-R65 HydrophobicContact CE1-CB 3.7Å; F44-R65 HydrophobicContact CE1-CG 3.95Å; F44-R65 HydrophobicContact CZ-CB 4.41Å; F44-R65 HydrophobicContact CZ-CG 4.16Å; F44-Q121 HydrophobicContact CE1-CB 4.44Å
45	F	98.8	Very high	87.5	Confident	10 Å²	10	74.4 Å²	74.4	4%	0.044	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	132.2	176.2	-179.6	-101.8	0	0	0	108.7	Q47 Q64 Y66 L149 M150 E153	F45-Q47 HydrophobicContact CD1-CB 4.07Å; F45-Q47 HydrophobicContact CE1-CB 4.42Å; F45-Q47 PolarHBondContact O-N 3.26Å; F45-Q47 VanDerWaalsContact O-N 3.14Å; F45-Q64 PolarHBondContact N-O 3.37Å; F45-Q64 PolarHBondContact O-N 3.34Å; F45-Y66 HydrophobicContact CB-CD1 3.98Å; F45-Y66 HydrophobicContact CB-CE1 3.93Å; F45-L149 HydrophobicContact CE1-CD2 4.26Å; F45-L149 HydrophobicContact CE1-CG 4.24Å; F45-L149 HydrophobicContact CZ-CD2 4.47Å; F45-L149 HydrophobicContact CZ-CG 4.18Å; F45-M150 HydrophobicContact CB-CE 3.83Å; F45-M150 HydrophobicContact CD1-CB 4.18Å; F45-M150 HydrophobicContact CD1-CE 4.19Å; F45-M150 HydrophobicContact CD1-CG 4.32Å; F45-M150 HydrophobicContact CD2-CG 4.26Å; F45-M150 HydrophobicContact CE1-CB 4.21Å; F45-M150 HydrophobicContact CG-CB 4.45Å; F45-M150 HydrophobicContact CG-CE 4.15Å; F45-M150 HydrophobicContact CG-CG 4.1Å; F45-M150 HydrophobicContact CZ-CB 4.49Å; F45-E153 HydrophobicContact CE2-CB 3.84Å; F45-E153 WeakPolarHBondContact CE2-OE2 3.37Å; F45-E153 HydrophobicContact CZ-CB 4.08Å; F45-E153 HydrophobicContact CZ-CG 4.32Å; F45-E153 WeakPolarHBondContact CZ-OE2 3.36Å
46	T	98.6	Very high	89.8	Confident	94 Å²	94	73 Å²	73	58%	0.577	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	102.7	174.2	-58	0	0	0	0	108.7	T61	T46-T61 HydrophobicContact CG2-CG2 3.91Å
47	Q	98.7	Very high	92	Very high	0 Å²	0	71.3 Å²	71.3	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	148.6	-173.4	-175.1	55.6	-94.2	0	0	111.5	F45 H51 T61 F62 Q64 D146	F45-Q47 HydrophobicContact CD1-CB 4.07Å; F45-Q47 HydrophobicContact CE1-CB 4.42Å; F45-Q47 PolarHBondContact O-N 3.26Å; F45-Q47 VanDerWaalsContact O-N 3.14Å; Q47-H51 PolarHBondContact OE1-CE1 3.14Å; Q47-H51 PolarHBondContact OE1-NE2 3.26Å; Q47-T61 CarbonylContact O-C 3.52Å; Q47-T61 WeakPolarHBondContact O-CA 3.44Å; Q47-T61 WeakPolarHBondContact O-CB 3.4Å; Q47-F62 HydrophobicContact CB-CD1 3.87Å; Q47-F62 HydrophobicContact CB-CE1 3.52Å; Q47-F62 HydrophobicContact CB-CZ 3.88Å; Q47-F62 HydrophobicContact CG-CD1 4.13Å; Q47-F62 HydrophobicContact CG-CE1 3.33Å; Q47-F62 HydrophobicContact CG-CZ 3.69Å; Q47-F62 PolarHBondContact N-O 3.35Å; Q47-F62 PolarHBondContact O-N 3.49Å; Q47-Q64 HydrophobicContact CB-CB 3.84Å; Q47-Q64 HydrophobicContact CG-CB 4.39Å; Q47-D146 HydrophobicContact CG-CB 4.18Å; Q47-D146 WeakPolarHBondContact CG-OD1 3.29Å; Q47-D146 PolarHBondContact NE2-O 2.99Å; Q47-D146 PolarHBondContact OE1-OD1 2.93Å
48	T	98.1	Very high	93.7	Very high	46 Å²	46	68 Å²	68	28%	0.282	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	135.2	172.9	-61.1	0	0	0	0	110.9	R117	T48-R117 PolarHBondContact O-NH2 2.99Å; T48-R117 VanDerWaalsContact O-NH2 3.16Å
49	L	98.3	Very high	95.3	Very high	16 Å²	16	74.6 Å²	74.6	8%	0.084	39%	0.388	C	S	.	.	S	Bend	trans	-63.9	-52.9	177.3	-78	176.4	0	0	0	111.9	M57 G60 F62 R117 P124 F125 L137	L49-M57 HydrophobicContact CB-CB 4.07Å; L49-M57 HydrophobicContact CB-CG 4.32Å; L49-M57 HydrophobicContact CD1-CB 4.31Å; L49-G60 PolarHBondContact N-O 3.09Å; L49-F62 HydrophobicContact CD2-CB 3.92Å; L49-F62 HydrophobicContact CD2-CD1 3.88Å; L49-F62 HydrophobicContact CD2-CG 4.23Å; L49-R117 PolarHBondContact O-NH1 3.26Å; L49-R117 PolarHBondContact O-NH2 2.98Å; L49-P124 HydrophobicContact CD2-CB 3.58Å; L49-F125 HydrophobicContact CD1-CE1 4.2Å; L49-F125 HydrophobicContact CD2-CE1 4.36Å; L49-F125 HydrophobicContact CD2-CZ 4.28Å; L49-L137 HydrophobicContact CB-CD1 4.3Å
50	D	98.3	Very high	96	Very high	19 Å²	19	68 Å²	68	10%	0.102	36%	0.362	C	S	.	.			trans	-128.7	108.5	-175.5	-168.3	-16.9	0	0	0	110.9	F52 N53 S56 M57 L137 Q142	D50-F52 VanDerWaalsContact C-N 3.33Å; D50-F52 PolarHBondContact OD1-N 3.35Å; D50-N53 PolarHBondContact OD1-N 3.31Å; D50-N53 VanDerWaalsContact OD1-N 3.1Å; D50-N53 WeakPolarHBondContact OD2-CB 3.27Å; D50-S56 PolarHBondContact OD2-OG 2.83Å; D50-M57 HydrophobicContact CB-CB 4.13Å; D50-M57 HydrophobicContact CB-CG 4Å; D50-L137 HydrophobicContact CB-CD1 4.31Å; D50-L137 HydrophobicContact CB-CD2 4.11Å; D50-L137 WeakPolarHBondContact OD2-CD2 3.18Å; D50-Q142 PolarHBondContact OD1-NE2 3.11Å
51	H	98.2	Very high	96	Very high	43 Å²	43	71 Å²	71	20%	0.199	38%	0.382	C	S	.	.	S	Bend	trans	-78	-18	-179.9	-67.5	-79.5	0	0	0	113.7	Q47 Q142 A145 D146	Q47-H51 PolarHBondContact OE1-CE1 3.14Å; Q47-H51 PolarHBondContact OE1-NE2 3.26Å; H51-Q142 PolarHBondContact CD2-OE1 3.5Å; H51-Q142 VanDerWaalsContact CD2-OE1 3.25Å; H51-A145 HydrophobicContact CB-CB 3.78Å; H51-A145 VanDerWaalsContact CG-CB 3.49Å; H51-D146 IonicContact CD2-OD1 3.48Å; H51-D146 PolarHBondContact CD2-OD1 3.09Å; H51-D146 IonicContact CE1-OD1 3.82Å; H51-D146 IonicContact NE2-OD1 2.71Å; H51-D146 PolarHBondContact NE2-OD1 3.03Å
52	F	97.9	Very high	96.1	Very high	117 Å²	117	67.9 Å²	67.9	51%	0.513	36%	0.362	S	S	.	.	S	Bend	trans	-112.9	-6.5	-168.3	-57.8	-69.6	0	0	0	113.5	D50 E141 Q142 A145	D50-F52 VanDerWaalsContact C-N 3.33Å; D50-F52 PolarHBondContact OD1-N 3.35Å; F52-E141 HydrophobicContact CE2-CB 3.62Å; F52-E141 HydrophobicContact CZ-CB 3.6Å; F52-Q142 HydrophobicContact CD2-CG 3.93Å; F52-Q142 HydrophobicContact CE2-CB 4.4Å; F52-Q142 HydrophobicContact CE2-CG 3.93Å; F52-A145 HydrophobicContact CE2-CB 4.39Å; F52-A145 HydrophobicContact CZ-CB 4.02Å
53	N	97	Very high	96.1	Very high	69 Å²	69	67.5 Å²	67.5	37%	0.369	37%	0.368	S	S	.	.			trans	-139.3	113.4	174.2	-174.9	-14.4	0	0	0	112.1	D50 N55 S56	D50-N53 PolarHBondContact OD1-N 3.31Å; D50-N53 VanDerWaalsContact OD1-N 3.1Å; D50-N53 WeakPolarHBondContact OD2-CB 3.27Å; N53-N55 PolarHBondContact O-N 3.45Å; N53-N55 PolarHBondContact OD1-N 3.49Å; N53-S56 WeakPolarHBondContact CB-OG 3.02Å; N53-S56 PolarHBondContact O-OG 2.05Å; N53-S56 PolarHBondContact OD1-N 3.48Å
54	F	94.5	Very high	96.1	Very high	174 Å²	174	63.5 Å²	63.5	76%	0.763	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-13.6	-178.6	-74	-102.4	0	0	0	114
55	N	93.7	Very high	96.1	Very high	150 Å²	150	59.2 Å²	59.2	80%	0.802	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	-30.7	-173.2	-65.3	-44.2	0	0	0	113.5	N53 M57	N53-N55 PolarHBondContact O-N 3.45Å; N53-N55 PolarHBondContact OD1-N 3.49Å; N55-M57 PolarHBondContact O-N 3Å
56	S	87.2	Confident	96.2	Very high	55 Å²	55	59.4 Å²	59.4	39%	0.385	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-42.2	-175.2	48.1	0	0	0	0	112.3	D50 N53	D50-S56 PolarHBondContact OD2-OG 2.83Å; N53-S56 WeakPolarHBondContact CB-OG 3.02Å; N53-S56 PolarHBondContact O-OG 2.05Å; N53-S56 PolarHBondContact OD1-N 3.48Å
57	M	91	Very high	96.2	Very high	61 Å²	61	54.9 Å²	54.9	30%	0.3	31%	0.305	S	S	.	.	S	Bend	trans	-126.1	5.4	-174.3	-59.9	-61.3	170.2	0	0	113.4	L49 D50 N55 N59 G60 F125 L137	L49-M57 HydrophobicContact CB-CB 4.07Å; L49-M57 HydrophobicContact CB-CG 4.32Å; L49-M57 HydrophobicContact CD1-CB 4.31Å; D50-M57 HydrophobicContact CB-CB 4.13Å; D50-M57 HydrophobicContact CB-CG 4Å; N55-M57 PolarHBondContact O-N 3Å; M57-N59 PolarHBondContact O-N 3.44Å; M57-G60 WeakPolarHBondContact O-CA 3.28Å; M57-G60 PolarHBondContact O-N 3.07Å; M57-F125 HydrophobicContact CE-CE1 4.43Å; M57-F125 HydrophobicContact CE-CZ 3.9Å; M57-F125 HydrophobicContact SD-CE1 4.24Å; M57-F125 HydrophobicContact SD-CZ 4.12Å; M57-L137 HydrophobicContact CE-CD1 4.14Å; M57-L137 HydrophobicContact CG-CD1 4.03Å
58	G	88.1	Confident	96.2	Very high	40 Å²	40	55.4 Å²	55.4	41%	0.412	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	-133.3	-176	0	0	0	0	0	112.4	G60	G58-G60 PolarHBondContact O-N 3.28Å
59	N	91.1	Very high	96.1	Very high	163 Å²	163	53.4 Å²	53.4	87%	0.872	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	27.7	174.1	-64.4	-13.8	0	0	0	112.4	M57	M57-N59 PolarHBondContact O-N 3.44Å
60	G	96.1	Very high	96.1	Very high	22 Å²	22	57.5 Å²	57.5	23%	0.227	32%	0.317	C	S	.	.			trans	-63	143.5	-178.4	0	0	0	0	0	112	L49 M57 G58	L49-G60 PolarHBondContact N-O 3.09Å; M57-G60 WeakPolarHBondContact O-CA 3.28Å; M57-G60 PolarHBondContact O-N 3.07Å; G58-G60 PolarHBondContact O-N 3.28Å
61	T	98.3	Very high	96	Very high	79 Å²	79	61.5 Å²	61.5	49%	0.485	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	160	-178.8	56.5	0	0	0	0	111.4	T46 Q47	T46-T61 HydrophobicContact CG2-CG2 3.91Å; Q47-T61 CarbonylContact O-C 3.52Å; Q47-T61 WeakPolarHBondContact O-CA 3.44Å; Q47-T61 WeakPolarHBondContact O-CB 3.4Å
62	F	98.8	Very high	95.9	Very high	13 Å²	13	61.8 Å²	61.8	6%	0.057	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	166	171.4	77.2	-75.7	0	0	0	111.1	Q47 L49 Q64 R117 P124	Q47-F62 HydrophobicContact CB-CD1 3.87Å; Q47-F62 HydrophobicContact CB-CE1 3.52Å; Q47-F62 HydrophobicContact CB-CZ 3.88Å; Q47-F62 HydrophobicContact CG-CD1 4.13Å; Q47-F62 HydrophobicContact CG-CE1 3.33Å; Q47-F62 HydrophobicContact CG-CZ 3.69Å; Q47-F62 PolarHBondContact N-O 3.35Å; Q47-F62 PolarHBondContact O-N 3.49Å; L49-F62 HydrophobicContact CD2-CB 3.92Å; L49-F62 HydrophobicContact CD2-CD1 3.88Å; L49-F62 HydrophobicContact CD2-CG 4.23Å; F62-Q64 HydrophobicContact CE2-CB 3.88Å; F62-Q64 HydrophobicContact CE2-CG 4.42Å; F62-Q64 HydrophobicContact CZ-CB 4.11Å; F62-R117 HydrophobicContact CE2-CB 4.4Å; F62-R117 HydrophobicContact CZ-CB 3.91Å; F62-P124 HydrophobicContact CB-CB 4.45Å; F62-P124 HydrophobicContact CD1-CB 4.32Å; F62-P124 HydrophobicContact CD1-CG 4.35Å; F62-P124 HydrophobicContact CD2-CB 4.4Å; F62-P124 HydrophobicContact CD2-CG 4.1Å; F62-P124 HydrophobicContact CE1-CG 4.29Å; F62-P124 HydrophobicContact CE2-CG 4.06Å; F62-P124 HydrophobicContact CG-CB 4.15Å; F62-P124 HydrophobicContact CG-CG 4.25Å; F62-P124 HydrophobicContact CZ-CG 4.16Å
63	S	98.7	Very high	95.9	Very high	69 Å²	69	57.3 Å²	57.3	48%	0.483	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	106.7	176.5	-67.1	0	0	0	0	110.2
64	Q	98.9	Very high	95.9	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	121.2	172.8	-173.8	-179.5	15.7	0	0	109.7	F44 F45 Q47 F62 E115 M150	F44-Q64 CarbonylContact C-O 3.56Å; F44-Q64 WeakPolarHBondContact CA-O 3.36Å; F45-Q64 PolarHBondContact N-O 3.37Å; F45-Q64 PolarHBondContact O-N 3.34Å; Q47-Q64 HydrophobicContact CB-CB 3.84Å; Q47-Q64 HydrophobicContact CG-CB 4.39Å; F62-Q64 HydrophobicContact CE2-CB 3.88Å; F62-Q64 HydrophobicContact CE2-CG 4.42Å; F62-Q64 HydrophobicContact CZ-CB 4.11Å; Q64-E115 WeakPolarHBondContact CG-O 3.45Å; Q64-E115 PolarHBondContact NE2-O 2.92Å; Q64-M150 HydrophobicContact CB-CE 4.38Å; Q64-M150 HydrophobicContact CG-CE 3.92Å
65	R	98.9	Very high	96	Very high	4 Å²	4	57.6 Å²	57.6	2%	0.015	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	143.7	179.1	-172.6	163.7	62.4	156.5	-0.6	110.9	E42 K43 F44 N89 I90 E115 S122	E42-R65 HydrophobicContact CG-CG 4.08Å; E42-R65 WeakPolarHBondContact OE2-CD 3.31Å; E42-R65 IonicContact OE2-NH1 3.12Å; E42-R65 PolarHBondContact OE2-NH1 2.9Å; E42-R65 VanDerWaalsContact OE2-NH1 3.12Å; K43-R65 WeakPolarHBondContact O-CA 3.23Å; F44-R65 HydrophobicContact CD1-CB 3.98Å; F44-R65 HydrophobicContact CD1-CG 4.44Å; F44-R65 HydrophobicContact CE1-CB 3.7Å; F44-R65 HydrophobicContact CE1-CG 3.95Å; F44-R65 HydrophobicContact CZ-CB 4.41Å; F44-R65 HydrophobicContact CZ-CG 4.16Å; R65-N89 VanDerWaalsContact NH2-CG 3.31Å; R65-N89 PolarHBondContact NH2-OD1 3.25Å; R65-I90 HydrophobicContact CG-CG2 4.39Å; R65-E115 HydrophobicContact CB-CB 4.06Å; R65-E115 WeakPolarHBondContact CB-OE2 3.43Å; R65-E115 IonicContact CZ-OE1 3.3Å; R65-E115 VanDerWaalsContact CZ-OE1 3.3Å; R65-E115 IonicContact CZ-OE2 3.61Å; R65-E115 IonicContact NE-OE1 3.19Å; R65-E115 PolarHBondContact NE-OE1 3.1Å; R65-E115 IonicContact NE-OE2 2.94Å; R65-E115 PolarHBondContact NE-OE2 3.33Å; R65-E115 IonicContact NH2-OE1 2.63Å; R65-E115 PolarHBondContact NH2-OE1 2.66Å; R65-E115 IonicContact NH2-OE2 3.48Å; R65-E115 PolarHBondContact NH2-OE2 3Å; R65-E115 WeakPolarHBondContact O-CB 3.45Å; R65-E115 PolarHBondContact O-N 3.4Å; R65-S122 WeakPolarHBondContact CB-OG 3Å; R65-S122 PolarHBondContact N-OG 3.16Å
66	Y	98.9	Very high	95.9	Very high	13 Å²	13	52.3 Å²	52.3	5%	0.051	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	155.4	166.5	71.1	-82.5	0	0	0	110.5	K43 F45 I68 I112 F113 M150 L154	K43-Y66 HydrophobicContact CB-CD1 4.07Å; K43-Y66 HydrophobicContact CB-CD2 4.35Å; K43-Y66 HydrophobicContact CB-CE1 3.48Å; K43-Y66 VanDerWaalsContact CB-CE1 3.48Å; K43-Y66 HydrophobicContact CB-CE2 3.81Å; K43-Y66 HydrophobicContact CB-CG 4.47Å; K43-Y66 HydrophobicContact CD-CE2 4.09Å; K43-Y66 VanDerWaalsContact CD-OH 3.22Å; K43-Y66 WeakPolarHBondContact CD-OH 3.45Å; K43-Y66 HydrophobicContact CG-CE2 4.41Å; K43-Y66 PolarHBondContact N-O 3.11Å; K43-Y66 PolarHBondContact O-N 3.31Å; F45-Y66 HydrophobicContact CB-CD1 3.98Å; F45-Y66 HydrophobicContact CB-CE1 3.93Å; Y66-I68 HydrophobicContact CD2-CB 4.16Å; Y66-I68 HydrophobicContact CD2-CG2 4.49Å; Y66-I68 HydrophobicContact CE2-CB 3.92Å; Y66-I68 HydrophobicContact CE2-CD1 4.31Å; Y66-I68 HydrophobicContact CE2-CG2 3.95Å; Y66-I112 HydrophobicContact CD2-CG2 4.01Å; Y66-F113 CarbonylContact C-O 3.42Å; Y66-F113 WeakPolarHBondContact CA-O 3.5Å; Y66-F113 WeakPolarHBondContact CB-O 3.26Å; Y66-M150 HydrophobicContact CD1-CE 4.27Å; Y66-M150 HydrophobicContact CD1-SD 4.37Å; Y66-M150 HydrophobicContact CG-CE 4.48Å; Y66-M150 HydrophobicContact CG-SD 4.19Å; Y66-L154 HydrophobicContact CD2-CD1 4.39Å; Y66-L154 HydrophobicContact CE2-CD1 3.99Å
67	L	98.8	Very high	96.3	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	138.5	174.6	-48.3	-178.5	0	0	0	108.6	F40 E42 I90 W91 A94 I112 F113	F40-L67 HydrophobicContact CB-CB 4.11Å; F40-L67 HydrophobicContact CD1-CB 3.98Å; F40-L67 HydrophobicContact CG-CB 4.19Å; E42-L67 HydrophobicContact CB-CD2 3.98Å; E42-L67 HydrophobicContact CG-CD2 3.96Å; L67-I90 HydrophobicContact CD1-CG1 4.5Å; L67-I90 HydrophobicContact CD1-CG2 4.03Å; L67-I90 HydrophobicContact CD2-CG2 4.23Å; L67-I90 HydrophobicContact CG-CG1 4.43Å; L67-I90 HydrophobicContact CG-CG2 3.89Å; L67-W91 HydrophobicContact CD1-CD2 3.52Å; L67-W91 HydrophobicContact CD1-CE3 3.59Å; L67-W91 HydrophobicContact CD1-CG 4Å; L67-W91 HydrophobicContact CD1-CH2 4.25Å; L67-W91 HydrophobicContact CD1-CZ2 4.2Å; L67-W91 HydrophobicContact CD1-CZ3 3.96Å; L67-W91 HydrophobicContact CD2-CD2 4.09Å; L67-W91 VanDerWaalsContact CD2-CE2 3.47Å; L67-W91 HydrophobicContact CD2-CH2 4.15Å; L67-W91 HydrophobicContact CD2-CZ2 3.53Å; L67-W91 HydrophobicContact CG-CD2 4.47Å; L67-W91 HydrophobicContact CG-CZ2 4.49Å; L67-A94 HydrophobicContact CD1-CB 3.66Å; L67-I112 CarbonylContact O-C 3.59Å; L67-I112 VanDerWaalsContact O-CA 3.28Å; L67-I112 WeakPolarHBondContact O-CA 3.38Å; L67-F113 HydrophobicContact CB-CB 4.18Å; L67-F113 PolarHBondContact N-O 3.42Å; L67-F113 PolarHBondContact O-N 3Å
68	I	98.6	Very high	96.6	Very high	10 Å²	10	52.2 Å²	52.2	5%	0.051	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	140.2	-179.7	-173.1	167.4	0	0	0	111.1	T41 K43 Y66 L110 V111 I112 L158	T41-I68 PolarHBondContact N-O 2.95Å; T41-I68 PolarHBondContact O-N 3.32Å; K43-I68 HydrophobicContact CD-CG2 3.8Å; K43-I68 HydrophobicContact CG-CG2 4.18Å; Y66-I68 HydrophobicContact CD2-CB 4.16Å; Y66-I68 HydrophobicContact CD2-CG2 4.49Å; Y66-I68 HydrophobicContact CE2-CB 3.92Å; Y66-I68 HydrophobicContact CE2-CD1 4.31Å; Y66-I68 HydrophobicContact CE2-CG2 3.95Å; I68-L110 HydrophobicContact CD1-CD1 4.04Å; I68-L110 HydrophobicContact CD1-CD2 4.36Å; I68-L110 HydrophobicContact CG1-CD1 3.94Å; I68-V111 WeakPolarHBondContact CA-O 3.38Å; I68-I112 HydrophobicContact CD1-CD1 4.37Å; I68-I112 HydrophobicContact CD1-CG1 4.15Å; I68-I112 HydrophobicContact CG1-CG1 4.08Å; I68-L158 HydrophobicContact CD1-CD1 4.01Å
69	T	97.8	Very high	97.1	Very high	5 Å²	5	50.4 Å²	50.4	3%	0.031	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	127.3	165.3	-177.1	0	0	0	0	110.2	F40 Q71 Y72 L110 V111	F40-T69 HydrophobicContact CD1-CG2 3.78Å; F40-T69 HydrophobicContact CE1-CG2 3.54Å; F40-T69 HydrophobicContact CZ-CG2 4.22Å; T69-Q71 WeakPolarHBondContact OG1-CB 3.41Å; T69-Q71 PolarHBondContact OG1-N 3.04Å; T69-Y72 HydrophobicContact CG2-CE2 4.49Å; T69-L110 WeakPolarHBondContact O-CD1 3.28Å; T69-V111 HydrophobicContact CG2-CB 3.86Å; T69-V111 HydrophobicContact CG2-CG2 4.38Å; T69-V111 PolarHBondContact N-O 3.45Å; T69-V111 PolarHBondContact O-N 3.46Å; T69-V111 VanDerWaalsContact O-N 3.12Å
70	D	96.7	Very high	97.5	Very high	101 Å²	101	42.8 Å²	42.8	54%	0.54	22%	0.222	S	C	.	.			trans	-102.6	8.3	175.4	65.9	-14.1	0	0	0	112.5	Y72 W73 L110	D70-Y72 PolarHBondContact O-N 2.92Å; D70-Y72 VanDerWaalsContact O-N 3.09Å; D70-W73 HydrophobicContact CB-CB 4.23Å; D70-W73 HydrophobicContact CB-CE3 4.14Å; D70-W73 WeakPolarHBondContact O-CB 3.38Å; D70-W73 PolarHBondContact O-N 3.37Å; D70-L110 HydrophobicContact CB-CD1 3.77Å
71	Q	96.6	Very high	97.6	Very high	104 Å²	104	41.8 Å²	41.8	49%	0.486	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-36.1	-177.5	179.9	-179.7	-13.6	0	0	113.2	T69	T69-Q71 WeakPolarHBondContact OG1-CB 3.41Å; T69-Q71 PolarHBondContact OG1-N 3.04Å
72	Y	95.9	Very high	97.7	Very high	49 Å²	49	38 Å²	38	19%	0.192	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-10.6	-179	-47.4	-64.9	0	0	0	113	T69 D70 K74 A104 A105 Q108	T69-Y72 HydrophobicContact CG2-CE2 4.49Å; D70-Y72 PolarHBondContact O-N 2.92Å; D70-Y72 VanDerWaalsContact O-N 3.09Å; Y72-K74 PolarHBondContact O-N 3.1Å; Y72-A104 WeakPolarHBondContact CB-O 3.29Å; Y72-A104 HydrophobicContact CD2-CB 3.87Å; Y72-A104 HydrophobicContact CG-CB 4.3Å; Y72-A105 HydrophobicContact CD1-CB 3.61Å; Y72-A105 HydrophobicContact CE1-CB 3.86Å; Y72-A105 HydrophobicContact CG-CB 4.2Å; Y72-Q108 CarbonylContact O-C 3.53Å; Y72-Q108 VanDerWaalsContact O-C 3.23Å; Y72-Q108 WeakPolarHBondContact O-CA 3.44Å
73	W	97.9	Very high	97.7	Very high	23 Å²	23	37.5 Å²	37.5	9%	0.087	19%	0.186	C	C	.	.			trans	-77.4	122.4	-161.8	-176.2	40.6	0	0	0	111.9	D70 K75 G78 Q108 L110 L158 A160	D70-W73 HydrophobicContact CB-CB 4.23Å; D70-W73 HydrophobicContact CB-CE3 4.14Å; D70-W73 WeakPolarHBondContact O-CB 3.38Å; D70-W73 PolarHBondContact O-N 3.37Å; W73-K75 VanDerWaalsContact C-N 3.27Å; W73-K75 HydrophobicContact CD2-CB 4.35Å; W73-K75 HydrophobicContact CE3-CB 4.07Å; W73-K75 HydrophobicContact CE3-CG 4.04Å; W73-K75 HydrophobicContact CH2-CB 4.46Å; W73-K75 HydrophobicContact CH2-CG 3.83Å; W73-K75 HydrophobicContact CZ2-CG 4.45Å; W73-K75 HydrophobicContact CZ3-CB 4.16Å; W73-K75 HydrophobicContact CZ3-CD 4.1Å; W73-K75 HydrophobicContact CZ3-CG 3.61Å; W73-K75 PolarHBondContact O-N 3.47Å; W73-G78 PolarHBondContact NE1-O 2.89Å; W73-G78 VanDerWaalsContact NE1-O 3.14Å; W73-Q108 WeakPolarHBondContact CA-O 3.4Å; W73-L110 HydrophobicContact CB-CB 4.12Å; W73-L110 HydrophobicContact CB-CD1 4.41Å; W73-L110 VanDerWaalsContact CD1-N 3.29Å; W73-L110 HydrophobicContact CD2-CB 3.87Å; W73-L110 HydrophobicContact CD2-CD1 4.22Å; W73-L110 HydrophobicContact CD2-CG 4.48Å; W73-L110 HydrophobicContact CE3-CD1 4.06Å; W73-L110 HydrophobicContact CG-CB 3.67Å; W73-L110 HydrophobicContact CG-CD1 4.4Å; W73-L158 HydrophobicContact CH2-CB 3.97Å; W73-L158 WeakPolarHBondContact CH2-O 3.43Å; W73-L158 HydrophobicContact CZ3-CB 4.34Å; W73-A160 HydrophobicContact CH2-CB 4.02Å; W73-A160 HydrophobicContact CZ2-CB 3.73Å
74	K	97.7	Very high	97.7	Very high	97 Å²	97	34.2 Å²	34.2	42%	0.422	16%	0.163	S	C	.	.			trans	-74.4	87	162.6	-172.6	175.2	172.5	-174.4	0	108.8	Y72 G76 Y77 G78 Q108	Y72-K74 PolarHBondContact O-N 3.1Å; K74-G76 PolarHBondContact O-N 3.43Å; K74-Y77 HydrophobicContact CD-CD1 3.71Å; K74-Y77 HydrophobicContact CD-CE1 4.47Å; K74-Y77 HydrophobicContact CD-CG 4.23Å; K74-Y77 HydrophobicContact CG-CD1 4.38Å; K74-Y77 PolarHBondContact O-N 3Å; K74-G78 PolarHBondContact O-N 3.34Å; K74-Q108 HydrophobicContact CB-CB 3.77Å; K74-Q108 PolarHBondContact N-O 2.82Å
75	K	96.2	Very high	97.7	Very high	152 Å²	152	34.2 Å²	34.2	66%	0.661	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-43.2	126.6	-174.3	-170.3	159.6	-171.4	171.7	0	113.2	W73 Y77	W73-K75 VanDerWaalsContact C-N 3.27Å; W73-K75 HydrophobicContact CD2-CB 4.35Å; W73-K75 HydrophobicContact CE3-CB 4.07Å; W73-K75 HydrophobicContact CE3-CG 4.04Å; W73-K75 HydrophobicContact CH2-CB 4.46Å; W73-K75 HydrophobicContact CH2-CG 3.83Å; W73-K75 HydrophobicContact CZ2-CG 4.45Å; W73-K75 HydrophobicContact CZ3-CB 4.16Å; W73-K75 HydrophobicContact CZ3-CD 4.1Å; W73-K75 HydrophobicContact CZ3-CG 3.61Å; W73-K75 PolarHBondContact O-N 3.47Å; K75-Y77 VanDerWaalsContact C-N 3.26Å; K75-Y77 PolarHBondContact O-N 3.23Å
76	G	92.1	Very high	97.6	Very high	39 Å²	39	34.2 Å²	34.2	40%	0.402	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.1	-2.9	-179.8	0	0	0	0	0	116.1	K74 C163	K74-G76 PolarHBondContact O-N 3.43Å; G76-C163 VanDerWaalsContact C-SG 3.54Å
77	Y	95.1	Very high	97.6	Very high	112 Å²	112	35.6 Å²	35.6	44%	0.439	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-130.2	-44.8	-178	178.9	-88.7	0	0	0	114	K74 K75 R486	K74-Y77 HydrophobicContact CD-CD1 3.71Å; K74-Y77 HydrophobicContact CD-CE1 4.47Å; K74-Y77 HydrophobicContact CD-CG 4.23Å; K74-Y77 HydrophobicContact CG-CD1 4.38Å; K74-Y77 PolarHBondContact O-N 3Å; K75-Y77 VanDerWaalsContact C-N 3.26Å; K75-Y77 PolarHBondContact O-N 3.23Å; Y77-R486 PolarHBondContact O-NH2 3.19Å
78	G	97.8	Very high	97.5	Very high	1 Å²	1	36 Å²	36	1%	0.01	18%	0.175	C	C	.	.	S	Bend	trans	-63	148.1	-179.2	0	0	0	0	0	111.8	W73 K74 Q108 C163	W73-G78 PolarHBondContact NE1-O 2.89Å; W73-G78 VanDerWaalsContact NE1-O 3.14Å; K74-G78 PolarHBondContact O-N 3.34Å; G78-Q108 WeakPolarHBondContact CA-O 3.43Å; G78-C163 WeakPolarHBondContact O-CB 3.36Å; G78-C163 PolarHBondContact O-SG 3.15Å
79	P	98.6	Very high	97.5	Very high	2 Å²	2	38 Å²	38	1%	0.013	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-65.2	167.4	178.9	31.4	-34.8	0	0	0	111.5	F81 Q107 A109 L110 P164 V482	P79-F81 HydrophobicContact CB-CE1 4.2Å; P79-F81 HydrophobicContact CG-CD1 4.41Å; P79-F81 HydrophobicContact CG-CE1 3.8Å; P79-F81 HydrophobicContact CG-CZ 4.33Å; P79-Q107 WeakPolarHBondContact CD-O 3.45Å; P79-A109 HydrophobicContact CG-CB 3.86Å; P79-A109 CarbonylContact O-C 3.58Å; P79-A109 WeakPolarHBondContact O-CA 3.33Å; P79-A109 WeakPolarHBondContact O-CB 3.38Å; P79-L110 PolarHBondContact O-N 3.27Å; P79-P164 CarbonylContact C-O 3.36Å; P79-P164 VanDerWaalsContact CA-O 3.23Å; P79-P164 WeakPolarHBondContact CA-O 3.44Å; P79-P164 WeakPolarHBondContact CB-O 3.36Å; P79-V482 HydrophobicContact CB-CG1 3.94Å; P79-V482 HydrophobicContact CB-CG2 3.75Å; P79-V482 HydrophobicContact CG-CG1 4.05Å; P79-V482 HydrophobicContact CG-CG2 4.03Å
80	I	98.9	Very high	97.5	Very high	4 Å²	4	37.8 Å²	37.8	2%	0.021	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	122.1	170	-55.6	176.2	0	0	0	107.5	L110 I112 K155 A160 C163 P164 V165 I166	I80-L110 CarbonylContact C-O 3.6Å; I80-L110 HydrophobicContact CD1-CD2 4.38Å; I80-L110 HydrophobicContact CG1-CB 4.3Å; I80-L110 HydrophobicContact CG1-CD2 4.14Å; I80-L110 HydrophobicContact CG2-CD2 4.32Å; I80-I112 HydrophobicContact CG2-CD1 3.9Å; I80-I112 HydrophobicContact CG2-CG1 4.33Å; I80-K155 HydrophobicContact CD1-CD 4.17Å; I80-K155 HydrophobicContact CD1-CG 3.54Å; I80-A160 HydrophobicContact CD1-CB 4.19Å; I80-C163 HydrophobicContact CD1-CB 4.41Å; I80-C163 HydrophobicContact CG1-CB 4.17Å; I80-P164 PolarHBondContact N-O 2.95Å; I80-V165 HydrophobicContact CB-CG1 4.47Å; I80-V165 HydrophobicContact CB-CG2 4.24Å; I80-V165 HydrophobicContact CD1-CG2 4.36Å; I80-V165 CarbonylContact O-C 3.51Å; I80-V165 WeakPolarHBondContact O-CA 3.47Å; I80-I166 PolarHBondContact O-N 3.09Å
81	F	98.9	Very high	97.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	116	168.6	-67.7	-7.7	0	0	0	108.2	P79 I100 L103 A104 Q107 A109 L110 V111 I112 I166 F168 I478	P79-F81 HydrophobicContact CB-CE1 4.2Å; P79-F81 HydrophobicContact CG-CD1 4.41Å; P79-F81 HydrophobicContact CG-CE1 3.8Å; P79-F81 HydrophobicContact CG-CZ 4.33Å; F81-I100 HydrophobicContact CB-CG2 3.98Å; F81-I100 HydrophobicContact CD2-CG2 4.18Å; F81-L103 HydrophobicContact CE2-CB 3.88Å; F81-L103 HydrophobicContact CE2-CD2 3.75Å; F81-L103 HydrophobicContact CE2-CG 3.58Å; F81-L103 HydrophobicContact CZ-CD2 3.9Å; F81-L103 HydrophobicContact CZ-CG 3.93Å; F81-A104 HydrophobicContact CD2-CB 3.98Å; F81-A104 HydrophobicContact CE2-CB 4.23Å; F81-Q107 HydrophobicContact CZ-CB 4Å; F81-Q107 HydrophobicContact CZ-CG 4.35Å; F81-A109 HydrophobicContact CD1-CB 3.93Å; F81-A109 HydrophobicContact CD2-CB 3.63Å; F81-A109 HydrophobicContact CE1-CB 3.99Å; F81-A109 HydrophobicContact CE2-CB 3.67Å; F81-A109 HydrophobicContact CG-CB 3.76Å; F81-A109 HydrophobicContact CZ-CB 3.86Å; F81-L110 PolarHBondContact N-O 2.91Å; F81-V111 WeakPolarHBondContact O-CA 3.32Å; F81-I112 PolarHBondContact O-N 2.79Å; F81-I166 WeakPolarHBondContact CA-O 3.47Å; F81-I166 HydrophobicContact CD1-CB 4.04Å; F81-I166 HydrophobicContact CD1-CG1 4.45Å; F81-I166 HydrophobicContact CE1-CB 4.26Å; F81-I166 HydrophobicContact CE1-CG1 4.27Å; F81-F168 HydrophobicContact CB-CD2 4.08Å; F81-F168 HydrophobicContact CB-CE2 3.52Å; F81-F168 HydrophobicContact CB-CZ 4.32Å; F81-F168 AromaticContact CD1-CE2 3.61Å; F81-F168 HydrophobicContact CD1-CE2 3.61Å; F81-F168 AromaticContact CD1-CZ 3.96Å; F81-F168 HydrophobicContact CD1-CZ 3.96Å; F81-F168 HydrophobicContact CD2-CE2 4.08Å; F81-F168 HydrophobicContact CD2-CZ 4.04Å; F81-F168 HydrophobicContact CE1-CE2 4.3Å; F81-F168 HydrophobicContact CE1-CZ 4.23Å; F81-F168 HydrophobicContact CE2-CZ 4.31Å; F81-F168 HydrophobicContact CG-CD2 4.47Å; F81-F168 AromaticContact CG-CE2 3.47Å; F81-F168 HydrophobicContact CG-CE2 3.47Å; F81-F168 VanDerWaalsContact CG-CE2 3.47Å; F81-F168 AromaticContact CG-CZ 3.86Å; F81-F168 HydrophobicContact CG-CZ 3.86Å; F81-F168 HydrophobicContact CZ-CZ 4.4Å; F81-I478 HydrophobicContact CE1-CG2 4.02Å; F81-I478 HydrophobicContact CZ-CG2 4.11Å
82	F	98.9	Very high	97.5	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	109.2	-171.6	-171.1	-81	0	0	0	109.5	T84 I112 A114 Y147 M150 I151 V165 I166 V167 F168	F82-T84 HydrophobicContact CD1-CG2 4.12Å; F82-T84 HydrophobicContact CE1-CG2 4.2Å; F82-I112 CarbonylContact C-O 3.59Å; F82-I112 WeakPolarHBondContact CA-O 3.31Å; F82-I112 HydrophobicContact CD2-CB 3.94Å; F82-I112 HydrophobicContact CD2-CD1 4.47Å; F82-I112 HydrophobicContact CD2-CG2 3.85Å; F82-I112 HydrophobicContact CE2-CB 4.42Å; F82-I112 HydrophobicContact CE2-CG2 3.81Å; F82-A114 HydrophobicContact CE1-CB 3.77Å; F82-A114 HydrophobicContact CE2-CB 3.96Å; F82-A114 HydrophobicContact CZ-CB 3.26Å; F82-Y147 AromaticContact CE1-CD1 3.78Å; F82-Y147 HydrophobicContact CE1-CD1 3.78Å; F82-Y147 AromaticContact CE1-CG 3.8Å; F82-Y147 HydrophobicContact CE1-CG 3.8Å; F82-Y147 AromaticContact CZ-CD1 3.83Å; F82-Y147 HydrophobicContact CZ-CD1 3.83Å; F82-Y147 HydrophobicContact CZ-CG 4.14Å; F82-M150 HydrophobicContact CE2-SD 3.99Å; F82-M150 HydrophobicContact CZ-SD 4.1Å; F82-I151 HydrophobicContact CD1-CD1 4.16Å; F82-I151 HydrophobicContact CD2-CD1 4.12Å; F82-I151 HydrophobicContact CD2-CG1 3.63Å; F82-I151 HydrophobicContact CE1-CD1 4.28Å; F82-I151 HydrophobicContact CE2-CD1 4.23Å; F82-I151 HydrophobicContact CE2-CG1 3.61Å; F82-I151 HydrophobicContact CG-CD1 4.06Å; F82-I151 HydrophobicContact CG-CG1 4.1Å; F82-I151 HydrophobicContact CZ-CD1 4.29Å; F82-I151 HydrophobicContact CZ-CG1 4.06Å; F82-V165 HydrophobicContact CB-CG1 4.1Å; F82-I166 PolarHBondContact N-O 2.98Å; F82-V167 HydrophobicContact CB-CG1 4.34Å; F82-V167 HydrophobicContact CD1-CG1 4.35Å; F82-V167 CarbonylContact O-C 3.53Å; F82-V167 WeakPolarHBondContact O-CA 3.33Å; F82-F168 PolarHBondContact O-N 3.12Å
83	Y	98.9	Very high	97.6	Very high	3 Å²	3	33.1 Å²	33.1	1%	0.012	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	121.4	172.8	-170.1	-83.9	0	0	0	109.6	G85 N86 I90 F93 I100 I112 F113 A114 F168 G170 L456	Y83-G85 PolarHBondContact O-N 3.04Å; Y83-N86 PolarHBondContact OH-OD1 3.41Å; Y83-N86 VanDerWaalsContact OH-OD1 3.04Å; Y83-I90 HydrophobicContact CD1-CD1 4.34Å; Y83-F93 HydrophobicContact CD1-CB 4.3Å; Y83-F93 HydrophobicContact CE1-CB 3.66Å; Y83-F93 HydrophobicContact CE1-CD1 4.47Å; Y83-F93 HydrophobicContact CE1-CD2 4.18Å; Y83-F93 AromaticContact CE1-CG 3.86Å; Y83-F93 HydrophobicContact CE1-CG 3.86Å; Y83-I100 HydrophobicContact CD2-CD1 3.6Å; Y83-I100 HydrophobicContact CE2-CD1 4.36Å; Y83-I112 PolarHBondContact N-O 3.46Å; Y83-F113 VanDerWaalsContact CB-CE1 3.48Å; Y83-F113 AromaticContact CD1-CD1 3.64Å; Y83-F113 HydrophobicContact CD1-CD1 3.64Å; Y83-F113 AromaticContact CD1-CE1 4Å; Y83-F113 HydrophobicContact CD1-CE1 4Å; Y83-F113 AromaticContact CD2-CD1 3.99Å; Y83-F113 HydrophobicContact CD2-CD1 3.99Å; Y83-F113 AromaticContact CD2-CE1 3.5Å; Y83-F113 HydrophobicContact CD2-CE1 3.5Å; Y83-F113 HydrophobicContact CD2-CZ 4.28Å; Y83-F113 HydrophobicContact CE1-CD1 4.49Å; Y83-F113 HydrophobicContact CE2-CE1 4.2Å; Y83-F113 AromaticContact CG-CD1 3.35Å; Y83-F113 HydrophobicContact CG-CD1 3.35Å; Y83-F113 AromaticContact CG-CE1 3.38Å; Y83-F113 HydrophobicContact CG-CE1 3.38Å; Y83-F113 HydrophobicContact CG-CG 4.26Å; Y83-F113 HydrophobicContact CG-CZ 4.33Å; Y83-A114 PolarHBondContact O-N 2.97Å; Y83-A114 VanDerWaalsContact O-N 3.15Å; Y83-F168 CarbonylContact C-O 3.57Å; Y83-F168 VanDerWaalsContact CA-O 3.28Å; Y83-F168 WeakPolarHBondContact CA-O 3.49Å; Y83-F168 HydrophobicContact CD2-CB 4.19Å; Y83-G170 PolarHBondContact OH-N 2.92Å; Y83-L456 HydrophobicContact CE2-CD1 4.33Å
84	T	98.9	Very high	97.6	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	92.3	173.4	49.2	0	0	0	0	108.4	F82 Y147 V167 F168 G173 L176 S177 M180	F82-T84 HydrophobicContact CD1-CG2 4.12Å; F82-T84 HydrophobicContact CE1-CG2 4.2Å; T84-Y147 HydrophobicContact CG2-CD2 3.82Å; T84-Y147 HydrophobicContact CG2-CE2 4.08Å; T84-Y147 HydrophobicContact CG2-CG 4.47Å; T84-V167 HydrophobicContact CG2-CB 4.26Å; T84-V167 HydrophobicContact CG2-CG1 4.34Å; T84-F168 PolarHBondContact N-O 3.34Å; T84-F168 PolarHBondContact OG1-O 3.07Å; T84-G173 WeakPolarHBondContact O-CA 3.31Å; T84-G173 PolarHBondContact OG1-O 2.86Å; T84-L176 HydrophobicContact CG2-CB 4.5Å; T84-S177 PolarHBondContact OG1-N 3.47Å; T84-S177 PolarHBondContact OG1-OG 3.48Å; T84-M180 HydrophobicContact CG2-CG 3.87Å
85	G	98.8	Very high	97.5	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.158	C	C	.	.			trans	-50.1	149.4	179.3	0	0	0	0	0	112.2	Y83 A114 H116 Y147 L176	Y83-G85 PolarHBondContact O-N 3.04Å; G85-A114 WeakPolarHBondContact CA-O 3.34Å; G85-A114 PolarHBondContact N-O 3.26Å; G85-H116 PolarHBondContact O-CD2 3.28Å; G85-Y147 PolarHBondContact N-OH 3.26Å; G85-Y147 PolarHBondContact O-OH 3.14Å; G85-L176 VanDerWaalsContact O-CD1 3.24Å; G85-L176 WeakPolarHBondContact O-CD1 3.43Å
86	N	98.3	Very high	97.5	Very high	3 Å²	3	25.1 Å²	25.1	2%	0.016	13%	0.129	C	C	.	.			trans	-127.6	-146.6	-173.1	60.8	-76	0	0	0	110.4	Y83 G88 F93 H116 Y172 L176	Y83-N86 PolarHBondContact OH-OD1 3.41Å; Y83-N86 VanDerWaalsContact OH-OD1 3.04Å; N86-G88 PolarHBondContact O-N 2.97Å; N86-F93 HydrophobicContact CB-CZ 4.38Å; N86-F93 WeakPolarHBondContact ND2-CE1 3.26Å; N86-F93 WeakPolarHBondContact ND2-CZ 3.47Å; N86-F93 WeakPolarHBondContact OD1-CD1 3.12Å; N86-F93 WeakPolarHBondContact OD1-CE1 3.36Å; N86-F93 WeakPolarHBondContact OD1-CE2 3.37Å; N86-F93 VanDerWaalsContact OD1-CZ 3.24Å; N86-F93 WeakPolarHBondContact OD1-CZ 3.4Å; N86-H116 WeakPolarHBondContact O-CB 3.22Å; N86-Y172 HydrophobicContact CB-CD1 3.78Å; N86-Y172 HydrophobicContact CB-CG 4.38Å; N86-L176 HydrophobicContact CB-CD1 4.49Å
87	E	98.2	Very high	97.8	Very high	42 Å²	42	23.5 Å²	23.5	20%	0.196	11%	0.111	C	C	.	.	S	Bend	trans	-73.7	47.8	-165.2	69	-76.5	-176	0	0	115.1	Y119 S171 Y172 W356	E87-Y119 VanDerWaalsContact C-CE1 3.45Å; E87-Y119 HydrophobicContact CB-CD1 4.37Å; E87-Y119 HydrophobicContact CB-CE1 3.6Å; E87-S171 PolarHBondContact OE1-OG 3.33Å; E87-Y172 HydrophobicContact CB-CD1 4.45Å; E87-Y172 VanDerWaalsContact OE2-CB 3.3Å; E87-Y172 WeakPolarHBondContact OE2-CB 3.49Å; E87-Y172 WeakPolarHBondContact OE2-CD1 3.2Å; E87-W356 HydrophobicContact CB-CB 4.38Å; E87-W356 HydrophobicContact CB-CD2 4.1Å; E87-W356 HydrophobicContact CB-CE3 3.66Å; E87-W356 HydrophobicContact CB-CG 4.42Å; E87-W356 HydrophobicContact CB-CZ3 4.28Å; E87-W356 HydrophobicContact CG-CD2 4.13Å; E87-W356 HydrophobicContact CG-CE3 4.02Å; E87-W356 HydrophobicContact CG-CG 4.49Å; E87-W356 HydrophobicContact CG-CZ3 4.44Å
88	G	97.4	Very high	97.9	Very high	9 Å²	9	19 Å²	19	9%	0.093	10%	0.098	C	C	.	.	S	Bend	trans	-179.2	-174.1	176.8	0	0	0	0	0	114.9	N86 I90 F93	N86-G88 PolarHBondContact O-N 2.97Å; G88-I90 PolarHBondContact O-N 2.95Å; G88-F93 WeakPolarHBondContact O-CE2 3.15Å
89	N	97.4	Very high	97.9	Very high	53 Å²	53	19.3 Å²	19.3	28%	0.283	10%	0.099	S	C	.	.			trans	-59.7	125.9	175.7	-176.3	-22.3	0	0	0	111.9	R65 W91 E92 D352	R65-N89 VanDerWaalsContact NH2-CG 3.31Å; R65-N89 PolarHBondContact NH2-OD1 3.25Å; N89-W91 PolarHBondContact O-N 2.83Å; N89-W91 VanDerWaalsContact O-N 3.1Å; N89-W91 PolarHBondContact OD1-N 3.06Å; N89-W91 VanDerWaalsContact OD1-N 3.09Å; N89-E92 HydrophobicContact CB-CG 4.34Å; N89-E92 WeakPolarHBondContact O-CB 3.43Å; N89-E92 PolarHBondContact O-N 3.1Å; N89-D352 PolarHBondContact N-OD2 3.42Å
90	I	98.4	Very high	97.9	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-59.9	-26.9	-175.4	-163.1	55.4	0	0	0	114.9	R65 L67 Y83 G88 E92 F93 A94 F113 A114 E115	R65-I90 HydrophobicContact CG-CG2 4.39Å; L67-I90 HydrophobicContact CD1-CG1 4.5Å; L67-I90 HydrophobicContact CD1-CG2 4.03Å; L67-I90 HydrophobicContact CD2-CG2 4.23Å; L67-I90 HydrophobicContact CG-CG1 4.43Å; L67-I90 HydrophobicContact CG-CG2 3.89Å; Y83-I90 HydrophobicContact CD1-CD1 4.34Å; G88-I90 PolarHBondContact O-N 2.95Å; I90-E92 VanDerWaalsContact C-N 3.32Å; I90-E92 PolarHBondContact O-N 2.79Å; I90-F93 HydrophobicContact CD1-CD2 4.07Å; I90-F93 PolarHBondContact O-N 3.19Å; I90-A94 PolarHBondContact O-N 3.32Å; I90-F113 HydrophobicContact CD1-CB 3.83Å; I90-F113 HydrophobicContact CD1-CD1 4.36Å; I90-F113 HydrophobicContact CG1-CB 3.74Å; I90-A114 WeakPolarHBondContact CD1-O 3.31Å; I90-E115 HydrophobicContact CB-CB 3.71Å; I90-E115 HydrophobicContact CB-CG 3.99Å; I90-E115 WeakPolarHBondContact CB-OE1 3.2Å; I90-E115 HydrophobicContact CG1-CB 4.17Å; I90-E115 HydrophobicContact CG2-CB 3.99Å; I90-E115 HydrophobicContact CG2-CG 4.37Å; I90-E115 WeakPolarHBondContact CG2-OE1 3.32Å; I90-E115 PolarHBondContact N-OE1 3.45Å
91	W	97.4	Very high	97.9	Very high	70 Å²	70	19.6 Å²	19.6	27%	0.265	10%	0.101	S	C	.	.	H	α-helix	trans	-65.2	-35.5	176.4	-79.8	104.6	0	0	0	112.5	F40 E42 L67 N89 F93 A94 L95	F40-W91 HydrophobicContact CB-CH2 3.79Å; F40-W91 HydrophobicContact CB-CZ3 3.89Å; F40-W91 HydrophobicContact CD2-CZ3 4.4Å; E42-W91 HydrophobicContact CB-CZ2 4.15Å; E42-W91 PolarHBondContact OE2-NE1 2.88Å; L67-W91 HydrophobicContact CD1-CD2 3.52Å; L67-W91 HydrophobicContact CD1-CE3 3.59Å; L67-W91 HydrophobicContact CD1-CG 4Å; L67-W91 HydrophobicContact CD1-CH2 4.25Å; L67-W91 HydrophobicContact CD1-CZ2 4.2Å; L67-W91 HydrophobicContact CD1-CZ3 3.96Å; L67-W91 HydrophobicContact CD2-CD2 4.09Å; L67-W91 VanDerWaalsContact CD2-CE2 3.47Å; L67-W91 HydrophobicContact CD2-CH2 4.15Å; L67-W91 HydrophobicContact CD2-CZ2 3.53Å; L67-W91 HydrophobicContact CG-CD2 4.47Å; L67-W91 HydrophobicContact CG-CZ2 4.49Å; N89-W91 PolarHBondContact O-N 2.83Å; N89-W91 VanDerWaalsContact O-N 3.1Å; N89-W91 PolarHBondContact OD1-N 3.06Å; N89-W91 VanDerWaalsContact OD1-N 3.09Å; W91-F93 VanDerWaalsContact C-N 3.3Å; W91-F93 PolarHBondContact O-N 3.07Å; W91-A94 PolarHBondContact O-N 3.36Å; W91-L95 WeakPolarHBondContact O-CB 3.36Å; W91-L95 VanDerWaalsContact O-CG 3.25Å; W91-L95 WeakPolarHBondContact O-CG 3.49Å; W91-L95 PolarHBondContact O-N 3.3Å
92	E	95.3	Very high	97.8	Very high	75 Å²	75	22.5 Å²	22.5	35%	0.35	12%	0.115	S	C	.	.	H	α-helix	trans	-61.3	-43.1	177.8	-67.6	-60.5	146.5	0	0	110.7	N89 I90 N96 F289	N89-E92 HydrophobicContact CB-CG 4.34Å; N89-E92 WeakPolarHBondContact O-CB 3.43Å; N89-E92 PolarHBondContact O-N 3.1Å; I90-E92 VanDerWaalsContact C-N 3.32Å; I90-E92 PolarHBondContact O-N 2.79Å; E92-N96 VanDerWaalsContact O-CB 3.3Å; E92-N96 WeakPolarHBondContact O-CB 3.46Å; E92-N96 PolarHBondContact O-N 3.39Å; E92-N96 PolarHBondContact O-ND2 3.05Å; E92-F289 HydrophobicContact CB-CD2 4.38Å; E92-F289 HydrophobicContact CB-CE2 4.19Å
93	F	97.9	Very high	97.8	Very high	11 Å²	11	22.5 Å²	22.5	5%	0.048	12%	0.115	C	C	.	.	H	α-helix	trans	-68.3	-42.4	176.7	-53.5	-55.6	0	0	0	112.2	Y83 N86 G88 I90 W91 L95 N96 S97 F113 F289	Y83-F93 HydrophobicContact CD1-CB 4.3Å; Y83-F93 HydrophobicContact CE1-CB 3.66Å; Y83-F93 HydrophobicContact CE1-CD1 4.47Å; Y83-F93 HydrophobicContact CE1-CD2 4.18Å; Y83-F93 AromaticContact CE1-CG 3.86Å; Y83-F93 HydrophobicContact CE1-CG 3.86Å; N86-F93 HydrophobicContact CB-CZ 4.38Å; N86-F93 WeakPolarHBondContact ND2-CE1 3.26Å; N86-F93 WeakPolarHBondContact ND2-CZ 3.47Å; N86-F93 WeakPolarHBondContact OD1-CD1 3.12Å; N86-F93 WeakPolarHBondContact OD1-CE1 3.36Å; N86-F93 WeakPolarHBondContact OD1-CE2 3.37Å; N86-F93 VanDerWaalsContact OD1-CZ 3.24Å; N86-F93 WeakPolarHBondContact OD1-CZ 3.4Å; G88-F93 WeakPolarHBondContact O-CE2 3.15Å; I90-F93 HydrophobicContact CD1-CD2 4.07Å; I90-F93 PolarHBondContact O-N 3.19Å; W91-F93 VanDerWaalsContact C-N 3.3Å; W91-F93 PolarHBondContact O-N 3.07Å; F93-L95 VanDerWaalsContact C-N 3.35Å; F93-L95 PolarHBondContact O-N 2.92Å; F93-N96 PolarHBondContact O-N 3.01Å; F93-S97 WeakPolarHBondContact O-CB 3.48Å; F93-S97 PolarHBondContact O-N 3.2Å; F93-S97 PolarHBondContact O-OG 3.11Å; F93-F113 HydrophobicContact CB-CD1 4.41Å; F93-F289 HydrophobicContact CD1-CE2 4.04Å; F93-F289 HydrophobicContact CD1-CZ 4.04Å; F93-F289 HydrophobicContact CE1-CE2 4.2Å; F93-F289 HydrophobicContact CE1-CZ 4.02Å
94	A	97.4	Very high	97.8	Very high	2 Å²	2	22.4 Å²	22.4	2%	0.017	11%	0.114	C	C	.	.	H	α-helix	trans	-63.8	-38.7	179.4	0	0	0	0	0	112.8	F40 L67 I90 W91 N96 F113	F40-A94 HydrophobicContact CD2-CB 4.29Å; F40-A94 HydrophobicContact CE2-CB 3.97Å; F40-A94 HydrophobicContact CZ-CB 4.39Å; L67-A94 HydrophobicContact CD1-CB 3.66Å; I90-A94 PolarHBondContact O-N 3.32Å; W91-A94 PolarHBondContact O-N 3.36Å; A94-N96 VanDerWaalsContact C-N 3.32Å; A94-F113 HydrophobicContact CB-CD1 3.92Å; A94-F113 HydrophobicContact CB-CD2 4.19Å; A94-F113 HydrophobicContact CB-CE1 4.14Å; A94-F113 HydrophobicContact CB-CE2 4.38Å; A94-F113 HydrophobicContact CB-CG 3.98Å; A94-F113 HydrophobicContact CB-CZ 4.36Å
95	L	95.9	Very high	97.8	Very high	93 Å²	93	24.9 Å²	24.9	49%	0.487	14%	0.135	S	C	.	.	H	α-helix	trans	-75.1	-21.2	177.7	-66.7	173.1	0	0	0	113	W91 F93	W91-L95 WeakPolarHBondContact O-CB 3.36Å; W91-L95 VanDerWaalsContact O-CG 3.25Å; W91-L95 WeakPolarHBondContact O-CG 3.49Å; W91-L95 PolarHBondContact O-N 3.3Å; F93-L95 VanDerWaalsContact C-N 3.35Å; F93-L95 PolarHBondContact O-N 2.92Å
96	N	96.8	Very high	97.7	Very high	9 Å²	9	31.4 Å²	31.4	5%	0.048	17%	0.166	C	C	.	.	H	α-helix	trans	-106.9	-1.9	-177.6	-74.2	-83	0	0	0	114.4	E92 F93 A94 S288 F289 R457	E92-N96 VanDerWaalsContact O-CB 3.3Å; E92-N96 WeakPolarHBondContact O-CB 3.46Å; E92-N96 PolarHBondContact O-N 3.39Å; E92-N96 PolarHBondContact O-ND2 3.05Å; F93-N96 PolarHBondContact O-N 3.01Å; A94-N96 VanDerWaalsContact C-N 3.32Å; N96-S288 PolarHBondContact ND2-O 3.29Å; N96-S288 PolarHBondContact OD1-O 3.44Å; N96-F289 HydrophobicContact CB-CD2 3.91Å; N96-F289 HydrophobicContact CB-CE2 4.25Å; N96-F289 HydrophobicContact CB-CG 4.28Å; N96-F289 WeakPolarHBondContact ND2-CD2 3.45Å; N96-R457 WeakPolarHBondContact O-CA 3.37Å; N96-R457 VanDerWaalsContact OD1-CZ 3.28Å; N96-R457 PolarHBondContact OD1-NH1 3.44Å; N96-R457 PolarHBondContact OD1-NH2 3.48Å
97	S	97.9	Very high	97.7	Very high	5 Å²	5	32.9 Å²	32.9	4%	0.035	17%	0.173	C	C	.	.			trans	-112.2	45.8	-178.9	-53.4	0	0	0	0	113	F93 F99 I100 L456	F93-S97 WeakPolarHBondContact O-CB 3.48Å; F93-S97 PolarHBondContact O-N 3.2Å; F93-S97 PolarHBondContact O-OG 3.11Å; S97-F99 PolarHBondContact O-N 2.63Å; S97-I100 PolarHBondContact O-N 3.34Å; S97-I100 VanDerWaalsContact O-N 3.16Å; S97-L456 CarbonylContact C-O 3.08Å; S97-L456 WeakPolarHBondContact CA-O 3.38Å
98	G	97.3	Very high	97.8	Very high	16 Å²	16	35.3 Å²	35.3	17%	0.165	18%	0.184	C	C	.	.	H	α-helix	trans	-59.5	-24.8	-174	0	0	0	0	0	115.4	I100 T101 E102 L456	G98-I100 PolarHBondContact O-N 3.44Å; G98-T101 PolarHBondContact O-N 2.78Å; G98-T101 PolarHBondContact O-OG1 2.94Å; G98-E102 WeakPolarHBondContact O-CG 3.36Å; G98-E102 PolarHBondContact O-N 3.49Å; G98-E102 VanDerWaalsContact O-N 3.11Å; G98-L456 PolarHBondContact N-O 3.28Å; G98-L456 VanDerWaalsContact N-O 3.16Å
99	F	98.7	Very high	97.8	Very high	8 Å²	8	34.9 Å²	34.9	4%	0.035	18%	0.179	C	C	.	.	H	α-helix	trans	-57.1	-33.8	175.7	173.3	-121.3	0	0	0	112.2	S97 T101 E102 L103 L192 D455 L456 R457 R471 E474	S97-F99 PolarHBondContact O-N 2.63Å; F99-T101 PolarHBondContact O-N 2.85Å; F99-E102 PolarHBondContact O-N 3.28Å; F99-L103 HydrophobicContact CE1-CD2 4.26Å; F99-L103 HydrophobicContact CE2-CB 4.44Å; F99-L103 HydrophobicContact CZ-CD1 4.45Å; F99-L103 HydrophobicContact CZ-CD2 4.11Å; F99-L103 VanDerWaalsContact O-CB 3.22Å; F99-L103 WeakPolarHBondContact O-CB 3.47Å; F99-L103 PolarHBondContact O-N 3.39Å; F99-L192 HydrophobicContact CD1-CD2 4.3Å; F99-L192 HydrophobicContact CE1-CD2 3.88Å; F99-D455 VanDerWaalsContact CB-O 3.28Å; F99-D455 WeakPolarHBondContact CB-O 3.19Å; F99-D455 WeakPolarHBondContact CG-O 3.32Å; F99-L456 VanDerWaalsContact CB-O 3.26Å; F99-L456 WeakPolarHBondContact CB-O 3.4Å; F99-L456 HydrophobicContact CD1-CD2 4.47Å; F99-L456 PolarHBondContact N-O 2.78Å; F99-R457 PolarHBondContact N-O 2.71Å; F99-R471 HydrophobicContact CD2-CB 4.13Å; F99-R471 HydrophobicContact CD2-CG 3.87Å; F99-R471 HydrophobicContact CE2-CB 3.65Å; F99-R471 HydrophobicContact CE2-CG 3.86Å; F99-R471 HydrophobicContact CG-CG 4.28Å; F99-R471 HydrophobicContact CZ-CB 4.07Å; F99-R471 HydrophobicContact CZ-CG 4.25Å; F99-E474 HydrophobicContact CE1-CB 4.25Å; F99-E474 WeakPolarHBondContact CE1-OE2 3.18Å; F99-E474 HydrophobicContact CZ-CB 4.1Å
100	I	98.6	Very high	97.9	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-66.4	-40.1	-178	-59.7	175.3	0	0	0	111	F81 Y83 S97 G98 A104 V111 F113 F168	F81-I100 HydrophobicContact CB-CG2 3.98Å; F81-I100 HydrophobicContact CD2-CG2 4.18Å; Y83-I100 HydrophobicContact CD2-CD1 3.6Å; Y83-I100 HydrophobicContact CE2-CD1 4.36Å; S97-I100 PolarHBondContact O-N 3.34Å; S97-I100 VanDerWaalsContact O-N 3.16Å; G98-I100 PolarHBondContact O-N 3.44Å; I100-A104 VanDerWaalsContact O-CB 3.25Å; I100-A104 WeakPolarHBondContact O-CB 3.4Å; I100-A104 PolarHBondContact O-N 3.46Å; I100-V111 HydrophobicContact CG2-CG1 3.92Å; I100-F113 HydrophobicContact CB-CZ 4.49Å; I100-F113 HydrophobicContact CD1-CE1 4.33Å; I100-F113 HydrophobicContact CD1-CZ 3.89Å; I100-F168 HydrophobicContact CD1-CB 3.56Å; I100-F168 HydrophobicContact CD1-CD1 4.08Å; I100-F168 HydrophobicContact CD1-CG 3.85Å; I100-F168 HydrophobicContact CG1-CB 4.3Å; I100-F168 HydrophobicContact CG1-CD1 3.86Å; I100-F168 HydrophobicContact CG1-CE1 4.37Å; I100-F168 HydrophobicContact CG1-CG 4.07Å
101	T	97.7	Very high	97.9	Very high	13 Å²	13	32.4 Å²	32.4	8%	0.08	17%	0.166	C	C	.	.	H	α-helix	trans	-76	-36.8	178.8	55.7	0	0	0	0	111.6	P38 F40 G98 F99 L103 A104 A105	P38-T101 HydrophobicContact CB-CG2 3.96Å; P38-T101 HydrophobicContact CG-CG2 4.23Å; F40-T101 HydrophobicContact CE2-CG2 4.35Å; F40-T101 HydrophobicContact CZ-CG2 3.79Å; G98-T101 PolarHBondContact O-N 2.78Å; G98-T101 PolarHBondContact O-OG1 2.94Å; F99-T101 PolarHBondContact O-N 2.85Å; T101-L103 VanDerWaalsContact C-N 3.34Å; T101-A104 PolarHBondContact O-N 3.46Å; T101-A105 PolarHBondContact O-N 3.35Å
102	E	98.3	Very high	98	Very high	61 Å²	61	29.2 Å²	29.2	29%	0.285	15%	0.154	S	C	.	.	H	α-helix	trans	-59.2	-45.6	170.5	-70.4	173.3	-164.4	0	0	111.4	G98 F99 A104 A105 Q106 G458 S459	G98-E102 WeakPolarHBondContact O-CG 3.36Å; G98-E102 PolarHBondContact O-N 3.49Å; G98-E102 VanDerWaalsContact O-N 3.11Å; F99-E102 PolarHBondContact O-N 3.28Å; E102-A104 VanDerWaalsContact C-N 3.35Å; E102-A105 WeakPolarHBondContact O-CB 3.3Å; E102-A105 PolarHBondContact O-N 3.03Å; E102-Q106 WeakPolarHBondContact O-CG 3.49Å; E102-Q106 PolarHBondContact O-N 3.47Å; E102-G458 WeakPolarHBondContact OE1-CA 3.32Å; E102-S459 PolarHBondContact OE1-N 2.99Å; E102-S459 WeakPolarHBondContact OE2-CB 3.35Å; E102-S459 PolarHBondContact OE2-N 3.16Å; E102-S459 PolarHBondContact OE2-OG 3.23Å
103	L	98.7	Very high	98.1	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-66.8	-38.2	176.4	-169.1	63.3	0	0	0	111.4	F81 F99 T101 A105 Q106 Q107 F168 A475 I478	F81-L103 HydrophobicContact CE2-CB 3.88Å; F81-L103 HydrophobicContact CE2-CD2 3.75Å; F81-L103 HydrophobicContact CE2-CG 3.58Å; F81-L103 HydrophobicContact CZ-CD2 3.9Å; F81-L103 HydrophobicContact CZ-CG 3.93Å; F99-L103 HydrophobicContact CE1-CD2 4.26Å; F99-L103 HydrophobicContact CE2-CB 4.44Å; F99-L103 HydrophobicContact CZ-CD1 4.45Å; F99-L103 HydrophobicContact CZ-CD2 4.11Å; F99-L103 VanDerWaalsContact O-CB 3.22Å; F99-L103 WeakPolarHBondContact O-CB 3.47Å; F99-L103 PolarHBondContact O-N 3.39Å; T101-L103 VanDerWaalsContact C-N 3.34Å; L103-A105 VanDerWaalsContact C-N 3.31Å; L103-A105 PolarHBondContact O-N 3.05Å; L103-Q106 PolarHBondContact O-N 3.35Å; L103-Q106 VanDerWaalsContact O-N 3.15Å; L103-Q107 HydrophobicContact CD1-CG 4.12Å; L103-Q107 VanDerWaalsContact CD1-NE2 3.3Å; L103-Q107 HydrophobicContact CG-CG 4.3Å; L103-Q107 WeakPolarHBondContact O-CB 3.36Å; L103-Q107 PolarHBondContact O-N 3.34Å; L103-F168 HydrophobicContact CD2-CE1 4.18Å; L103-F168 HydrophobicContact CD2-CZ 4.11Å; L103-A475 HydrophobicContact CD1-CB 3.39Å; L103-I478 HydrophobicContact CD2-CD1 3.74Å; L103-I478 HydrophobicContact CD2-CG2 4.29Å
104	A	98.6	Very high	98.2	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-63	-38.8	177	0	0	0	0	0	111.7	Y72 F81 I100 T101 E102 Q106 Q107 Q108 A109 V111	Y72-A104 WeakPolarHBondContact CB-O 3.29Å; Y72-A104 HydrophobicContact CD2-CB 3.87Å; Y72-A104 HydrophobicContact CG-CB 4.3Å; F81-A104 HydrophobicContact CD2-CB 3.98Å; F81-A104 HydrophobicContact CE2-CB 4.23Å; I100-A104 VanDerWaalsContact O-CB 3.25Å; I100-A104 WeakPolarHBondContact O-CB 3.4Å; I100-A104 PolarHBondContact O-N 3.46Å; T101-A104 PolarHBondContact O-N 3.46Å; E102-A104 VanDerWaalsContact C-N 3.35Å; A104-Q106 VanDerWaalsContact C-N 3.3Å; A104-Q106 PolarHBondContact O-N 2.92Å; A104-Q107 PolarHBondContact O-N 3.29Å; A104-Q108 CarbonylContact O-C 3.56Å; A104-Q108 WeakPolarHBondContact O-CA 3.38Å; A104-Q108 PolarHBondContact O-N 3.34Å; A104-A109 HydrophobicContact CB-CB 3.88Å; A104-A109 PolarHBondContact O-N 2.95Å; A104-V111 HydrophobicContact CB-CG2 3.29Å
105	A	98.1	Very high	98.3	Very high	53 Å²	53	25 Å²	25	44%	0.438	14%	0.135	S	C	.	.	H	α-helix	trans	-60.8	-39.2	173.1	0	0	0	0	0	112.1	Y72 T101 E102 L103	Y72-A105 HydrophobicContact CD1-CB 3.61Å; Y72-A105 HydrophobicContact CE1-CB 3.86Å; Y72-A105 HydrophobicContact CG-CB 4.2Å; T101-A105 PolarHBondContact O-N 3.35Å; E102-A105 WeakPolarHBondContact O-CB 3.3Å; E102-A105 PolarHBondContact O-N 3.03Å; L103-A105 VanDerWaalsContact C-N 3.31Å; L103-A105 PolarHBondContact O-N 3.05Å
106	Q	98.1	Very high	98.4	Very high	137 Å²	137	20.6 Å²	20.6	64%	0.64	11%	0.111	S	C	*	.	H	α-helix	trans	-73.8	-40.2	178.4	-64.8	173.9	23.2	0	0	112.9	E102 L103 A104	E102-Q106 WeakPolarHBondContact O-CG 3.49Å; E102-Q106 PolarHBondContact O-N 3.47Å; L103-Q106 PolarHBondContact O-N 3.35Å; L103-Q106 VanDerWaalsContact O-N 3.15Å; A104-Q106 VanDerWaalsContact C-N 3.3Å; A104-Q106 PolarHBondContact O-N 2.92Å
107	Q	98.4	Very high	98.5	Very high	34 Å²	34	20.2 Å²	20.2	16%	0.159	11%	0.109	C	C	.	.	H	α-helix	trans	-100.1	5.3	-173.7	-58.2	-161.6	19.9	0	0	113.7	P79 F81 L103 A104 A109 A475	P79-Q107 WeakPolarHBondContact CD-O 3.45Å; F81-Q107 HydrophobicContact CZ-CB 4Å; F81-Q107 HydrophobicContact CZ-CG 4.35Å; L103-Q107 HydrophobicContact CD1-CG 4.12Å; L103-Q107 VanDerWaalsContact CD1-NE2 3.3Å; L103-Q107 HydrophobicContact CG-CG 4.3Å; L103-Q107 WeakPolarHBondContact O-CB 3.36Å; L103-Q107 PolarHBondContact O-N 3.34Å; A104-Q107 PolarHBondContact O-N 3.29Å; Q107-A109 VanDerWaalsContact C-N 3.31Å; Q107-A109 PolarHBondContact O-N 2.75Å; Q107-A475 PolarHBondContact NE2-O 2.95Å
108	Q	98.4	Very high	98.5	Very high	92 Å²	92	20 Å²	20	43%	0.43	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	41.6	-180	-44.6	-176.4	-71.2	0	0	112.9	Y72 W73 K74 G78 A104	Y72-Q108 CarbonylContact O-C 3.53Å; Y72-Q108 VanDerWaalsContact O-C 3.23Å; Y72-Q108 WeakPolarHBondContact O-CA 3.44Å; W73-Q108 WeakPolarHBondContact CA-O 3.4Å; K74-Q108 HydrophobicContact CB-CB 3.77Å; K74-Q108 PolarHBondContact N-O 2.82Å; G78-Q108 WeakPolarHBondContact CA-O 3.43Å; A104-Q108 CarbonylContact O-C 3.56Å; A104-Q108 WeakPolarHBondContact O-CA 3.38Å; A104-Q108 PolarHBondContact O-N 3.34Å
109	A	98.7	Very high	98.6	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.1	C	C	.	.			trans	-89.4	151.4	-170.7	0	0	0	0	0	113	P79 F81 A104 Q107	P79-A109 HydrophobicContact CG-CB 3.86Å; P79-A109 CarbonylContact O-C 3.58Å; P79-A109 WeakPolarHBondContact O-CA 3.33Å; P79-A109 WeakPolarHBondContact O-CB 3.38Å; F81-A109 HydrophobicContact CD1-CB 3.93Å; F81-A109 HydrophobicContact CD2-CB 3.63Å; F81-A109 HydrophobicContact CE1-CB 3.99Å; F81-A109 HydrophobicContact CE2-CB 3.67Å; F81-A109 HydrophobicContact CG-CB 3.76Å; F81-A109 HydrophobicContact CZ-CB 3.86Å; A104-A109 HydrophobicContact CB-CB 3.88Å; A104-A109 PolarHBondContact O-N 2.95Å; Q107-A109 VanDerWaalsContact C-N 3.31Å; Q107-A109 PolarHBondContact O-N 2.75Å
110	L	98.7	Very high	98.6	Very high	1 Å²	1	20 Å²	20	1%	0.005	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	138.4	160.3	179.1	68.4	0	0	0	108.3	I68 T69 D70 W73 P79 I80 F81 I112 L158	I68-L110 HydrophobicContact CD1-CD1 4.04Å; I68-L110 HydrophobicContact CD1-CD2 4.36Å; I68-L110 HydrophobicContact CG1-CD1 3.94Å; T69-L110 WeakPolarHBondContact O-CD1 3.28Å; D70-L110 HydrophobicContact CB-CD1 3.77Å; W73-L110 HydrophobicContact CB-CB 4.12Å; W73-L110 HydrophobicContact CB-CD1 4.41Å; W73-L110 VanDerWaalsContact CD1-N 3.29Å; W73-L110 HydrophobicContact CD2-CB 3.87Å; W73-L110 HydrophobicContact CD2-CD1 4.22Å; W73-L110 HydrophobicContact CD2-CG 4.48Å; W73-L110 HydrophobicContact CE3-CD1 4.06Å; W73-L110 HydrophobicContact CG-CB 3.67Å; W73-L110 HydrophobicContact CG-CD1 4.4Å; P79-L110 PolarHBondContact O-N 3.27Å; I80-L110 CarbonylContact C-O 3.6Å; I80-L110 HydrophobicContact CD1-CD2 4.38Å; I80-L110 HydrophobicContact CG1-CB 4.3Å; I80-L110 HydrophobicContact CG1-CD2 4.14Å; I80-L110 HydrophobicContact CG2-CD2 4.32Å; F81-L110 PolarHBondContact N-O 2.91Å; L110-I112 HydrophobicContact CD2-CD1 3.91Å; L110-I112 HydrophobicContact CD2-CG1 4.19Å; L110-I112 HydrophobicContact CG-CD1 4.47Å; L110-I112 HydrophobicContact CG-CG1 4.21Å; L110-L158 HydrophobicContact CD2-CD1 3.6Å
111	V	98.8	Very high	98.6	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	129.1	176.7	-173.6	0	0	0	0	110.2	F40 I68 T69 F81 I100 A104 F113	F40-V111 HydrophobicContact CE1-CB 4.38Å; F40-V111 HydrophobicContact CE1-CG1 3.93Å; F40-V111 HydrophobicContact CZ-CG1 4.24Å; I68-V111 WeakPolarHBondContact CA-O 3.38Å; T69-V111 HydrophobicContact CG2-CB 3.86Å; T69-V111 HydrophobicContact CG2-CG2 4.38Å; T69-V111 PolarHBondContact N-O 3.45Å; T69-V111 PolarHBondContact O-N 3.46Å; T69-V111 VanDerWaalsContact O-N 3.12Å; F81-V111 WeakPolarHBondContact O-CA 3.32Å; I100-V111 HydrophobicContact CG2-CG1 3.92Å; A104-V111 HydrophobicContact CB-CG2 3.29Å; V111-F113 HydrophobicContact CG1-CD2 3.85Å; V111-F113 HydrophobicContact CG1-CE2 3.53Å
112	I	98.9	Very high	98.6	Very high	3 Å²	3	24.2 Å²	24.2	2%	0.015	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	127.4	176.7	-57.8	176.5	0	0	0	108.4	Y66 L67 I68 I80 F81 F82 Y83 L110 L154	Y66-I112 HydrophobicContact CD2-CG2 4.01Å; L67-I112 CarbonylContact O-C 3.59Å; L67-I112 VanDerWaalsContact O-CA 3.28Å; L67-I112 WeakPolarHBondContact O-CA 3.38Å; I68-I112 HydrophobicContact CD1-CD1 4.37Å; I68-I112 HydrophobicContact CD1-CG1 4.15Å; I68-I112 HydrophobicContact CG1-CG1 4.08Å; I80-I112 HydrophobicContact CG2-CD1 3.9Å; I80-I112 HydrophobicContact CG2-CG1 4.33Å; F81-I112 PolarHBondContact O-N 2.79Å; F82-I112 CarbonylContact C-O 3.59Å; F82-I112 WeakPolarHBondContact CA-O 3.31Å; F82-I112 HydrophobicContact CD2-CB 3.94Å; F82-I112 HydrophobicContact CD2-CD1 4.47Å; F82-I112 HydrophobicContact CD2-CG2 3.85Å; F82-I112 HydrophobicContact CE2-CB 4.42Å; F82-I112 HydrophobicContact CE2-CG2 3.81Å; Y83-I112 PolarHBondContact N-O 3.46Å; L110-I112 HydrophobicContact CD2-CD1 3.91Å; L110-I112 HydrophobicContact CD2-CG1 4.19Å; L110-I112 HydrophobicContact CG-CD1 4.47Å; L110-I112 HydrophobicContact CG-CG1 4.21Å; I112-L154 HydrophobicContact CD1-CD1 3.89Å
113	F	98.9	Very high	98.6	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	110.5	167	-76.7	-107.6	0	0	0	108.1	F40 Y66 L67 Y83 I90 F93 A94 I100 V111	F40-F113 AromaticContact CE1-CD2 3.72Å; F40-F113 HydrophobicContact CE1-CD2 3.72Å; F40-F113 AromaticContact CE1-CE2 3.93Å; F40-F113 HydrophobicContact CE1-CE2 3.93Å; F40-F113 AromaticContact CZ-CD2 3.78Å; F40-F113 HydrophobicContact CZ-CD2 3.78Å; F40-F113 AromaticContact CZ-CE2 3.56Å; F40-F113 HydrophobicContact CZ-CE2 3.56Å; Y66-F113 CarbonylContact C-O 3.42Å; Y66-F113 WeakPolarHBondContact CA-O 3.5Å; Y66-F113 WeakPolarHBondContact CB-O 3.26Å; L67-F113 HydrophobicContact CB-CB 4.18Å; L67-F113 PolarHBondContact N-O 3.42Å; L67-F113 PolarHBondContact O-N 3Å; Y83-F113 VanDerWaalsContact CB-CE1 3.48Å; Y83-F113 AromaticContact CD1-CD1 3.64Å; Y83-F113 HydrophobicContact CD1-CD1 3.64Å; Y83-F113 AromaticContact CD1-CE1 4Å; Y83-F113 HydrophobicContact CD1-CE1 4Å; Y83-F113 AromaticContact CD2-CD1 3.99Å; Y83-F113 HydrophobicContact CD2-CD1 3.99Å; Y83-F113 AromaticContact CD2-CE1 3.5Å; Y83-F113 HydrophobicContact CD2-CE1 3.5Å; Y83-F113 HydrophobicContact CD2-CZ 4.28Å; Y83-F113 HydrophobicContact CE1-CD1 4.49Å; Y83-F113 HydrophobicContact CE2-CE1 4.2Å; Y83-F113 AromaticContact CG-CD1 3.35Å; Y83-F113 HydrophobicContact CG-CD1 3.35Å; Y83-F113 AromaticContact CG-CE1 3.38Å; Y83-F113 HydrophobicContact CG-CE1 3.38Å; Y83-F113 HydrophobicContact CG-CG 4.26Å; Y83-F113 HydrophobicContact CG-CZ 4.33Å; I90-F113 HydrophobicContact CD1-CB 3.83Å; I90-F113 HydrophobicContact CD1-CD1 4.36Å; I90-F113 HydrophobicContact CG1-CB 3.74Å; F93-F113 HydrophobicContact CB-CD1 4.41Å; A94-F113 HydrophobicContact CB-CD1 3.92Å; A94-F113 HydrophobicContact CB-CD2 4.19Å; A94-F113 HydrophobicContact CB-CE1 4.14Å; A94-F113 HydrophobicContact CB-CE2 4.38Å; A94-F113 HydrophobicContact CB-CG 3.98Å; A94-F113 HydrophobicContact CB-CZ 4.36Å; I100-F113 HydrophobicContact CB-CZ 4.49Å; I100-F113 HydrophobicContact CD1-CE1 4.33Å; I100-F113 HydrophobicContact CD1-CZ 3.89Å; V111-F113 HydrophobicContact CG1-CD2 3.85Å; V111-F113 HydrophobicContact CG1-CE2 3.53Å
114	A	98.9	Very high	98.6	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	126.6	-179.5	0	0	0	0	0	110.3	F82 Y83 G85 I90 Y147 M150	F82-A114 HydrophobicContact CE1-CB 3.77Å; F82-A114 HydrophobicContact CE2-CB 3.96Å; F82-A114 HydrophobicContact CZ-CB 3.26Å; Y83-A114 PolarHBondContact O-N 2.97Å; Y83-A114 VanDerWaalsContact O-N 3.15Å; G85-A114 WeakPolarHBondContact CA-O 3.34Å; G85-A114 PolarHBondContact N-O 3.26Å; I90-A114 WeakPolarHBondContact CD1-O 3.31Å; A114-Y147 HydrophobicContact CB-CD1 3.76Å; A114-Y147 HydrophobicContact CB-CE1 3.71Å; A114-M150 HydrophobicContact CB-CE 4.05Å; A114-M150 HydrophobicContact CB-SD 3.66Å
115	E	98.9	Very high	98.6	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	14%	0.139	C	C	.	.	P	Polyproline II helix	trans	-73.4	140.8	177.6	-171.8	160.1	-99.2	0	0	111	Q64 R65 I90 Y119 Q121 S122	Q64-E115 WeakPolarHBondContact CG-O 3.45Å; Q64-E115 PolarHBondContact NE2-O 2.92Å; R65-E115 HydrophobicContact CB-CB 4.06Å; R65-E115 WeakPolarHBondContact CB-OE2 3.43Å; R65-E115 IonicContact CZ-OE1 3.3Å; R65-E115 VanDerWaalsContact CZ-OE1 3.3Å; R65-E115 IonicContact CZ-OE2 3.61Å; R65-E115 IonicContact NE-OE1 3.19Å; R65-E115 PolarHBondContact NE-OE1 3.1Å; R65-E115 IonicContact NE-OE2 2.94Å; R65-E115 PolarHBondContact NE-OE2 3.33Å; R65-E115 IonicContact NH2-OE1 2.63Å; R65-E115 PolarHBondContact NH2-OE1 2.66Å; R65-E115 IonicContact NH2-OE2 3.48Å; R65-E115 PolarHBondContact NH2-OE2 3Å; R65-E115 WeakPolarHBondContact O-CB 3.45Å; R65-E115 PolarHBondContact O-N 3.4Å; I90-E115 HydrophobicContact CB-CB 3.71Å; I90-E115 HydrophobicContact CB-CG 3.99Å; I90-E115 WeakPolarHBondContact CB-OE1 3.2Å; I90-E115 HydrophobicContact CG1-CB 4.17Å; I90-E115 HydrophobicContact CG2-CB 3.99Å; I90-E115 HydrophobicContact CG2-CG 4.37Å; I90-E115 WeakPolarHBondContact CG2-OE1 3.32Å; I90-E115 PolarHBondContact N-OE1 3.45Å; E115-Y119 VanDerWaalsContact CD-O 3.3Å; E115-Q121 PolarHBondContact OE2-N 3.14Å; E115-S122 VanDerWaalsContact CB-OG 3.32Å; E115-S122 WeakPolarHBondContact CB-OG 3.41Å; E115-S122 WeakPolarHBondContact CG-OG 3.44Å; E115-S122 PolarHBondContact OE2-N 3.11Å; E115-S122 PolarHBondContact OE2-OG 3.41Å
116	H	98.9	Very high	98.5	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.135	C	C	.	.	P	Polyproline II helix	trans	-71.1	140.4	177.4	-165.7	-67.9	0	0	0	110.5	G85 N86 Y119 A143 Y147 Y172	G85-H116 PolarHBondContact O-CD2 3.28Å; N86-H116 WeakPolarHBondContact O-CB 3.22Å; H116-Y119 HydrophobicContact CB-CD2 3.64Å; H116-Y119 HydrophobicContact CB-CE2 4.34Å; H116-Y119 HydrophobicContact CB-CG 4.39Å; H116-Y119 AromaticContact CE1-CE2 3.88Å; H116-Y119 AromaticContact CG-CD2 3.66Å; H116-Y119 AromaticContact CG-CE2 3.9Å; H116-Y119 AromaticContact ND1-CD2 3.38Å; H116-Y119 WeakPolarHBondContact ND1-CD2 3.47Å; H116-Y119 AromaticContact ND1-CE2 3.45Å; H116-Y119 WeakPolarHBondContact ND1-CE2 3.38Å; H116-Y119 PolarHBondContact O-N 3.11Å; H116-A143 VanDerWaalsContact CE1-CB 3.48Å; H116-A143 WeakPolarHBondContact CE1-CB 3.45Å; H116-A143 WeakPolarHBondContact NE2-CB 3.21Å; H116-Y147 VanDerWaalsContact CA-OH 3.31Å; H116-Y147 WeakPolarHBondContact CA-OH 3.5Å; H116-Y147 WeakPolarHBondContact CB-OH 3.34Å; H116-Y172 AromaticContact CD2-CE1 3.71Å; H116-Y172 AromaticContact NE2-CE1 3.48Å; H116-Y172 WeakPolarHBondContact NE2-CE1 3.33Å; H116-Y172 AromaticContact NE2-CZ 3.52Å; H116-Y172 PolarHBondContact NE2-OH 3.42Å
117	R	98.8	Very high	98.2	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	143	171.6	57.3	165.5	58.5	-153.7	-4.3	110.8	T48 L49 F62 Y119 S122 P124 L137 A143 D146	T48-R117 PolarHBondContact O-NH2 2.99Å; T48-R117 VanDerWaalsContact O-NH2 3.16Å; L49-R117 PolarHBondContact O-NH1 3.26Å; L49-R117 PolarHBondContact O-NH2 2.98Å; F62-R117 HydrophobicContact CE2-CB 4.4Å; F62-R117 HydrophobicContact CZ-CB 3.91Å; R117-Y119 VanDerWaalsContact O-CD2 3.28Å; R117-Y119 WeakPolarHBondContact O-CD2 3.39Å; R117-Y119 PolarHBondContact O-N 3.41Å; R117-S122 CarbonylContact C-O 3.5Å; R117-P124 HydrophobicContact CB-CG 4.42Å; R117-L137 VanDerWaalsContact CD-O 3.26Å; R117-L137 WeakPolarHBondContact CD-O 3.45Å; R117-L137 PolarHBondContact NH1-O 2.91Å; R117-A143 HydrophobicContact CG-CB 4.3Å; R117-D146 IonicContact CZ-OD1 3.6Å; R117-D146 IonicContact CZ-OD2 3.41Å; R117-D146 IonicContact NE-OD1 3.67Å; R117-D146 IonicContact NE-OD2 2.7Å; R117-D146 PolarHBondContact NE-OD2 2.84Å; R117-D146 IonicContact NH2-OD1 2.71Å; R117-D146 PolarHBondContact NH2-OD1 3.09Å; R117-D146 IonicContact NH2-OD2 3.28Å; R117-D146 PolarHBondContact NH2-OD2 3.38Å
118	Y	98.8	Very high	98.1	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	-1.2	-175.9	-61.4	-102.4	0	0	0	116.6	S122 L123 P124 S129 F130 E134 L137 L138	Y118-S122 PolarHBondContact N-O 2.95Å; Y118-L123 WeakPolarHBondContact O-CD2 3.39Å; Y118-P124 HydrophobicContact CD2-CG 3.91Å; Y118-P124 HydrophobicContact CE1-CG 4.4Å; Y118-P124 HydrophobicContact CE2-CB 4.46Å; Y118-P124 HydrophobicContact CE2-CG 3.53Å; Y118-P124 HydrophobicContact CG-CG 4.49Å; Y118-S129 WeakPolarHBondContact CE1-O 3.27Å; Y118-F130 HydrophobicContact CD1-CE1 4.38Å; Y118-F130 WeakPolarHBondContact O-CZ 3.49Å; Y118-E134 PolarHBondContact OH-O 2.9Å; Y118-L137 HydrophobicContact CE2-CB 4.29Å; Y118-L137 VanDerWaalsContact OH-CB 3.27Å; Y118-L137 WeakPolarHBondContact OH-CB 3.49Å; Y118-L138 HydrophobicContact CD1-CB 4.25Å; Y118-L138 HydrophobicContact CD1-CD2 4.4Å; Y118-L138 HydrophobicContact CD2-CB 3.62Å; Y118-L138 HydrophobicContact CD2-CD1 3.77Å; Y118-L138 HydrophobicContact CD2-CD2 4.43Å; Y118-L138 HydrophobicContact CD2-CG 4.12Å; Y118-L138 HydrophobicContact CE1-CB 4.34Å; Y118-L138 HydrophobicContact CE2-CB 3.73Å; Y118-L138 HydrophobicContact CG-CB 3.9Å; Y118-L138 HydrophobicContact CG-CD1 4.07Å; Y118-L138 HydrophobicContact CG-CD2 4Å; Y118-L138 HydrophobicContact CG-CG 4.2Å
119	Y	98.8	Very high	98.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.137	C	C	.	.	S	Bend	trans	-110.6	151.6	176.3	-64.3	-86.8	0	0	0	111.5	E87 E115 H116 R117 Q121 S122 L138 D352 A355 W356 Q359	E87-Y119 VanDerWaalsContact C-CE1 3.45Å; E87-Y119 HydrophobicContact CB-CD1 4.37Å; E87-Y119 HydrophobicContact CB-CE1 3.6Å; E115-Y119 VanDerWaalsContact CD-O 3.3Å; H116-Y119 HydrophobicContact CB-CD2 3.64Å; H116-Y119 HydrophobicContact CB-CE2 4.34Å; H116-Y119 HydrophobicContact CB-CG 4.39Å; H116-Y119 AromaticContact CE1-CE2 3.88Å; H116-Y119 AromaticContact CG-CD2 3.66Å; H116-Y119 AromaticContact CG-CE2 3.9Å; H116-Y119 AromaticContact ND1-CD2 3.38Å; H116-Y119 WeakPolarHBondContact ND1-CD2 3.47Å; H116-Y119 AromaticContact ND1-CE2 3.45Å; H116-Y119 WeakPolarHBondContact ND1-CE2 3.38Å; H116-Y119 PolarHBondContact O-N 3.11Å; R117-Y119 VanDerWaalsContact O-CD2 3.28Å; R117-Y119 WeakPolarHBondContact O-CD2 3.39Å; R117-Y119 PolarHBondContact O-N 3.41Å; Y119-Q121 PolarHBondContact O-N 2.68Å; Y119-Q121 VanDerWaalsContact O-N 3.08Å; Y119-S122 PolarHBondContact O-N 2.77Å; Y119-L138 HydrophobicContact CE2-CD1 4.32Å; Y119-D352 WeakPolarHBondContact CA-OD1 3.38Å; Y119-D352 HydrophobicContact CD1-CB 3.85Å; Y119-D352 HydrophobicContact CE1-CB 4.33Å; Y119-D352 WeakPolarHBondContact CE1-O 3.48Å; Y119-A355 HydrophobicContact CD1-CB 3.89Å; Y119-A355 HydrophobicContact CD2-CB 4.35Å; Y119-A355 HydrophobicContact CE1-CB 3.35Å; Y119-A355 HydrophobicContact CE2-CB 3.89Å; Y119-A355 HydrophobicContact CG-CB 4.37Å; Y119-W356 VanDerWaalsContact OH-CA 3.29Å; Y119-W356 WeakPolarHBondContact OH-CA 3.21Å; Y119-W356 PolarHBondContact OH-N 2.73Å; Y119-Q359 PolarHBondContact OH-OE1 2.82Å
120	G	97.9	Very high	98.1	Very high	24 Å²	24	27.1 Å²	27.1	25%	0.247	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	-112.8	176.6	0	0	0	0	0	112.9	D352	G120-D352 PolarHBondContact N-OD1 2.88Å
121	Q	98.4	Very high	98.1	Very high	103 Å²	103	30.5 Å²	30.5	48%	0.481	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-0.2	179.2	-63	-172.9	1.8	0	0	113.3	F44 E115 Y119 L123	F44-Q121 HydrophobicContact CE1-CB 4.44Å; E115-Q121 PolarHBondContact OE2-N 3.14Å; Y119-Q121 PolarHBondContact O-N 2.68Å; Y119-Q121 VanDerWaalsContact O-N 3.08Å; Q121-L123 VanDerWaalsContact C-N 3.26Å; Q121-L123 PolarHBondContact O-N 2.9Å; Q121-L123 VanDerWaalsContact O-N 3.08Å
122	S	98.8	Very high	98	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.184	C	C	.	.			trans	-89.5	59.3	-176.9	-60	0	0	0	0	111.4	R65 E115 R117 Y118 Y119 P124	R65-S122 WeakPolarHBondContact CB-OG 3Å; R65-S122 PolarHBondContact N-OG 3.16Å; E115-S122 VanDerWaalsContact CB-OG 3.32Å; E115-S122 WeakPolarHBondContact CB-OG 3.41Å; E115-S122 WeakPolarHBondContact CG-OG 3.44Å; E115-S122 PolarHBondContact OE2-N 3.11Å; E115-S122 PolarHBondContact OE2-OG 3.41Å; R117-S122 CarbonylContact C-O 3.5Å; Y118-S122 PolarHBondContact N-O 2.95Å; Y119-S122 PolarHBondContact O-N 2.77Å; S122-P124 WeakPolarHBondContact O-CD 3.37Å
123	L	98.7	Very high	97.8	Very high	34 Å²	34	39.7 Å²	39.7	18%	0.178	21%	0.212	C	C	.	.			trans	-98.7	109.2	-171.4	-60.4	-178.3	0	0	0	111.2	Y118 Q121 F125 G126 F130	Y118-L123 WeakPolarHBondContact O-CD2 3.39Å; Q121-L123 VanDerWaalsContact C-N 3.26Å; Q121-L123 PolarHBondContact O-N 2.9Å; Q121-L123 VanDerWaalsContact O-N 3.08Å; L123-F125 PolarHBondContact O-N 3.47Å; L123-F125 VanDerWaalsContact O-N 3.12Å; L123-G126 PolarHBondContact O-N 3.01Å; L123-G126 VanDerWaalsContact O-N 3.14Å; L123-F130 HydrophobicContact CD2-CE2 4.34Å; L123-F130 HydrophobicContact CD2-CZ 4.17Å
124	P	98.4	Very high	97.7	Very high	12 Å²	12	42.2 Å²	42.2	8%	0.078	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-31.7	-174.2	-31.2	41.3	0	0	0	114.9	L49 F62 R117 Y118 S122	L49-P124 HydrophobicContact CD2-CB 3.58Å; F62-P124 HydrophobicContact CB-CB 4.45Å; F62-P124 HydrophobicContact CD1-CB 4.32Å; F62-P124 HydrophobicContact CD1-CG 4.35Å; F62-P124 HydrophobicContact CD2-CB 4.4Å; F62-P124 HydrophobicContact CD2-CG 4.1Å; F62-P124 HydrophobicContact CE1-CG 4.29Å; F62-P124 HydrophobicContact CE2-CG 4.06Å; F62-P124 HydrophobicContact CG-CB 4.15Å; F62-P124 HydrophobicContact CG-CG 4.25Å; F62-P124 HydrophobicContact CZ-CG 4.16Å; R117-P124 HydrophobicContact CB-CG 4.42Å; Y118-P124 HydrophobicContact CD2-CG 3.91Å; Y118-P124 HydrophobicContact CE1-CG 4.4Å; Y118-P124 HydrophobicContact CE2-CB 4.46Å; Y118-P124 HydrophobicContact CE2-CG 3.53Å; Y118-P124 HydrophobicContact CG-CG 4.49Å; S122-P124 WeakPolarHBondContact O-CD 3.37Å
125	F	97.9	Very high	97.7	Very high	54 Å²	54	42.3 Å²	42.3	24%	0.237	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123	24.1	-180	-51.8	-80.9	0	0	0	111.9	L49 M57 L123 K127 E128 S129 E134 L137	L49-F125 HydrophobicContact CD1-CE1 4.2Å; L49-F125 HydrophobicContact CD2-CE1 4.36Å; L49-F125 HydrophobicContact CD2-CZ 4.28Å; M57-F125 HydrophobicContact CE-CE1 4.43Å; M57-F125 HydrophobicContact CE-CZ 3.9Å; M57-F125 HydrophobicContact SD-CE1 4.24Å; M57-F125 HydrophobicContact SD-CZ 4.12Å; L123-F125 PolarHBondContact O-N 3.47Å; L123-F125 VanDerWaalsContact O-N 3.12Å; F125-K127 PolarHBondContact O-N 3.29Å; F125-E128 HydrophobicContact CB-CB 4.4Å; F125-E128 PolarHBondContact O-N 2.96Å; F125-S129 PolarHBondContact N-OG 3.14Å; F125-E134 HydrophobicContact CB-CB 4.47Å; F125-E134 HydrophobicContact CB-CG 4.2Å; F125-E134 HydrophobicContact CD1-CG 4.1Å; F125-E134 HydrophobicContact CD2-CB 3.54Å; F125-E134 HydrophobicContact CD2-CG 3.8Å; F125-E134 HydrophobicContact CE1-CG 4.44Å; F125-E134 HydrophobicContact CE2-CB 3.87Å; F125-E134 HydrophobicContact CE2-CG 4.16Å; F125-E134 WeakPolarHBondContact CE2-O 3Å; F125-E134 HydrophobicContact CG-CB 4.01Å; F125-E134 HydrophobicContact CG-CG 3.76Å; F125-E134 HydrophobicContact CZ-CG 4.47Å; F125-L137 HydrophobicContact CE2-CD1 3.88Å; F125-L137 HydrophobicContact CE2-CG 4.46Å; F125-L137 HydrophobicContact CZ-CD1 3.69Å
126	G	96.6	Very high	97.7	Very high	35 Å²	35	43.9 Å²	43.9	36%	0.361	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	57.6	-132.6	-174	0	0	0	0	0	111.5	L123 E128 S129	L123-G126 PolarHBondContact O-N 3.01Å; L123-G126 VanDerWaalsContact O-N 3.14Å; G126-E128 PolarHBondContact O-N 3.04Å; G126-S129 PolarHBondContact N-OG 2.89Å; G126-S129 WeakPolarHBondContact O-CB 3.5Å; G126-S129 PolarHBondContact O-N 3.46Å; G126-S129 PolarHBondContact O-OG 2.99Å
127	K	91.5	Very high	97.7	Very high	180 Å²	180	44.6 Å²	44.6	78%	0.783	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-63.2	-25.7	179.9	-65.7	-175.4	179.6	-177.7	0	113.6	F125 S129	F125-K127 PolarHBondContact O-N 3.29Å; K127-S129 PolarHBondContact O-N 3.44Å
128	E	97.1	Very high	97.7	Very high	105 Å²	105	44.6 Å²	44.6	49%	0.491	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-82.2	1.1	-178.7	-50.5	-51.4	121.8	0	0	112.6	F125 G126 F130 N131 E134	F125-E128 HydrophobicContact CB-CB 4.4Å; F125-E128 PolarHBondContact O-N 2.96Å; G126-E128 PolarHBondContact O-N 3.04Å; E128-F130 PolarHBondContact O-N 3.21Å; E128-N131 WeakPolarHBondContact O-CB 3.38Å; E128-N131 PolarHBondContact O-N 3.26Å; E128-N131 PolarHBondContact OE2-ND2 3.16Å; E128-E134 WeakPolarHBondContact O-CB 3.36Å
129	S	98.4	Very high	97.7	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-57	-27.4	-178.4	-57.9	0	0	0	0	113	Y118 F125 G126 K127 V135	Y118-S129 WeakPolarHBondContact CE1-O 3.27Å; F125-S129 PolarHBondContact N-OG 3.14Å; G126-S129 PolarHBondContact N-OG 2.89Å; G126-S129 WeakPolarHBondContact O-CB 3.5Å; G126-S129 PolarHBondContact O-N 3.46Å; G126-S129 PolarHBondContact O-OG 2.99Å; K127-S129 PolarHBondContact O-N 3.44Å; S129-V135 VanDerWaalsContact O-CA 3.22Å; S129-V135 WeakPolarHBondContact O-CA 3.38Å; S129-V135 WeakPolarHBondContact O-CB 3.45Å; S129-V135 PolarHBondContact O-N 2.73Å; S129-V135 VanDerWaalsContact O-N 3.17Å
130	F	97.8	Very high	97.7	Very high	18 Å²	18	45.9 Å²	45.9	8%	0.079	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-93.5	6.3	-178.8	-53.3	-71	0	0	0	113.8	Y118 L123 E128 L351 L354 A355 W395	Y118-F130 HydrophobicContact CD1-CE1 4.38Å; Y118-F130 WeakPolarHBondContact O-CZ 3.49Å; L123-F130 HydrophobicContact CD2-CE2 4.34Å; L123-F130 HydrophobicContact CD2-CZ 4.17Å; E128-F130 PolarHBondContact O-N 3.21Å; F130-L351 HydrophobicContact CD2-CD2 3.92Å; F130-L351 HydrophobicContact CE2-CB 3.69Å; F130-L351 HydrophobicContact CE2-CD1 4.08Å; F130-L351 HydrophobicContact CE2-CD2 3.82Å; F130-L351 HydrophobicContact CE2-CG 4.05Å; F130-L351 HydrophobicContact CZ-CB 3.93Å; F130-L354 HydrophobicContact CB-CD1 4.29Å; F130-L354 HydrophobicContact CD1-CB 3.84Å; F130-L354 HydrophobicContact CD2-CD1 4.44Å; F130-L354 HydrophobicContact CE1-CB 4.18Å; F130-L354 HydrophobicContact CG-CB 4.21Å; F130-L354 HydrophobicContact CG-CD1 4.18Å; F130-A355 HydrophobicContact CE1-CB 3.86Å; F130-W395 WeakPolarHBondContact O-CZ3 3.21Å
131	N	97.7	Very high	97.7	Very high	71 Å²	71	46 Å²	46	38%	0.38	25%	0.247	S	C	.	.	S	Bend	trans	-79.8	160.4	173.5	-67.7	-10.8	0	0	0	111.2	E128 P133 E134 V135	E128-N131 WeakPolarHBondContact O-CB 3.38Å; E128-N131 PolarHBondContact O-N 3.26Å; E128-N131 PolarHBondContact OE2-ND2 3.16Å; N131-P133 CarbonylContact O-C 3.55Å; N131-E134 VanDerWaalsContact CB-OE2 3.31Å; N131-E134 WeakPolarHBondContact CB-OE2 3.43Å; N131-E134 CarbonylContact O-C 3.59Å; N131-E134 PolarHBondContact O-N 2.85Å; N131-V135 WeakPolarHBondContact O-CG1 3.46Å; N131-V135 PolarHBondContact O-N 2.94Å
132	I	96.9	Very high	97.7	Very high	103 Å²	103	41.5 Å²	41.5	53%	0.528	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	127.5	170	-60.9	166	0	0	0	107.1	V135 W395 A396	I132-V135 HydrophobicContact CG1-CG1 4.39Å; I132-W395 VanDerWaalsContact CD1-O 3.27Å; I132-W395 WeakPolarHBondContact CD1-O 3.47Å; I132-A396 HydrophobicContact CD1-CB 3.98Å
133	P	95.8	Very high	97.7	Very high	93 Å²	93	41.5 Å²	41.5	60%	0.604	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	cis	-95	1.6	11	37.9	-36.6	0	0	0	116	N131 V135 G136	N131-P133 CarbonylContact O-C 3.55Å; P133-V135 VanDerWaalsContact C-N 3.31Å; P133-V135 PolarHBondContact O-N 3.11Å; P133-G136 PolarHBondContact O-N 3.25Å
134	E	97.4	Very high	97.8	Very high	53 Å²	53	40 Å²	40	25%	0.248	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-54.5	-39.9	-172.7	-72.1	70.7	-152.9	0	0	113.9	Y118 F125 E128 N131 G136 L137	Y118-E134 PolarHBondContact OH-O 2.9Å; F125-E134 HydrophobicContact CB-CB 4.47Å; F125-E134 HydrophobicContact CB-CG 4.2Å; F125-E134 HydrophobicContact CD1-CG 4.1Å; F125-E134 HydrophobicContact CD2-CB 3.54Å; F125-E134 HydrophobicContact CD2-CG 3.8Å; F125-E134 HydrophobicContact CE1-CG 4.44Å; F125-E134 HydrophobicContact CE2-CB 3.87Å; F125-E134 HydrophobicContact CE2-CG 4.16Å; F125-E134 WeakPolarHBondContact CE2-O 3Å; F125-E134 HydrophobicContact CG-CB 4.01Å; F125-E134 HydrophobicContact CG-CG 3.76Å; F125-E134 HydrophobicContact CZ-CG 4.47Å; E128-E134 WeakPolarHBondContact O-CB 3.36Å; N131-E134 VanDerWaalsContact CB-OE2 3.31Å; N131-E134 WeakPolarHBondContact CB-OE2 3.43Å; N131-E134 CarbonylContact O-C 3.59Å; N131-E134 PolarHBondContact O-N 2.85Å; E134-G136 PolarHBondContact O-N 3.45Å; E134-G136 VanDerWaalsContact O-N 3.09Å; E134-L137 PolarHBondContact O-N 3.09Å
135	V	98.4	Very high	97.8	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.012	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-61.9	-17.9	177.9	71.3	0	0	0	0	112.7	S129 N131 I132 P133 L137 L138 Y358 W395	S129-V135 VanDerWaalsContact O-CA 3.22Å; S129-V135 WeakPolarHBondContact O-CA 3.38Å; S129-V135 WeakPolarHBondContact O-CB 3.45Å; S129-V135 PolarHBondContact O-N 2.73Å; S129-V135 VanDerWaalsContact O-N 3.17Å; N131-V135 WeakPolarHBondContact O-CG1 3.46Å; N131-V135 PolarHBondContact O-N 2.94Å; I132-V135 HydrophobicContact CG1-CG1 4.39Å; P133-V135 VanDerWaalsContact C-N 3.31Å; P133-V135 PolarHBondContact O-N 3.11Å; V135-L137 PolarHBondContact O-N 3.01Å; V135-L137 VanDerWaalsContact O-N 3.08Å; V135-L138 VanDerWaalsContact O-CB 3.24Å; V135-L138 WeakPolarHBondContact O-CB 3.48Å; V135-L138 PolarHBondContact O-N 3.28Å; V135-Y358 HydrophobicContact CB-CD2 4.4Å; V135-Y358 HydrophobicContact CB-CE2 4.38Å; V135-Y358 HydrophobicContact CG1-CD2 3.83Å; V135-Y358 HydrophobicContact CG1-CE2 3.51Å; V135-Y358 HydrophobicContact CG2-CD1 3.8Å; V135-Y358 HydrophobicContact CG2-CD2 3.67Å; V135-Y358 HydrophobicContact CG2-CE1 4.17Å; V135-Y358 HydrophobicContact CG2-CE2 4.07Å; V135-Y358 HydrophobicContact CG2-CG 3.52Å; V135-Y358 WeakPolarHBondContact O-CE1 3.23Å; V135-W395 HydrophobicContact CG1-CE3 4.41Å
136	G	98.1	Very high	97.8	Very high	35 Å²	35	37.2 Å²	37.2	36%	0.361	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-64.3	-10.8	-178.9	0	0	0	0	0	116.2	P133 E134 L138 Y358	P133-G136 PolarHBondContact O-N 3.25Å; E134-G136 PolarHBondContact O-N 3.45Å; E134-G136 VanDerWaalsContact O-N 3.09Å; G136-L138 VanDerWaalsContact C-N 3.33Å; G136-Y358 WeakPolarHBondContact CA-OH 3.24Å
137	L	98.5	Very high	97.9	Very high	14 Å²	14	35.6 Å²	35.6	7%	0.073	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-91.8	6.3	171.7	-42.8	177	0	0	0	113.2	L49 D50 M57 R117 Y118 F125 E134 V135 T139	L49-L137 HydrophobicContact CB-CD1 4.3Å; D50-L137 HydrophobicContact CB-CD1 4.31Å; D50-L137 HydrophobicContact CB-CD2 4.11Å; D50-L137 WeakPolarHBondContact OD2-CD2 3.18Å; M57-L137 HydrophobicContact CE-CD1 4.14Å; M57-L137 HydrophobicContact CG-CD1 4.03Å; R117-L137 VanDerWaalsContact CD-O 3.26Å; R117-L137 WeakPolarHBondContact CD-O 3.45Å; R117-L137 PolarHBondContact NH1-O 2.91Å; Y118-L137 HydrophobicContact CE2-CB 4.29Å; Y118-L137 VanDerWaalsContact OH-CB 3.27Å; Y118-L137 WeakPolarHBondContact OH-CB 3.49Å; F125-L137 HydrophobicContact CE2-CD1 3.88Å; F125-L137 HydrophobicContact CE2-CG 4.46Å; F125-L137 HydrophobicContact CZ-CD1 3.69Å; E134-L137 PolarHBondContact O-N 3.09Å; V135-L137 PolarHBondContact O-N 3.01Å; V135-L137 VanDerWaalsContact O-N 3.08Å; L137-T139 PolarHBondContact O-N 2.82Å
138	L	98.9	Very high	98.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.155	C	C	.	.			trans	-86.8	88.3	170.7	-179.8	51.2	0	0	0	109.8	Y118 Y119 V135 G136 A355 Y358 Q359	Y118-L138 HydrophobicContact CD1-CB 4.25Å; Y118-L138 HydrophobicContact CD1-CD2 4.4Å; Y118-L138 HydrophobicContact CD2-CB 3.62Å; Y118-L138 HydrophobicContact CD2-CD1 3.77Å; Y118-L138 HydrophobicContact CD2-CD2 4.43Å; Y118-L138 HydrophobicContact CD2-CG 4.12Å; Y118-L138 HydrophobicContact CE1-CB 4.34Å; Y118-L138 HydrophobicContact CE2-CB 3.73Å; Y118-L138 HydrophobicContact CG-CB 3.9Å; Y118-L138 HydrophobicContact CG-CD1 4.07Å; Y118-L138 HydrophobicContact CG-CD2 4Å; Y118-L138 HydrophobicContact CG-CG 4.2Å; Y119-L138 HydrophobicContact CE2-CD1 4.32Å; V135-L138 VanDerWaalsContact O-CB 3.24Å; V135-L138 WeakPolarHBondContact O-CB 3.48Å; V135-L138 PolarHBondContact O-N 3.28Å; G136-L138 VanDerWaalsContact C-N 3.33Å; L138-A355 HydrophobicContact CD2-CB 3.73Å; L138-A355 WeakPolarHBondContact CD2-O 3.29Å; L138-Y358 HydrophobicContact CB-CD1 4.01Å; L138-Y358 HydrophobicContact CB-CE1 4.28Å; L138-Y358 HydrophobicContact CD2-CD1 4.13Å; L138-Y358 HydrophobicContact CG-CD1 4.18Å; L138-Q359 HydrophobicContact CD1-CG 4.06Å; L138-Q359 HydrophobicContact CD2-CG 4.03Å; L138-Q359 HydrophobicContact CG-CG 3.76Å
139	T	98.9	Very high	98.4	Very high	28 Å²	28	23.5 Å²	23.5	17%	0.172	14%	0.137	C	C	.	.			trans	-131.9	160.5	171	86.8	0	0	0	0	110.4	L137 E141 Q142 A143 E363	L137-T139 PolarHBondContact O-N 2.82Å; T139-E141 VanDerWaalsContact C-N 3.32Å; T139-E141 WeakPolarHBondContact CB-OE2 3.47Å; T139-E141 PolarHBondContact O-N 2.95Å; T139-E141 PolarHBondContact OG1-N 3.12Å; T139-E141 PolarHBondContact OG1-OE2 3.32Å; T139-Q142 HydrophobicContact CG2-CG 4.47Å; T139-Q142 PolarHBondContact O-N 3.1Å; T139-Q142 WeakPolarHBondContact OG1-CG 3.41Å; T139-Q142 PolarHBondContact OG1-N 3.39Å; T139-A143 PolarHBondContact O-N 2.78Å; T139-E363 WeakPolarHBondContact CA-OE2 3.39Å; T139-E363 WeakPolarHBondContact CB-OE2 3.31Å
140	V	98.9	Very high	98.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.1	-44.4	175.4	177.4	0	0	0	0	110.1	Q142 A143 L144 Y172 L176 Y179 E363 L404 F408	V140-Q142 VanDerWaalsContact C-N 3.33Å; V140-Q142 PolarHBondContact O-N 3.41Å; V140-A143 PolarHBondContact O-N 2.97Å; V140-L144 HydrophobicContact CG1-CD1 4.04Å; V140-L144 HydrophobicContact CG1-CG 4.3Å; V140-L144 VanDerWaalsContact O-CG 3.29Å; V140-L144 WeakPolarHBondContact O-CG 3.19Å; V140-L144 PolarHBondContact O-N 2.93Å; V140-Y172 HydrophobicContact CG2-CE2 4.04Å; V140-L176 HydrophobicContact CG1-CD2 3.89Å; V140-Y179 HydrophobicContact CG1-CD2 3.71Å; V140-Y179 HydrophobicContact CG1-CE2 4.11Å; V140-E363 WeakPolarHBondContact CG2-OE2 3.32Å; V140-E363 PolarHBondContact N-OE2 3.16Å; V140-L404 HydrophobicContact CG2-CD1 4.1Å; V140-F408 HydrophobicContact CB-CE2 4.02Å; V140-F408 HydrophobicContact CB-CZ 4.13Å; V140-F408 HydrophobicContact CG1-CE1 4.38Å; V140-F408 HydrophobicContact CG1-CE2 3.62Å; V140-F408 HydrophobicContact CG1-CZ 3.51Å
141	E	98.9	Very high	98.4	Very high	27 Å²	27	22.9 Å²	22.9	13%	0.126	14%	0.135	C	C	.	.	H	α-helix	trans	-63.2	-38.7	-179.3	-54.8	83.6	171	0	0	112.3	F52 T139 A143 L144 A145 E363 W403 Q407 F408	F52-E141 HydrophobicContact CE2-CB 3.62Å; F52-E141 HydrophobicContact CZ-CB 3.6Å; T139-E141 VanDerWaalsContact C-N 3.32Å; T139-E141 WeakPolarHBondContact CB-OE2 3.47Å; T139-E141 PolarHBondContact O-N 2.95Å; T139-E141 PolarHBondContact OG1-N 3.12Å; T139-E141 PolarHBondContact OG1-OE2 3.32Å; E141-A143 VanDerWaalsContact C-N 3.34Å; E141-L144 PolarHBondContact O-N 3.02Å; E141-A145 WeakPolarHBondContact O-CB 3.44Å; E141-A145 PolarHBondContact O-N 2.86Å; E141-E363 VanDerWaalsContact OE2-OE1 3.13Å; E141-W403 PolarHBondContact OE1-NE1 2.95Å; E141-W403 VanDerWaalsContact OE1-NE1 3.09Å; E141-Q407 WeakPolarHBondContact OE1-CG 3.4Å; E141-F408 HydrophobicContact CG-CZ 4.08Å
142	Q	98.9	Very high	98.5	Very high	8 Å²	8	25.4 Å²	25.4	4%	0.037	14%	0.139	C	C	.	.	H	α-helix	trans	-63.9	-41.8	177.7	-73.4	-80.8	19.4	0	0	110.7	D50 H51 F52 T139 V140 A145 D146	D50-Q142 PolarHBondContact OD1-NE2 3.11Å; H51-Q142 PolarHBondContact CD2-OE1 3.5Å; H51-Q142 VanDerWaalsContact CD2-OE1 3.25Å; F52-Q142 HydrophobicContact CD2-CG 3.93Å; F52-Q142 HydrophobicContact CE2-CB 4.4Å; F52-Q142 HydrophobicContact CE2-CG 3.93Å; T139-Q142 HydrophobicContact CG2-CG 4.47Å; T139-Q142 PolarHBondContact O-N 3.1Å; T139-Q142 WeakPolarHBondContact OG1-CG 3.41Å; T139-Q142 PolarHBondContact OG1-N 3.39Å; V140-Q142 VanDerWaalsContact C-N 3.33Å; V140-Q142 PolarHBondContact O-N 3.41Å; Q142-A145 PolarHBondContact O-N 3.04Å; Q142-D146 VanDerWaalsContact O-CG 3.23Å; Q142-D146 PolarHBondContact O-N 3.22Å
143	A	98.9	Very high	98.5	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-66.3	-40	175.3	0	0	0	0	0	112.7	H116 R117 T139 V140 E141 A145 D146 Y147	H116-A143 VanDerWaalsContact CE1-CB 3.48Å; H116-A143 WeakPolarHBondContact CE1-CB 3.45Å; H116-A143 WeakPolarHBondContact NE2-CB 3.21Å; R117-A143 HydrophobicContact CG-CB 4.3Å; T139-A143 PolarHBondContact O-N 2.78Å; V140-A143 PolarHBondContact O-N 2.97Å; E141-A143 VanDerWaalsContact C-N 3.34Å; A143-A145 VanDerWaalsContact C-N 3.35Å; A143-D146 WeakPolarHBondContact O-CB 3.26Å; A143-D146 PolarHBondContact O-N 3.24Å; A143-Y147 VanDerWaalsContact O-CD2 3.22Å; A143-Y147 WeakPolarHBondContact O-CD2 3.33Å; A143-Y147 PolarHBondContact O-N 3.39Å; A143-Y147 VanDerWaalsContact O-N 3.09Å
144	L	98.9	Very high	98.6	Very high	2 Å²	2	18.7 Å²	18.7	1%	0.01	10%	0.098	C	C	.	.	H	α-helix	trans	-65	-39.7	175.2	-63	173.9	0	0	0	111.8	V140 E141 D146 Y147 A148 L176 M180 Y184 F408	V140-L144 HydrophobicContact CG1-CD1 4.04Å; V140-L144 HydrophobicContact CG1-CG 4.3Å; V140-L144 VanDerWaalsContact O-CG 3.29Å; V140-L144 WeakPolarHBondContact O-CG 3.19Å; V140-L144 PolarHBondContact O-N 2.93Å; E141-L144 PolarHBondContact O-N 3.02Å; L144-D146 VanDerWaalsContact C-N 3.32Å; L144-Y147 PolarHBondContact O-N 3.41Å; L144-A148 WeakPolarHBondContact O-CB 3.34Å; L144-A148 PolarHBondContact O-N 2.9Å; L144-L176 HydrophobicContact CD2-CB 4.32Å; L144-L176 HydrophobicContact CD2-CD2 3.74Å; L144-L176 HydrophobicContact CG-CD2 4.21Å; L144-M180 HydrophobicContact CB-SD 3.97Å; L144-M180 HydrophobicContact CD2-CB 4.47Å; L144-M180 HydrophobicContact CD2-CG 3.57Å; L144-M180 HydrophobicContact CD2-SD 3.6Å; L144-M180 VanDerWaalsContact CD2-SD 3.6Å; L144-M180 HydrophobicContact CG-SD 4.38Å; L144-Y184 HydrophobicContact CB-CE2 3.97Å; L144-F408 HydrophobicContact CD1-CD1 4.47Å; L144-F408 HydrophobicContact CD1-CE1 3.42Å; L144-F408 VanDerWaalsContact CD1-CE1 3.42Å; L144-F408 HydrophobicContact CD1-CZ 3.76Å
145	A	98.9	Very high	98.6	Very high	8 Å²	8	17.6 Å²	17.6	7%	0.066	9%	0.092	C	C	.	.	H	α-helix	trans	-64.8	-37.1	174.6	0	0	0	0	0	111.8	H51 F52 E141 Q142 A143 A148 L149	H51-A145 HydrophobicContact CB-CB 3.78Å; H51-A145 VanDerWaalsContact CG-CB 3.49Å; F52-A145 HydrophobicContact CE2-CB 4.39Å; F52-A145 HydrophobicContact CZ-CB 4.02Å; E141-A145 WeakPolarHBondContact O-CB 3.44Å; E141-A145 PolarHBondContact O-N 2.86Å; Q142-A145 PolarHBondContact O-N 3.04Å; A143-A145 VanDerWaalsContact C-N 3.35Å; A145-A148 PolarHBondContact O-N 3.33Å; A145-L149 WeakPolarHBondContact O-CB 3.38Å; A145-L149 PolarHBondContact O-N 3.01Å
146	D	98.9	Very high	98.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-57.7	-51.1	172.7	-71.3	-21.3	0	0	0	111.7	Q47 H51 R117 Q142 A143 L144 A148 L149 M150	Q47-D146 HydrophobicContact CG-CB 4.18Å; Q47-D146 WeakPolarHBondContact CG-OD1 3.29Å; Q47-D146 PolarHBondContact NE2-O 2.99Å; Q47-D146 PolarHBondContact OE1-OD1 2.93Å; H51-D146 IonicContact CD2-OD1 3.48Å; H51-D146 PolarHBondContact CD2-OD1 3.09Å; H51-D146 IonicContact CE1-OD1 3.82Å; H51-D146 IonicContact NE2-OD1 2.71Å; H51-D146 PolarHBondContact NE2-OD1 3.03Å; R117-D146 IonicContact CZ-OD1 3.6Å; R117-D146 IonicContact CZ-OD2 3.41Å; R117-D146 IonicContact NE-OD1 3.67Å; R117-D146 IonicContact NE-OD2 2.7Å; R117-D146 PolarHBondContact NE-OD2 2.84Å; R117-D146 IonicContact NH2-OD1 2.71Å; R117-D146 PolarHBondContact NH2-OD1 3.09Å; R117-D146 IonicContact NH2-OD2 3.28Å; R117-D146 PolarHBondContact NH2-OD2 3.38Å; Q142-D146 VanDerWaalsContact O-CG 3.23Å; Q142-D146 PolarHBondContact O-N 3.22Å; A143-D146 WeakPolarHBondContact O-CB 3.26Å; A143-D146 PolarHBondContact O-N 3.24Å; L144-D146 VanDerWaalsContact C-N 3.32Å; D146-A148 PolarHBondContact O-N 3.45Å; D146-L149 PolarHBondContact O-N 2.8Å; D146-M150 WeakPolarHBondContact O-CB 3.47Å; D146-M150 PolarHBondContact O-N 2.91Å
147	Y	98.9	Very high	98.5	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-63	-42.2	179.4	-59.8	-32.9	0	0	0	111.8	F82 T84 G85 A114 H116 A143 L144 M150 I151 L176 M180	F82-Y147 AromaticContact CE1-CD1 3.78Å; F82-Y147 HydrophobicContact CE1-CD1 3.78Å; F82-Y147 AromaticContact CE1-CG 3.8Å; F82-Y147 HydrophobicContact CE1-CG 3.8Å; F82-Y147 AromaticContact CZ-CD1 3.83Å; F82-Y147 HydrophobicContact CZ-CD1 3.83Å; F82-Y147 HydrophobicContact CZ-CG 4.14Å; T84-Y147 HydrophobicContact CG2-CD2 3.82Å; T84-Y147 HydrophobicContact CG2-CE2 4.08Å; T84-Y147 HydrophobicContact CG2-CG 4.47Å; G85-Y147 PolarHBondContact N-OH 3.26Å; G85-Y147 PolarHBondContact O-OH 3.14Å; A114-Y147 HydrophobicContact CB-CD1 3.76Å; A114-Y147 HydrophobicContact CB-CE1 3.71Å; H116-Y147 VanDerWaalsContact CA-OH 3.31Å; H116-Y147 WeakPolarHBondContact CA-OH 3.5Å; H116-Y147 WeakPolarHBondContact CB-OH 3.34Å; A143-Y147 VanDerWaalsContact O-CD2 3.22Å; A143-Y147 WeakPolarHBondContact O-CD2 3.33Å; A143-Y147 PolarHBondContact O-N 3.39Å; A143-Y147 VanDerWaalsContact O-N 3.09Å; L144-Y147 PolarHBondContact O-N 3.41Å; Y147-M150 PolarHBondContact O-N 2.84Å; Y147-I151 WeakPolarHBondContact O-CB 3.26Å; Y147-I151 WeakPolarHBondContact O-CD1 3.17Å; Y147-I151 WeakPolarHBondContact O-CG1 3.38Å; Y147-I151 PolarHBondContact O-N 2.97Å; Y147-L176 HydrophobicContact CE2-CD1 4.18Å; Y147-M180 HydrophobicContact CD2-SD 4.39Å
148	A	98.9	Very high	98.4	Very high	7 Å²	7	29.3 Å²	29.3	6%	0.058	14%	0.138	C	C	.	.	H	α-helix	trans	-59.8	-48.5	175.8	0	0	0	0	0	111.3	L144 A145 D146 M150 I151 R152 M180 Y184 M187	L144-A148 WeakPolarHBondContact O-CB 3.34Å; L144-A148 PolarHBondContact O-N 2.9Å; A145-A148 PolarHBondContact O-N 3.33Å; D146-A148 PolarHBondContact O-N 3.45Å; A148-M150 PolarHBondContact O-N 3.21Å; A148-I151 PolarHBondContact O-N 3.32Å; A148-R152 PolarHBondContact O-N 3.42Å; A148-M180 HydrophobicContact CB-CE 4.42Å; A148-Y184 HydrophobicContact CB-CD1 3.81Å; A148-Y184 HydrophobicContact CB-CD2 4.35Å; A148-Y184 HydrophobicContact CB-CE1 3.71Å; A148-Y184 HydrophobicContact CB-CE2 4.29Å; A148-Y184 HydrophobicContact CB-CG 4.12Å; A148-M187 HydrophobicContact CB-CE 4.36Å; A148-M187 HydrophobicContact CB-SD 4.01Å; A148-M187 WeakPolarHBondContact O-CE 3.36Å
149	L	98.8	Very high	98.2	Very high	25 Å²	25	33 Å²	33	13%	0.131	17%	0.168	C	C	.	.	H	α-helix	trans	-61.5	-46.9	179	-173.1	63.8	0	0	0	111.6	F45 A145 D146 I151 R152 E153	F45-L149 HydrophobicContact CE1-CD2 4.26Å; F45-L149 HydrophobicContact CE1-CG 4.24Å; F45-L149 HydrophobicContact CZ-CD2 4.47Å; F45-L149 HydrophobicContact CZ-CG 4.18Å; A145-L149 WeakPolarHBondContact O-CB 3.38Å; A145-L149 PolarHBondContact O-N 3.01Å; D146-L149 PolarHBondContact O-N 2.8Å; L149-I151 PolarHBondContact O-N 2.94Å; L149-R152 WeakPolarHBondContact O-CB 3.45Å; L149-R152 PolarHBondContact O-N 3.33Å; L149-E153 HydrophobicContact CD1-CG 4.42Å; L149-E153 WeakPolarHBondContact CD1-OE1 3.36Å; L149-E153 PolarHBondContact O-N 3.39Å
150	M	98.8	Very high	98.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.4	-46.3	178.7	-175	-172.5	-67.5	0	0	111.4	F45 Q64 Y66 F82 A114 D146 Y147 A148 R152 E153 L154	F45-M150 HydrophobicContact CB-CE 3.83Å; F45-M150 HydrophobicContact CD1-CB 4.18Å; F45-M150 HydrophobicContact CD1-CE 4.19Å; F45-M150 HydrophobicContact CD1-CG 4.32Å; F45-M150 HydrophobicContact CD2-CG 4.26Å; F45-M150 HydrophobicContact CE1-CB 4.21Å; F45-M150 HydrophobicContact CG-CB 4.45Å; F45-M150 HydrophobicContact CG-CE 4.15Å; F45-M150 HydrophobicContact CG-CG 4.1Å; F45-M150 HydrophobicContact CZ-CB 4.49Å; Q64-M150 HydrophobicContact CB-CE 4.38Å; Q64-M150 HydrophobicContact CG-CE 3.92Å; Y66-M150 HydrophobicContact CD1-CE 4.27Å; Y66-M150 HydrophobicContact CD1-SD 4.37Å; Y66-M150 HydrophobicContact CG-CE 4.48Å; Y66-M150 HydrophobicContact CG-SD 4.19Å; F82-M150 HydrophobicContact CE2-SD 3.99Å; F82-M150 HydrophobicContact CZ-SD 4.1Å; A114-M150 HydrophobicContact CB-CE 4.05Å; A114-M150 HydrophobicContact CB-SD 3.66Å; D146-M150 WeakPolarHBondContact O-CB 3.47Å; D146-M150 PolarHBondContact O-N 2.91Å; Y147-M150 PolarHBondContact O-N 2.84Å; A148-M150 PolarHBondContact O-N 3.21Å; M150-R152 VanDerWaalsContact C-N 3.33Å; M150-R152 PolarHBondContact O-N 3.46Å; M150-E153 PolarHBondContact O-N 3.1Å; M150-L154 HydrophobicContact CG-CD1 3.56Å; M150-L154 HydrophobicContact CG-CG 4.03Å; M150-L154 VanDerWaalsContact O-CB 3.27Å; M150-L154 WeakPolarHBondContact O-CB 3.39Å; M150-L154 VanDerWaalsContact O-CG 3.28Å; M150-L154 WeakPolarHBondContact O-CG 3.19Å; M150-L154 PolarHBondContact O-N 3.07Å; M150-L154 HydrophobicContact SD-CD1 4.14Å
151	I	98.8	Very high	97.7	Very high	5 Å²	5	34.7 Å²	34.7	3%	0.026	18%	0.181	C	C	.	.	H	α-helix	trans	-58.1	-46.7	176.8	-72.9	163.6	0	0	0	110.6	F82 Y147 A148 L149 K155 V165 M180 M187 V188	F82-I151 HydrophobicContact CD1-CD1 4.16Å; F82-I151 HydrophobicContact CD2-CD1 4.12Å; F82-I151 HydrophobicContact CD2-CG1 3.63Å; F82-I151 HydrophobicContact CE1-CD1 4.28Å; F82-I151 HydrophobicContact CE2-CD1 4.23Å; F82-I151 HydrophobicContact CE2-CG1 3.61Å; F82-I151 HydrophobicContact CG-CD1 4.06Å; F82-I151 HydrophobicContact CG-CG1 4.1Å; F82-I151 HydrophobicContact CZ-CD1 4.29Å; F82-I151 HydrophobicContact CZ-CG1 4.06Å; Y147-I151 WeakPolarHBondContact O-CB 3.26Å; Y147-I151 WeakPolarHBondContact O-CD1 3.17Å; Y147-I151 WeakPolarHBondContact O-CG1 3.38Å; Y147-I151 PolarHBondContact O-N 2.97Å; A148-I151 PolarHBondContact O-N 3.32Å; L149-I151 PolarHBondContact O-N 2.94Å; I151-K155 HydrophobicContact CG2-CD 4Å; I151-K155 VanDerWaalsContact O-CB 3.29Å; I151-K155 WeakPolarHBondContact O-CB 3.45Å; I151-K155 WeakPolarHBondContact O-CG 3.26Å; I151-K155 PolarHBondContact O-N 3.21Å; I151-V165 HydrophobicContact CD1-CG1 4.21Å; I151-V165 HydrophobicContact CG2-CG1 4.47Å; I151-V165 HydrophobicContact CG2-CG2 3.9Å; I151-M180 HydrophobicContact CD1-CE 3.94Å; I151-M187 HydrophobicContact CB-CE 4.26Å; I151-M187 HydrophobicContact CG2-CE 4.07Å; I151-V188 HydrophobicContact CD1-CG2 4.35Å
152	R	98.2	Very high	97.3	Very high	123 Å²	123	38.8 Å²	38.8	46%	0.464	20%	0.2	S	C	.	.	H	α-helix	trans	-57.6	-53.7	179.9	-176	-171.5	71.5	-178.1	7	111	A148 L149 M150 K155 E156 M187	A148-R152 PolarHBondContact O-N 3.42Å; L149-R152 WeakPolarHBondContact O-CB 3.45Å; L149-R152 PolarHBondContact O-N 3.33Å; M150-R152 VanDerWaalsContact C-N 3.33Å; M150-R152 PolarHBondContact O-N 3.46Å; R152-K155 PolarHBondContact O-N 3.01Å; R152-E156 PolarHBondContact O-N 2.95Å; R152-M187 HydrophobicContact CB-CE 3.89Å
153	E	98.3	Very high	97.2	Very high	52 Å²	52	38.4 Å²	38.4	24%	0.243	20%	0.198	C	C	.	.	H	α-helix	trans	-75	-38.6	-171.4	-66.6	-168.6	-173.2	0	0	112.5	F45 L149 M150 K155 E156 Q157	F45-E153 HydrophobicContact CE2-CB 3.84Å; F45-E153 WeakPolarHBondContact CE2-OE2 3.37Å; F45-E153 HydrophobicContact CZ-CB 4.08Å; F45-E153 HydrophobicContact CZ-CG 4.32Å; F45-E153 WeakPolarHBondContact CZ-OE2 3.36Å; L149-E153 HydrophobicContact CD1-CG 4.42Å; L149-E153 WeakPolarHBondContact CD1-OE1 3.36Å; L149-E153 PolarHBondContact O-N 3.39Å; M150-E153 PolarHBondContact O-N 3.1Å; E153-K155 VanDerWaalsContact C-N 3.28Å; E153-K155 PolarHBondContact O-N 3.29Å; E153-E156 PolarHBondContact O-N 2.97Å; E153-Q157 WeakPolarHBondContact O-CB 3.4Å; E153-Q157 VanDerWaalsContact O-CG 3.26Å; E153-Q157 WeakPolarHBondContact O-CG 3.4Å; E153-Q157 PolarHBondContact O-N 3.35Å
154	L	98.2	Very high	97.2	Very high	4 Å²	4	38.5 Å²	38.5	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-65.1	-34.3	174.1	-67.7	-176.9	0	0	0	111.6	Y66 I112 M150 E156 Q157 L158	Y66-L154 HydrophobicContact CD2-CD1 4.39Å; Y66-L154 HydrophobicContact CE2-CD1 3.99Å; I112-L154 HydrophobicContact CD1-CD1 3.89Å; M150-L154 HydrophobicContact CG-CD1 3.56Å; M150-L154 HydrophobicContact CG-CG 4.03Å; M150-L154 VanDerWaalsContact O-CB 3.27Å; M150-L154 WeakPolarHBondContact O-CB 3.39Å; M150-L154 VanDerWaalsContact O-CG 3.28Å; M150-L154 WeakPolarHBondContact O-CG 3.19Å; M150-L154 PolarHBondContact O-N 3.07Å; M150-L154 HydrophobicContact SD-CD1 4.14Å; L154-E156 VanDerWaalsContact C-N 3.3Å; L154-E156 PolarHBondContact O-N 3.01Å; L154-Q157 PolarHBondContact O-N 3.44Å; L154-L158 HydrophobicContact CB-CD1 4.39Å; L154-L158 WeakPolarHBondContact O-CB 3.39Å; L154-L158 WeakPolarHBondContact O-CG 3.39Å; L154-L158 PolarHBondContact O-N 3.47Å
155	K	97.3	Very high	97.2	Very high	29 Å²	29	38.5 Å²	38.5	13%	0.126	20%	0.199	C	C	.	.	H	α-helix	trans	-60.7	-40.6	173.1	-80.5	-178.3	67.8	162.1	0	112.1	I80 I151 R152 E153 A159 A160 S161 C163 V165	I80-K155 HydrophobicContact CD1-CD 4.17Å; I80-K155 HydrophobicContact CD1-CG 3.54Å; I151-K155 HydrophobicContact CG2-CD 4Å; I151-K155 VanDerWaalsContact O-CB 3.29Å; I151-K155 WeakPolarHBondContact O-CB 3.45Å; I151-K155 WeakPolarHBondContact O-CG 3.26Å; I151-K155 PolarHBondContact O-N 3.21Å; R152-K155 PolarHBondContact O-N 3.01Å; E153-K155 VanDerWaalsContact C-N 3.28Å; E153-K155 PolarHBondContact O-N 3.29Å; K155-A159 PolarHBondContact O-N 3.24Å; K155-A160 WeakPolarHBondContact CE-O 3.22Å; K155-A160 CarbonylContact O-C 3.47Å; K155-A160 WeakPolarHBondContact O-CA 3.41Å; K155-A160 PolarHBondContact O-N 2.91Å; K155-S161 WeakPolarHBondContact CE-O 3.4Å; K155-S161 PolarHBondContact NZ-O 3.41Å; K155-S161 PolarHBondContact O-N 3.08Å; K155-C163 WeakPolarHBondContact CE-O 3.22Å; K155-C163 PolarHBondContact NZ-O 2.97Å; K155-V165 HydrophobicContact CD-CG2 3.92Å
156	E	96.4	Very high	97.2	Very high	126 Å²	126	38.1 Å²	38.1	59%	0.589	20%	0.196	S	C	*	.	H	α-helix	trans	-68.6	-51.2	176.2	-69	174.5	-176.6	0	0	111.4	R152 E153 L154 L158 A159	R152-E156 PolarHBondContact O-N 2.95Å; E153-E156 PolarHBondContact O-N 2.97Å; L154-E156 VanDerWaalsContact C-N 3.3Å; L154-E156 PolarHBondContact O-N 3.01Å; E156-L158 PolarHBondContact O-N 3.45Å; E156-A159 PolarHBondContact O-N 3.43Å; E156-A159 VanDerWaalsContact O-N 3.09Å
157	Q	96.6	Very high	97.2	Very high	132 Å²	132	38.1 Å²	38.1	62%	0.617	20%	0.196	S	C	*	.	H	α-helix	trans	-60.5	-32.6	-177.8	-69.2	173	21.3	0	0	113.1	E153 L154	E153-Q157 WeakPolarHBondContact O-CB 3.4Å; E153-Q157 VanDerWaalsContact O-CG 3.26Å; E153-Q157 WeakPolarHBondContact O-CG 3.4Å; E153-Q157 PolarHBondContact O-N 3.35Å; L154-Q157 PolarHBondContact O-N 3.44Å
158	L	96.8	Very high	97.2	Very high	40 Å²	40	38.1 Å²	38.1	21%	0.209	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	3.6	-178.9	-60.8	172.8	0	0	0	113.4	I68 W73 L110 L154 E156 A160	I68-L158 HydrophobicContact CD1-CD1 4.01Å; W73-L158 HydrophobicContact CH2-CB 3.97Å; W73-L158 WeakPolarHBondContact CH2-O 3.43Å; W73-L158 HydrophobicContact CZ3-CB 4.34Å; L110-L158 HydrophobicContact CD2-CD1 3.6Å; L154-L158 HydrophobicContact CB-CD1 4.39Å; L154-L158 WeakPolarHBondContact O-CB 3.39Å; L154-L158 WeakPolarHBondContact O-CG 3.39Å; L154-L158 PolarHBondContact O-N 3.47Å; E156-L158 PolarHBondContact O-N 3.45Å; L158-A160 HydrophobicContact CB-CB 4.3Å; L158-A160 PolarHBondContact O-N 3.38Å
159	A	95.7	Very high	97.2	Very high	76 Å²	76	37.8 Å²	37.8	63%	0.628	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.8	41.9	-172.1	0	0	0	0	0	112.6	K155 E156	K155-A159 PolarHBondContact O-N 3.24Å; E156-A159 PolarHBondContact O-N 3.43Å; E156-A159 VanDerWaalsContact O-N 3.09Å
160	A	95.8	Very high	97.2	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.008	19%	0.187	C	C	.	.			trans	-112.2	20	-176.4	0	0	0	0	0	112.8	W73 I80 K155 L158 H162 C163	W73-A160 HydrophobicContact CH2-CB 4.02Å; W73-A160 HydrophobicContact CZ2-CB 3.73Å; I80-A160 HydrophobicContact CD1-CB 4.19Å; K155-A160 WeakPolarHBondContact CE-O 3.22Å; K155-A160 CarbonylContact O-C 3.47Å; K155-A160 WeakPolarHBondContact O-CA 3.41Å; K155-A160 PolarHBondContact O-N 2.91Å; L158-A160 HydrophobicContact CB-CB 4.3Å; L158-A160 PolarHBondContact O-N 3.38Å; A160-H162 PolarHBondContact O-N 3.21Å; A160-C163 HydrophobicContact CB-CB 4.1Å; A160-C163 VanDerWaalsContact O-CB 3.27Å; A160-C163 WeakPolarHBondContact O-CB 3.42Å; A160-C163 PolarHBondContact O-N 3.23Å
161	S	90.7	Very high	97.2	Very high	63 Å²	63	37.1 Å²	37.1	44%	0.441	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-33.9	-174.8	-51.2	0	0	0	0	114	K155	K155-S161 WeakPolarHBondContact CE-O 3.4Å; K155-S161 PolarHBondContact NZ-O 3.41Å; K155-S161 PolarHBondContact O-N 3.08Å
162	H	90.6	Very high	97.2	Very high	114 Å²	114	37 Å²	37	53%	0.528	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	3.8	178.5	-57.2	-65.3	0	0	0	114.8	A160 P164 L489	A160-H162 PolarHBondContact O-N 3.21Å; H162-P164 WeakPolarHBondContact O-CD 3.32Å; H162-L489 WeakPolarHBondContact O-CD1 3.34Å
163	C	97.1	Very high	97.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.167	C	C	.	.			trans	-78.3	123.9	177.1	-63	0	0	0	0	109.7	G76 G78 I80 K155 A160	G76-C163 VanDerWaalsContact C-SG 3.54Å; G78-C163 WeakPolarHBondContact O-CB 3.36Å; G78-C163 PolarHBondContact O-SG 3.15Å; I80-C163 HydrophobicContact CD1-CB 4.41Å; I80-C163 HydrophobicContact CG1-CB 4.17Å; K155-C163 WeakPolarHBondContact CE-O 3.22Å; K155-C163 PolarHBondContact NZ-O 2.97Å; A160-C163 HydrophobicContact CB-CB 4.1Å; A160-C163 VanDerWaalsContact O-CB 3.27Å; A160-C163 WeakPolarHBondContact O-CB 3.42Å; A160-C163 PolarHBondContact O-N 3.23Å
164	P	98.3	Very high	97.2	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.013	16%	0.156	C	C	.	.			trans	-60.1	146.2	170.8	-25.1	36.8	0	0	0	111.1	P79 I80 H162 A189 V482 E485 R486	P79-P164 CarbonylContact C-O 3.36Å; P79-P164 VanDerWaalsContact CA-O 3.23Å; P79-P164 WeakPolarHBondContact CA-O 3.44Å; P79-P164 WeakPolarHBondContact CB-O 3.36Å; I80-P164 PolarHBondContact N-O 2.95Å; H162-P164 WeakPolarHBondContact O-CD 3.32Å; P164-A189 HydrophobicContact CB-CB 4.42Å; P164-V482 HydrophobicContact CB-CG1 4.35Å; P164-V482 HydrophobicContact CB-CG2 4.49Å; P164-V482 HydrophobicContact CG-CG1 4.14Å; P164-V482 WeakPolarHBondContact CG-O 3.14Å; P164-E485 HydrophobicContact CB-CB 4.02Å; P164-E485 HydrophobicContact CB-CG 3.85Å; P164-E485 HydrophobicContact CG-CB 4.14Å; P164-E485 HydrophobicContact CG-CG 4.05Å; P164-R486 HydrophobicContact CG-CB 4.26Å
165	V	98.9	Very high	97.3	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.006	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	132.3	177.6	-175.1	0	0	0	0	109.1	I80 F82 I151 K155 V188 A189	I80-V165 HydrophobicContact CB-CG1 4.47Å; I80-V165 HydrophobicContact CB-CG2 4.24Å; I80-V165 HydrophobicContact CD1-CG2 4.36Å; I80-V165 CarbonylContact O-C 3.51Å; I80-V165 WeakPolarHBondContact O-CA 3.47Å; F82-V165 HydrophobicContact CB-CG1 4.1Å; I151-V165 HydrophobicContact CD1-CG1 4.21Å; I151-V165 HydrophobicContact CG2-CG1 4.47Å; I151-V165 HydrophobicContact CG2-CG2 3.9Å; K155-V165 HydrophobicContact CD-CG2 3.92Å; V165-V188 CarbonylContact O-C 3.23Å; V165-A189 WeakPolarHBondContact O-CB 3.21Å; V165-A189 PolarHBondContact O-N 3.42Å
166	I	98.9	Very high	97.4	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	129.1	171.3	-57	-68.9	0	0	0	106.9	I80 F81 F82 F168 A189 G190 I478 W481 V482	I80-I166 PolarHBondContact O-N 3.09Å; F81-I166 WeakPolarHBondContact CA-O 3.47Å; F81-I166 HydrophobicContact CD1-CB 4.04Å; F81-I166 HydrophobicContact CD1-CG1 4.45Å; F81-I166 HydrophobicContact CE1-CB 4.26Å; F81-I166 HydrophobicContact CE1-CG1 4.27Å; F82-I166 PolarHBondContact N-O 2.98Å; I166-F168 HydrophobicContact CB-CE2 3.85Å; I166-F168 HydrophobicContact CB-CZ 4.33Å; I166-F168 HydrophobicContact CG2-CD2 4.23Å; I166-F168 HydrophobicContact CG2-CE2 3.51Å; I166-F168 HydrophobicContact CG2-CZ 3.68Å; I166-F168 WeakPolarHBondContact O-CD2 3.48Å; I166-A189 HydrophobicContact CD1-CB 3.96Å; I166-G190 WeakPolarHBondContact CA-O 3.27Å; I166-I478 HydrophobicContact CG1-CG2 4.03Å; I166-I478 HydrophobicContact CG2-CG1 4.28Å; I166-I478 HydrophobicContact CG2-CG2 4.15Å; I166-W481 HydrophobicContact CD1-CB 4.24Å; I166-W481 HydrophobicContact CD1-CE3 4.39Å; I166-V482 HydrophobicContact CD1-CG2 4.07Å; I166-V482 HydrophobicContact CG1-CG2 3.75Å
167	V	98.9	Very high	97.5	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	145.1	177.6	-63.2	0	0	0	0	111.2	F82 T84 S177 M180 V188 G190 A191 L192	F82-V167 HydrophobicContact CB-CG1 4.34Å; F82-V167 HydrophobicContact CD1-CG1 4.35Å; F82-V167 CarbonylContact O-C 3.53Å; F82-V167 WeakPolarHBondContact O-CA 3.33Å; T84-V167 HydrophobicContact CG2-CB 4.26Å; T84-V167 HydrophobicContact CG2-CG1 4.34Å; V167-S177 WeakPolarHBondContact CG2-O 3.48Å; V167-M180 HydrophobicContact CG1-CB 4.38Å; V167-M180 HydrophobicContact CG2-CB 4.21Å; V167-V188 HydrophobicContact CB-CG1 4.16Å; V167-V188 HydrophobicContact CG1-CB 4.32Å; V167-V188 HydrophobicContact CG1-CG1 3.67Å; V167-V188 HydrophobicContact CG1-CG2 3.64Å; V167-V188 HydrophobicContact CG2-CG1 3.59Å; V167-G190 PolarHBondContact N-O 3.16Å; V167-A191 HydrophobicContact CG2-CB 3.54Å; V167-A191 CarbonylContact O-C 3.5Å; V167-A191 WeakPolarHBondContact O-CA 3.34Å; V167-L192 PolarHBondContact O-N 3.02Å
168	F	98.9	Very high	97.6	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	146.9	-178.6	-63.3	-100.8	0	0	0	109.8	F81 F82 Y83 T84 I100 L103 I166 S177 L192 I478	F81-F168 HydrophobicContact CB-CD2 4.08Å; F81-F168 HydrophobicContact CB-CE2 3.52Å; F81-F168 HydrophobicContact CB-CZ 4.32Å; F81-F168 AromaticContact CD1-CE2 3.61Å; F81-F168 HydrophobicContact CD1-CE2 3.61Å; F81-F168 AromaticContact CD1-CZ 3.96Å; F81-F168 HydrophobicContact CD1-CZ 3.96Å; F81-F168 HydrophobicContact CD2-CE2 4.08Å; F81-F168 HydrophobicContact CD2-CZ 4.04Å; F81-F168 HydrophobicContact CE1-CE2 4.3Å; F81-F168 HydrophobicContact CE1-CZ 4.23Å; F81-F168 HydrophobicContact CE2-CZ 4.31Å; F81-F168 HydrophobicContact CG-CD2 4.47Å; F81-F168 AromaticContact CG-CE2 3.47Å; F81-F168 HydrophobicContact CG-CE2 3.47Å; F81-F168 VanDerWaalsContact CG-CE2 3.47Å; F81-F168 AromaticContact CG-CZ 3.86Å; F81-F168 HydrophobicContact CG-CZ 3.86Å; F81-F168 HydrophobicContact CZ-CZ 4.4Å; F82-F168 PolarHBondContact O-N 3.12Å; Y83-F168 CarbonylContact C-O 3.57Å; Y83-F168 VanDerWaalsContact CA-O 3.28Å; Y83-F168 WeakPolarHBondContact CA-O 3.49Å; Y83-F168 HydrophobicContact CD2-CB 4.19Å; T84-F168 PolarHBondContact N-O 3.34Å; T84-F168 PolarHBondContact OG1-O 3.07Å; I100-F168 HydrophobicContact CD1-CB 3.56Å; I100-F168 HydrophobicContact CD1-CD1 4.08Å; I100-F168 HydrophobicContact CD1-CG 3.85Å; I100-F168 HydrophobicContact CG1-CB 4.3Å; I100-F168 HydrophobicContact CG1-CD1 3.86Å; I100-F168 HydrophobicContact CG1-CE1 4.37Å; I100-F168 HydrophobicContact CG1-CG 4.07Å; L103-F168 HydrophobicContact CD2-CE1 4.18Å; L103-F168 HydrophobicContact CD2-CZ 4.11Å; I166-F168 HydrophobicContact CB-CE2 3.85Å; I166-F168 HydrophobicContact CB-CZ 4.33Å; I166-F168 HydrophobicContact CG2-CD2 4.23Å; I166-F168 HydrophobicContact CG2-CE2 3.51Å; I166-F168 HydrophobicContact CG2-CZ 3.68Å; I166-F168 WeakPolarHBondContact O-CD2 3.48Å; F168-S177 WeakPolarHBondContact CA-OG 3.49Å; F168-S177 PolarHBondContact N-OG 2.91Å; F168-S177 PolarHBondContact O-OG 2.89Å; F168-S177 VanDerWaalsContact O-OG 3.06Å; F168-L192 HydrophobicContact CD1-CB 3.84Å; F168-L192 HydrophobicContact CD1-CD2 3.88Å; F168-L192 HydrophobicContact CD1-CG 4.34Å; F168-L192 HydrophobicContact CE1-CB 4.16Å; F168-L192 HydrophobicContact CE1-CD2 4.03Å; F168-I478 HydrophobicContact CE1-CD1 3.71Å; F168-I478 HydrophobicContact CZ-CD1 3.89Å
169	G	98.9	Very high	97.7	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.4	148.9	169.7	0	0	0	0	0	112.9	G173 G174 S177 L192 A194	G169-G173 VanDerWaalsContact CA-C 3.45Å; G169-G174 VanDerWaalsContact C-CA 3.44Å; G169-G174 WeakPolarHBondContact O-CA 3.41Å; G169-G174 PolarHBondContact O-N 3.45Å; G169-S177 PolarHBondContact N-OG 2.93Å; G169-L192 PolarHBondContact N-O 3.43Å; G169-A194 PolarHBondContact O-N 3.38Å
170	G	98.8	Very high	97.8	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	151	169.9	0	0	0	0	0	110.9	Y83 Y172 G173 G174 A194	Y83-G170 PolarHBondContact OH-N 2.92Å; G170-Y172 PolarHBondContact O-N 3.25Å; G170-G173 WeakPolarHBondContact O-CA 3.47Å; G170-G173 PolarHBondContact O-N 3.39Å; G170-G174 PolarHBondContact O-N 2.93Å; G170-G174 VanDerWaalsContact O-N 3.14Å; G170-A194 CarbonylContact C-O 3.57Å; G170-A194 VanDerWaalsContact CA-O 3.25Å; G170-A194 WeakPolarHBondContact CA-O 3.35Å
171	S	98.7	Very high	98	Very high	12 Å²	12	10.5 Å²	10.5	8%	0.084	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	59	-133	176.7	-167.9	0	0	0	0	112.2	E87 G173 G174 M175 A194 S195 H452	E87-S171 PolarHBondContact OE1-OG 3.33Å; S171-G173 PolarHBondContact O-N 2.88Å; S171-G174 VanDerWaalsContact O-CA 3.29Å; S171-G174 WeakPolarHBondContact O-CA 3.42Å; S171-G174 PolarHBondContact O-N 3.09Å; S171-M175 PolarHBondContact O-N 3.42Å; S171-A194 PolarHBondContact N-O 3.48Å; S171-S195 WeakPolarHBondContact CA-O 3.22Å; S171-H452 VanDerWaalsContact CB-NE2 3.31Å; S171-H452 WeakPolarHBondContact CB-NE2 3.37Å; S171-H452 PolarHBondContact OG-NE2 3.32Å
172	Y	98.9	Very high	98.4	Very high	1 Å²	1	8 Å²	8	0%	0.004	4%	0.038	C	C	.	.	H	α-helix	trans	-57.5	-29.7	168.9	167.6	-125.4	0	0	0	112.8	N86 E87 H116 V140 G170 G174 M175 L176 W356 Q359	N86-Y172 HydrophobicContact CB-CD1 3.78Å; N86-Y172 HydrophobicContact CB-CG 4.38Å; E87-Y172 HydrophobicContact CB-CD1 4.45Å; E87-Y172 VanDerWaalsContact OE2-CB 3.3Å; E87-Y172 WeakPolarHBondContact OE2-CB 3.49Å; E87-Y172 WeakPolarHBondContact OE2-CD1 3.2Å; H116-Y172 AromaticContact CD2-CE1 3.71Å; H116-Y172 AromaticContact NE2-CE1 3.48Å; H116-Y172 WeakPolarHBondContact NE2-CE1 3.33Å; H116-Y172 AromaticContact NE2-CZ 3.52Å; H116-Y172 PolarHBondContact NE2-OH 3.42Å; V140-Y172 HydrophobicContact CG2-CE2 4.04Å; G170-Y172 PolarHBondContact O-N 3.25Å; Y172-G174 VanDerWaalsContact C-N 3.27Å; Y172-G174 PolarHBondContact O-N 3.41Å; Y172-M175 HydrophobicContact CD2-CB 4.24Å; Y172-M175 HydrophobicContact CD2-CE 3.95Å; Y172-M175 HydrophobicContact CD2-SD 4.04Å; Y172-M175 WeakPolarHBondContact O-CA 3.09Å; Y172-M175 WeakPolarHBondContact O-CB 3.23Å; Y172-M175 PolarHBondContact O-N 3.1Å; Y172-M175 VanDerWaalsContact O-N 3.13Å; Y172-L176 HydrophobicContact CD1-CD1 4.15Å; Y172-L176 HydrophobicContact CD2-CD1 4.43Å; Y172-L176 HydrophobicContact CD2-CG 4.14Å; Y172-L176 HydrophobicContact CE1-CD1 3.72Å; Y172-L176 HydrophobicContact CE1-CG 4.32Å; Y172-L176 HydrophobicContact CE2-CD1 4.03Å; Y172-L176 HydrophobicContact CE2-CD2 3.82Å; Y172-L176 HydrophobicContact CE2-CG 3.69Å; Y172-L176 HydrophobicContact CG-CD1 4.47Å; Y172-L176 WeakPolarHBondContact O-CG 3.14Å; Y172-L176 PolarHBondContact O-N 3.3Å; Y172-W356 HydrophobicContact CD1-CE3 4.45Å; Y172-W356 HydrophobicContact CD1-CH2 4.5Å; Y172-W356 AromaticContact CD1-CZ3 3.69Å; Y172-W356 HydrophobicContact CD1-CZ3 3.69Å; Y172-W356 HydrophobicContact CD2-CZ3 4.33Å; Y172-W356 HydrophobicContact CE1-CZ3 4.25Å; Y172-W356 HydrophobicContact CG-CH2 4.15Å; Y172-W356 AromaticContact CG-CZ3 3.76Å; Y172-W356 HydrophobicContact CG-CZ3 3.76Å; Y172-Q359 PolarHBondContact OH-NE2 3.01Å
173	G	98.9	Very high	98.7	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-60.7	-38.2	168.2	0	0	0	0	0	112.1	T84 G169 G170 S171 L176 S177	T84-G173 WeakPolarHBondContact O-CA 3.31Å; T84-G173 PolarHBondContact OG1-O 2.86Å; G169-G173 VanDerWaalsContact CA-C 3.45Å; G170-G173 WeakPolarHBondContact O-CA 3.47Å; G170-G173 PolarHBondContact O-N 3.39Å; S171-G173 PolarHBondContact O-N 2.88Å; G173-L176 PolarHBondContact O-N 3.14Å; G173-S177 PolarHBondContact O-N 3.44Å; G173-S177 PolarHBondContact O-OG 3.08Å
174	G	98.9	Very high	98.8	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-65	-41.1	172.8	0	0	0	0	0	111.7	G169 G170 S171 Y172 S177 V178 A193	G169-G174 VanDerWaalsContact C-CA 3.44Å; G169-G174 WeakPolarHBondContact O-CA 3.41Å; G169-G174 PolarHBondContact O-N 3.45Å; G170-G174 PolarHBondContact O-N 2.93Å; G170-G174 VanDerWaalsContact O-N 3.14Å; S171-G174 VanDerWaalsContact O-CA 3.29Å; S171-G174 WeakPolarHBondContact O-CA 3.42Å; S171-G174 PolarHBondContact O-N 3.09Å; Y172-G174 VanDerWaalsContact C-N 3.27Å; Y172-G174 PolarHBondContact O-N 3.41Å; G174-S177 WeakPolarHBondContact O-CB 3.5Å; G174-S177 PolarHBondContact O-N 2.87Å; G174-V178 WeakPolarHBondContact O-CG2 3.44Å; G174-V178 PolarHBondContact O-N 3.03Å; G174-A193 WeakPolarHBondContact O-CB 3.38Å
175	M	98.9	Very high	98.8	Very high	1 Å²	1	11.3 Å²	11.3	1%	0.005	6%	0.055	C	C	.	.	H	α-helix	trans	-58.8	-48.4	172.4	-58.1	165.2	48.5	0	0	110.9	S171 Y172 S177 V178 Y179 A196 P197 I198 T201 L404	S171-M175 PolarHBondContact O-N 3.42Å; Y172-M175 HydrophobicContact CD2-CB 4.24Å; Y172-M175 HydrophobicContact CD2-CE 3.95Å; Y172-M175 HydrophobicContact CD2-SD 4.04Å; Y172-M175 WeakPolarHBondContact O-CA 3.09Å; Y172-M175 WeakPolarHBondContact O-CB 3.23Å; Y172-M175 PolarHBondContact O-N 3.1Å; Y172-M175 VanDerWaalsContact O-N 3.13Å; M175-S177 VanDerWaalsContact C-N 3.27Å; M175-S177 PolarHBondContact O-N 2.88Å; M175-V178 WeakPolarHBondContact O-CB 3.48Å; M175-V178 PolarHBondContact O-N 3.03Å; M175-V178 VanDerWaalsContact O-N 3.12Å; M175-Y179 HydrophobicContact CB-CD2 4.49Å; M175-Y179 HydrophobicContact CB-CE2 3.85Å; M175-Y179 HydrophobicContact CE-CE2 4.18Å; M175-Y179 WeakPolarHBondContact CE-OH 3.5Å; M175-Y179 VanDerWaalsContact O-CD1 3.25Å; M175-Y179 WeakPolarHBondContact O-CD1 3.3Å; M175-Y179 VanDerWaalsContact O-CD2 3.31Å; M175-Y179 WeakPolarHBondContact O-CD2 3.39Å; M175-Y179 PolarHBondContact O-N 3.43Å; M175-A196 HydrophobicContact CG-CB 4.25Å; M175-P197 HydrophobicContact SD-CG 4.07Å; M175-I198 HydrophobicContact CB-CG2 4.03Å; M175-I198 HydrophobicContact CG-CG2 3.75Å; M175-T201 HydrophobicContact CE-CG2 3.86Å; M175-T201 WeakPolarHBondContact CE-OG1 3.29Å; M175-T201 HydrophobicContact SD-CG2 3.82Å; M175-L404 HydrophobicContact CE-CD2 4.08Å
176	L	98.9	Very high	98.6	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-58.2	-39.1	175.9	-69.1	167.8	0	0	0	112	T84 G85 N86 V140 L144 Y147 Y172 G173 Y179 M180	T84-L176 HydrophobicContact CG2-CB 4.5Å; G85-L176 VanDerWaalsContact O-CD1 3.24Å; G85-L176 WeakPolarHBondContact O-CD1 3.43Å; N86-L176 HydrophobicContact CB-CD1 4.49Å; V140-L176 HydrophobicContact CG1-CD2 3.89Å; L144-L176 HydrophobicContact CD2-CB 4.32Å; L144-L176 HydrophobicContact CD2-CD2 3.74Å; L144-L176 HydrophobicContact CG-CD2 4.21Å; Y147-L176 HydrophobicContact CE2-CD1 4.18Å; Y172-L176 HydrophobicContact CD1-CD1 4.15Å; Y172-L176 HydrophobicContact CD2-CD1 4.43Å; Y172-L176 HydrophobicContact CD2-CG 4.14Å; Y172-L176 HydrophobicContact CE1-CD1 3.72Å; Y172-L176 HydrophobicContact CE1-CG 4.32Å; Y172-L176 HydrophobicContact CE2-CD1 4.03Å; Y172-L176 HydrophobicContact CE2-CD2 3.82Å; Y172-L176 HydrophobicContact CE2-CG 3.69Å; Y172-L176 HydrophobicContact CG-CD1 4.47Å; Y172-L176 WeakPolarHBondContact O-CG 3.14Å; Y172-L176 PolarHBondContact O-N 3.3Å; G173-L176 PolarHBondContact O-N 3.14Å; L176-Y179 PolarHBondContact O-N 3.25Å; L176-M180 WeakPolarHBondContact O-CB 3.4Å; L176-M180 VanDerWaalsContact O-CG 3.31Å; L176-M180 WeakPolarHBondContact O-CG 3.36Å; L176-M180 PolarHBondContact O-N 2.97Å
177	S	98.9	Very high	98.5	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-64.1	-42	174.9	-82.2	0	0	0	0	113	T84 V167 F168 G169 G173 G174 M175 R181 A191	T84-S177 PolarHBondContact OG1-N 3.47Å; T84-S177 PolarHBondContact OG1-OG 3.48Å; V167-S177 WeakPolarHBondContact CG2-O 3.48Å; F168-S177 WeakPolarHBondContact CA-OG 3.49Å; F168-S177 PolarHBondContact N-OG 2.91Å; F168-S177 PolarHBondContact O-OG 2.89Å; F168-S177 VanDerWaalsContact O-OG 3.06Å; G169-S177 PolarHBondContact N-OG 2.93Å; G173-S177 PolarHBondContact O-N 3.44Å; G173-S177 PolarHBondContact O-OG 3.08Å; G174-S177 WeakPolarHBondContact O-CB 3.5Å; G174-S177 PolarHBondContact O-N 2.87Å; M175-S177 VanDerWaalsContact C-N 3.27Å; M175-S177 PolarHBondContact O-N 2.88Å; S177-R181 PolarHBondContact O-N 2.89Å; S177-A191 VanDerWaalsContact O-CB 3.3Å; S177-A191 WeakPolarHBondContact O-CB 3.27Å
178	V	98.9	Very high	98.4	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-56.1	-54.6	169.5	176.5	0	0	0	0	108.9	G174 M175 M180 R181 L182 A193 I198 I419 F421	G174-V178 WeakPolarHBondContact O-CG2 3.44Å; G174-V178 PolarHBondContact O-N 3.03Å; M175-V178 WeakPolarHBondContact O-CB 3.48Å; M175-V178 PolarHBondContact O-N 3.03Å; M175-V178 VanDerWaalsContact O-N 3.12Å; V178-M180 VanDerWaalsContact C-N 3.34Å; V178-M180 PolarHBondContact O-N 3.31Å; V178-R181 WeakPolarHBondContact O-CA 3.48Å; V178-R181 PolarHBondContact O-N 2.8Å; V178-L182 HydrophobicContact CG1-CD1 4.05Å; V178-L182 HydrophobicContact CG1-CD2 4.49Å; V178-L182 HydrophobicContact CG1-CG 4.12Å; V178-L182 WeakPolarHBondContact O-CG 3.47Å; V178-L182 PolarHBondContact O-N 3.26Å; V178-A193 HydrophobicContact CG2-CB 3.4Å; V178-I198 HydrophobicContact CB-CG2 4.43Å; V178-I198 HydrophobicContact CG1-CD1 4.39Å; V178-I198 HydrophobicContact CG2-CG2 4.16Å; V178-I419 HydrophobicContact CG1-CD1 4.09Å; V178-I419 HydrophobicContact CG2-CG2 4.13Å; V178-F421 HydrophobicContact CG1-CE1 4.34Å; V178-F421 HydrophobicContact CG2-CD1 4.24Å; V178-F421 HydrophobicContact CG2-CE1 3.56Å; V178-F421 HydrophobicContact CG2-CZ 4.37Å
179	Y	98.9	Very high	98.4	Very high	2 Å²	2	18.6 Å²	18.6	1%	0.008	9%	0.094	C	C	.	.	H	α-helix	trans	-65.1	-36.1	-172.1	-55.6	-17.6	0	0	0	112.7	V140 M175 L176 R181 L182 K183 I198 F408	V140-Y179 HydrophobicContact CG1-CD2 3.71Å; V140-Y179 HydrophobicContact CG1-CE2 4.11Å; M175-Y179 HydrophobicContact CB-CD2 4.49Å; M175-Y179 HydrophobicContact CB-CE2 3.85Å; M175-Y179 HydrophobicContact CE-CE2 4.18Å; M175-Y179 WeakPolarHBondContact CE-OH 3.5Å; M175-Y179 VanDerWaalsContact O-CD1 3.25Å; M175-Y179 WeakPolarHBondContact O-CD1 3.3Å; M175-Y179 VanDerWaalsContact O-CD2 3.31Å; M175-Y179 WeakPolarHBondContact O-CD2 3.39Å; M175-Y179 PolarHBondContact O-N 3.43Å; L176-Y179 PolarHBondContact O-N 3.25Å; Y179-R181 VanDerWaalsContact C-N 3.32Å; Y179-R181 PolarHBondContact O-N 3.4Å; Y179-L182 HydrophobicContact CD1-CD1 4.46Å; Y179-L182 PolarHBondContact O-N 2.95Å; Y179-K183 WeakPolarHBondContact O-CB 3.49Å; Y179-K183 WeakPolarHBondContact O-CG 3.49Å; Y179-K183 PolarHBondContact O-N 3.39Å; Y179-I198 HydrophobicContact CE1-CG2 4Å; Y179-F408 HydrophobicContact CD1-CB 3.49Å; Y179-F408 VanDerWaalsContact CD1-CB 3.49Å; Y179-F408 AromaticContact CD1-CD1 3.74Å; Y179-F408 HydrophobicContact CD1-CD1 3.74Å; Y179-F408 AromaticContact CD1-CG 3.69Å; Y179-F408 HydrophobicContact CD1-CG 3.69Å; Y179-F408 HydrophobicContact CD2-CB 4.41Å; Y179-F408 AromaticContact CD2-CD1 3.84Å; Y179-F408 HydrophobicContact CD2-CD1 3.84Å; Y179-F408 HydrophobicContact CD2-CD2 4.02Å; Y179-F408 HydrophobicContact CD2-CE1 4.07Å; Y179-F408 HydrophobicContact CD2-CE2 4.23Å; Y179-F408 AromaticContact CD2-CG 3.81Å; Y179-F408 HydrophobicContact CD2-CG 3.81Å; Y179-F408 HydrophobicContact CD2-CZ 4.25Å; Y179-F408 HydrophobicContact CE1-CB 3.37Å; Y179-F408 HydrophobicContact CE1-CD1 4.38Å; Y179-F408 AromaticContact CE1-CG 3.86Å; Y179-F408 HydrophobicContact CE1-CG 3.86Å; Y179-F408 HydrophobicContact CE2-CB 4.29Å; Y179-F408 HydrophobicContact CE2-CD1 4.45Å; Y179-F408 AromaticContact CE2-CD2 3.91Å; Y179-F408 HydrophobicContact CE2-CD2 3.91Å; Y179-F408 HydrophobicContact CE2-CE2 4.36Å; Y179-F408 AromaticContact CE2-CG 3.95Å; Y179-F408 HydrophobicContact CE2-CG 3.95Å; Y179-F408 HydrophobicContact CG-CB 4.04Å; Y179-F408 AromaticContact CG-CD1 3.43Å; Y179-F408 HydrophobicContact CG-CD1 3.43Å; Y179-F408 VanDerWaalsContact CG-CD1 3.43Å; Y179-F408 HydrophobicContact CG-CD2 4.35Å; Y179-F408 AromaticContact CG-CE1 3.93Å; Y179-F408 HydrophobicContact CG-CE1 3.93Å; Y179-F408 AromaticContact CG-CG 3.67Å; Y179-F408 HydrophobicContact CG-CG 3.67Å; Y179-F408 AromaticContact CZ-CG 3.97Å
180	M	98.9	Very high	98.4	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-57.8	-44.7	170.2	-80.3	-57.1	-72	0	0	111.2	T84 L144 Y147 A148 I151 V167 L176 V178 Y184 V188	T84-M180 HydrophobicContact CG2-CG 3.87Å; L144-M180 HydrophobicContact CB-SD 3.97Å; L144-M180 HydrophobicContact CD2-CB 4.47Å; L144-M180 HydrophobicContact CD2-CG 3.57Å; L144-M180 HydrophobicContact CD2-SD 3.6Å; L144-M180 VanDerWaalsContact CD2-SD 3.6Å; L144-M180 HydrophobicContact CG-SD 4.38Å; Y147-M180 HydrophobicContact CD2-SD 4.39Å; A148-M180 HydrophobicContact CB-CE 4.42Å; I151-M180 HydrophobicContact CD1-CE 3.94Å; V167-M180 HydrophobicContact CG1-CB 4.38Å; V167-M180 HydrophobicContact CG2-CB 4.21Å; L176-M180 WeakPolarHBondContact O-CB 3.4Å; L176-M180 VanDerWaalsContact O-CG 3.31Å; L176-M180 WeakPolarHBondContact O-CG 3.36Å; L176-M180 PolarHBondContact O-N 2.97Å; V178-M180 VanDerWaalsContact C-N 3.34Å; V178-M180 PolarHBondContact O-N 3.31Å; M180-Y184 HydrophobicContact CE-CD2 4.2Å; M180-Y184 CarbonylContact O-C 3.58Å; M180-Y184 WeakPolarHBondContact O-CA 3.37Å; M180-Y184 WeakPolarHBondContact O-CB 3.3Å; M180-Y184 PolarHBondContact O-N 3.36Å; M180-Y184 HydrophobicContact SD-CD2 3.88Å; M180-Y184 HydrophobicContact SD-CE2 4.35Å; M180-V188 HydrophobicContact CB-CG2 4.44Å; M180-V188 HydrophobicContact CE-CG2 3.98Å
181	R	98.7	Very high	98.4	Very high	24 Å²	24	18.6 Å²	18.6	9%	0.091	9%	0.094	C	C	.	.	H	α-helix	trans	-69.6	-33.2	177.8	-178	56.9	-168.9	157.5	4.6	112.4	S177 V178 Y179 P185 V188 A191 N417 I419	S177-R181 PolarHBondContact O-N 2.89Å; V178-R181 WeakPolarHBondContact O-CA 3.48Å; V178-R181 PolarHBondContact O-N 2.8Å; Y179-R181 VanDerWaalsContact C-N 3.32Å; Y179-R181 PolarHBondContact O-N 3.4Å; R181-P185 VanDerWaalsContact NH1-CB 3.3Å; R181-P185 PolarHBondContact NH1-O 2.88Å; R181-P185 WeakPolarHBondContact O-CB 3.13Å; R181-V188 WeakPolarHBondContact CD-O 3.42Å; R181-V188 PolarHBondContact NH1-O 3.08Å; R181-A191 HydrophobicContact CB-CB 3.98Å; R181-N417 WeakPolarHBondContact CG-O 3.4Å; R181-N417 PolarHBondContact NE-O 3.39Å; R181-N417 PolarHBondContact NH2-OD1 2.9Å; R181-I419 HydrophobicContact CB-CD1 4.15Å; R181-I419 HydrophobicContact CB-CG1 4.13Å; R181-I419 HydrophobicContact CG-CD1 4.04Å; R181-I419 HydrophobicContact CG-CG1 3.74Å
182	L	98.5	Very high	98.4	Very high	11 Å²	11	18 Å²	18	6%	0.058	9%	0.09	C	C	.	.	H	α-helix	trans	-69.8	-44.9	176.4	-57.6	-171.2	0	0	0	112.4	V178 Y179 W409 L413 A416 I419	V178-L182 HydrophobicContact CG1-CD1 4.05Å; V178-L182 HydrophobicContact CG1-CD2 4.49Å; V178-L182 HydrophobicContact CG1-CG 4.12Å; V178-L182 WeakPolarHBondContact O-CG 3.47Å; V178-L182 PolarHBondContact O-N 3.26Å; Y179-L182 HydrophobicContact CD1-CD1 4.46Å; Y179-L182 PolarHBondContact O-N 2.95Å; L182-W409 HydrophobicContact CB-CE3 4.48Å; L182-W409 HydrophobicContact CB-CH2 3.85Å; L182-W409 HydrophobicContact CB-CZ2 3.98Å; L182-W409 HydrophobicContact CB-CZ3 4.15Å; L182-W409 HydrophobicContact CD1-CD2 3.86Å; L182-W409 HydrophobicContact CD1-CE3 3.79Å; L182-W409 HydrophobicContact CD1-CG 4.29Å; L182-W409 HydrophobicContact CD1-CZ3 4.23Å; L182-W409 HydrophobicContact CD2-CE3 3.85Å; L182-W409 HydrophobicContact CD2-CH2 4.08Å; L182-W409 HydrophobicContact CD2-CZ3 3.55Å; L182-W409 HydrophobicContact CG-CE3 4.22Å; L182-W409 HydrophobicContact CG-CH2 4.36Å; L182-W409 HydrophobicContact CG-CZ3 4.15Å; L182-L413 HydrophobicContact CD1-CD2 4.08Å; L182-L413 HydrophobicContact CD2-CD2 4.39Å; L182-A416 HydrophobicContact CD2-CB 3.47Å; L182-A416 VanDerWaalsContact CD2-CB 3.47Å; L182-I419 HydrophobicContact CD2-CD1 3.84Å
183	K	98.5	Very high	98.4	Very high	75 Å²	75	18 Å²	18	33%	0.326	9%	0.089	S	C	.	.	H	α-helix	trans	-93.5	-30.7	-170.2	-64.2	-68.6	-177.1	166.1	0	114	Y179 P185 Q407 F408	Y179-K183 WeakPolarHBondContact O-CB 3.49Å; Y179-K183 WeakPolarHBondContact O-CG 3.49Å; Y179-K183 PolarHBondContact O-N 3.39Å; K183-P185 WeakPolarHBondContact O-CD 3.47Å; K183-Q407 WeakPolarHBondContact CE-O 3.5Å; K183-Q407 PolarHBondContact NZ-O 2.98Å; K183-F408 HydrophobicContact CG-CD1 4.39Å; K183-F408 HydrophobicContact CG-CE1 4.14Å
184	Y	98.6	Very high	98.4	Very high	54 Å²	54	18 Å²	18	21%	0.212	9%	0.089	C	C	.	.			trans	-123.2	48.8	-179.1	-56.2	-84.8	0	0	0	112.8	L144 A148 M180 N186 M187 V188	L144-Y184 HydrophobicContact CB-CE2 3.97Å; A148-Y184 HydrophobicContact CB-CD1 3.81Å; A148-Y184 HydrophobicContact CB-CD2 4.35Å; A148-Y184 HydrophobicContact CB-CE1 3.71Å; A148-Y184 HydrophobicContact CB-CE2 4.29Å; A148-Y184 HydrophobicContact CB-CG 4.12Å; M180-Y184 HydrophobicContact CE-CD2 4.2Å; M180-Y184 CarbonylContact O-C 3.58Å; M180-Y184 WeakPolarHBondContact O-CA 3.37Å; M180-Y184 WeakPolarHBondContact O-CB 3.3Å; M180-Y184 PolarHBondContact O-N 3.36Å; M180-Y184 HydrophobicContact SD-CD2 3.88Å; M180-Y184 HydrophobicContact SD-CE2 4.35Å; Y184-N186 WeakPolarHBondContact CA-OD1 3.44Å; Y184-N186 PolarHBondContact O-N 2.92Å; Y184-N186 VanDerWaalsContact O-N 3.11Å; Y184-M187 HydrophobicContact CD1-SD 4.11Å; Y184-M187 PolarHBondContact O-N 3.13Å; Y184-V188 PolarHBondContact O-N 3.03Å
185	P	97.6	Very high	98.4	Very high	57 Å²	57	18 Å²	18	37%	0.37	9%	0.089	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-14.3	-179.4	28.9	-35.8	0	0	0	113.5	R181 K183 M187	R181-P185 VanDerWaalsContact NH1-CB 3.3Å; R181-P185 PolarHBondContact NH1-O 2.88Å; R181-P185 WeakPolarHBondContact O-CB 3.13Å; K183-P185 WeakPolarHBondContact O-CD 3.47Å; P185-M187 VanDerWaalsContact C-N 3.29Å
186	N	95.5	Very high	98.4	Very high	110 Å²	110	18 Å²	18	59%	0.588	9%	0.09	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-17.1	171.4	62.7	-55.6	0	0	0	113.2	Y184	Y184-N186 WeakPolarHBondContact CA-OD1 3.44Å; Y184-N186 PolarHBondContact O-N 2.92Å; Y184-N186 VanDerWaalsContact O-N 3.11Å
187	M	96.3	Very high	98.4	Very high	40 Å²	40	18.1 Å²	18.1	20%	0.197	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-38	-176.3	-56.9	-174.3	64	0	0	112.7	A148 I151 R152 Y184 P185	A148-M187 HydrophobicContact CB-CE 4.36Å; A148-M187 HydrophobicContact CB-SD 4.01Å; A148-M187 WeakPolarHBondContact O-CE 3.36Å; I151-M187 HydrophobicContact CB-CE 4.26Å; I151-M187 HydrophobicContact CG2-CE 4.07Å; R152-M187 HydrophobicContact CB-CE 3.89Å; Y184-M187 HydrophobicContact CD1-SD 4.11Å; Y184-M187 PolarHBondContact O-N 3.13Å; P185-M187 VanDerWaalsContact C-N 3.29Å
188	V	98.2	Very high	98.4	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.006	9%	0.091	C	C	.	.			trans	-108.8	121.3	-175.3	172.5	0	0	0	0	108.9	I151 V165 V167 M180 R181 Y184 G190	I151-V188 HydrophobicContact CD1-CG2 4.35Å; V165-V188 CarbonylContact O-C 3.23Å; V167-V188 HydrophobicContact CB-CG1 4.16Å; V167-V188 HydrophobicContact CG1-CB 4.32Å; V167-V188 HydrophobicContact CG1-CG1 3.67Å; V167-V188 HydrophobicContact CG1-CG2 3.64Å; V167-V188 HydrophobicContact CG2-CG1 3.59Å; M180-V188 HydrophobicContact CB-CG2 4.44Å; M180-V188 HydrophobicContact CE-CG2 3.98Å; R181-V188 WeakPolarHBondContact CD-O 3.42Å; R181-V188 PolarHBondContact NH1-O 3.08Å; Y184-V188 PolarHBondContact O-N 3.03Å; V188-G190 VanDerWaalsContact CG1-O 3.29Å; V188-G190 WeakPolarHBondContact CG1-O 3.27Å
189	A	98.6	Very high	98.4	Very high	2 Å²	2	20.2 Å²	20.2	2%	0.017	10%	0.101	C	C	.	.	S	Bend	trans	-77.2	-25.4	-176	0	0	0	0	0	114.3	P164 V165 I166 N418 E485	P164-A189 HydrophobicContact CB-CB 4.42Å; V165-A189 WeakPolarHBondContact O-CB 3.21Å; V165-A189 PolarHBondContact O-N 3.42Å; I166-A189 HydrophobicContact CD1-CB 3.96Å; A189-N418 WeakPolarHBondContact O-CB 3.35Å; A189-N418 PolarHBondContact O-ND2 3.14Å; A189-E485 HydrophobicContact CB-CB 3.72Å; A189-E485 HydrophobicContact CB-CG 3.82Å
190	G	98.8	Very high	98.3	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175	168.8	178.8	0	0	0	0	0	111.9	I166 V167 V188 N418	I166-G190 WeakPolarHBondContact CA-O 3.27Å; V167-G190 PolarHBondContact N-O 3.16Å; V188-G190 VanDerWaalsContact CG1-O 3.29Å; V188-G190 WeakPolarHBondContact CG1-O 3.27Å; G190-N418 CarbonylContact C-O 3.1Å; G190-N418 WeakPolarHBondContact CA-O 3.11Å
191	A	98.9	Very high	98.2	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	136.8	-176.7	0	0	0	0	0	111.9	V167 S177 R181 N418 I419 I420	V167-A191 HydrophobicContact CG2-CB 3.54Å; V167-A191 CarbonylContact O-C 3.5Å; V167-A191 WeakPolarHBondContact O-CA 3.34Å; S177-A191 VanDerWaalsContact O-CB 3.3Å; S177-A191 WeakPolarHBondContact O-CB 3.27Å; R181-A191 HydrophobicContact CB-CB 3.98Å; A191-N418 PolarHBondContact N-O 3.25Å; A191-I419 HydrophobicContact CB-CG1 4.42Å; A191-I419 HydrophobicContact CB-CG2 4.33Å; A191-I419 WeakPolarHBondContact O-CA 3.5Å; A191-I420 PolarHBondContact O-N 2.83Å
192	L	98.9	Very high	98.2	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	106.9	160	175.7	57.1	0	0	0	108.2	F99 V167 F168 G169 I420 L456 E474 I478	F99-L192 HydrophobicContact CD1-CD2 4.3Å; F99-L192 HydrophobicContact CE1-CD2 3.88Å; V167-L192 PolarHBondContact O-N 3.02Å; F168-L192 HydrophobicContact CD1-CB 3.84Å; F168-L192 HydrophobicContact CD1-CD2 3.88Å; F168-L192 HydrophobicContact CD1-CG 4.34Å; F168-L192 HydrophobicContact CE1-CB 4.16Å; F168-L192 HydrophobicContact CE1-CD2 4.03Å; G169-L192 PolarHBondContact N-O 3.43Å; L192-I420 HydrophobicContact CD1-CB 3.73Å; L192-I420 HydrophobicContact CD1-CD1 4.43Å; L192-I420 HydrophobicContact CD1-CG2 3.48Å; L192-I420 VanDerWaalsContact CD1-CG2 3.48Å; L192-L456 HydrophobicContact CD2-CD2 3.86Å; L192-L456 HydrophobicContact CG-CD2 4.4Å; L192-E474 HydrophobicContact CD1-CG 4Å; L192-E474 HydrophobicContact CD2-CG 4.39Å; L192-I478 HydrophobicContact CB-CD1 4.49Å
193	A	98.9	Very high	98.1	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	93.9	179.2	0	0	0	0	0	109.4	G174 V178 A196 I419 I420 F421 S422	G174-A193 WeakPolarHBondContact O-CB 3.38Å; V178-A193 HydrophobicContact CG2-CB 3.4Å; A193-A196 HydrophobicContact CB-CB 4.04Å; A193-I419 HydrophobicContact CB-CG2 4.37Å; A193-I420 PolarHBondContact N-O 2.89Å; A193-F421 HydrophobicContact CB-CD1 4.37Å; A193-F421 WeakPolarHBondContact O-CA 3.22Å; A193-S422 PolarHBondContact O-N 3.12Å
194	A	98.9	Very high	98	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	124.6	-176.4	0	0	0	0	0	111.5	G169 G170 S171 A196 S422 H453 D455 L456	G169-A194 PolarHBondContact O-N 3.38Å; G170-A194 CarbonylContact C-O 3.57Å; G170-A194 VanDerWaalsContact CA-O 3.25Å; G170-A194 WeakPolarHBondContact CA-O 3.35Å; S171-A194 PolarHBondContact N-O 3.48Å; A194-A196 VanDerWaalsContact C-N 3.27Å; A194-A196 PolarHBondContact O-N 3.43Å; A194-S422 VanDerWaalsContact CA-OG 3.22Å; A194-S422 WeakPolarHBondContact CA-OG 3.31Å; A194-S422 WeakPolarHBondContact CB-OG 3.41Å; A194-H453 HydrophobicContact CB-CB 3.67Å; A194-D455 WeakPolarHBondContact CB-OD2 3.38Å; A194-L456 HydrophobicContact CB-CD1 3.7Å; A194-L456 HydrophobicContact CB-CD2 4.24Å; A194-L456 HydrophobicContact CB-CG 3.65Å
195	S	98.8	Very high	97.9	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	49	48.7	179.4	-55.6	0	0	0	0	112.4	S171 P197 S422 D427 H453	S171-S195 WeakPolarHBondContact CA-O 3.22Å; S195-P197 VanDerWaalsContact O-CD 3.29Å; S195-P197 WeakPolarHBondContact O-CD 3.45Å; S195-S422 WeakPolarHBondContact CA-O 3.44Å; S195-S422 PolarHBondContact N-O 2.77Å; S195-D427 WeakPolarHBondContact CB-OD2 3.28Å; S195-D427 PolarHBondContact OG-OD2 2.96Å; S195-H453 WeakPolarHBondContact OG-CA 3.16Å; S195-H453 PolarHBondContact OG-N 3.02Å
196	A	98.7	Very high	97.8	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.008	15%	0.15	C	C	.	.			trans	-94.6	107.5	-175.3	0	0	0	0	0	111	M175 A193 A194 I198 G433	M175-A196 HydrophobicContact CG-CB 4.25Å; A193-A196 HydrophobicContact CB-CB 4.04Å; A194-A196 VanDerWaalsContact C-N 3.27Å; A194-A196 PolarHBondContact O-N 3.43Å; A196-I198 HydrophobicContact CB-CG2 4.24Å; A196-I198 PolarHBondContact O-N 3.38Å; A196-G433 WeakPolarHBondContact O-CA 3.32Å
197	P	98.6	Very high	97.9	Very high	4 Å²	4	18.8 Å²	18.8	3%	0.026	14%	0.138	C	C	.	.			trans	-82.1	48.7	-174	35.2	-38	0	0	0	113.2	M175 S195 L199 S200 T201 W429 G432	M175-P197 HydrophobicContact SD-CG 4.07Å; S195-P197 VanDerWaalsContact O-CD 3.29Å; S195-P197 WeakPolarHBondContact O-CD 3.45Å; P197-L199 PolarHBondContact O-N 3.25Å; P197-S200 PolarHBondContact O-N 2.88Å; P197-S200 PolarHBondContact O-OG 3.43Å; P197-T201 HydrophobicContact CB-CG2 4.41Å; P197-T201 HydrophobicContact CG-CG2 3.95Å; P197-T201 WeakPolarHBondContact O-CG2 3.33Å; P197-T201 PolarHBondContact O-N 3.18Å; P197-T201 PolarHBondContact O-OG1 3.03Å; P197-W429 HydrophobicContact CB-CB 4.42Å; P197-W429 HydrophobicContact CB-CD2 4.49Å; P197-W429 HydrophobicContact CB-CE3 3.66Å; P197-W429 HydrophobicContact CB-CZ3 4.32Å; P197-W429 HydrophobicContact CG-CD2 4.33Å; P197-W429 HydrophobicContact CG-CE3 3.7Å; P197-W429 HydrophobicContact CG-CZ3 4.18Å; P197-G432 CarbonylContact C-O 3.45Å; P197-G432 WeakPolarHBondContact CA-O 3.48Å
198	I	98.4	Very high	98	Very high	3 Å²	3	22.1 Å²	22.1	2%	0.015	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-18.9	-171.3	60.1	161	0	0	0	114.7	M175 V178 Y179 A196 A202 L413 F421 V434	M175-I198 HydrophobicContact CB-CG2 4.03Å; M175-I198 HydrophobicContact CG-CG2 3.75Å; V178-I198 HydrophobicContact CB-CG2 4.43Å; V178-I198 HydrophobicContact CG1-CD1 4.39Å; V178-I198 HydrophobicContact CG2-CG2 4.16Å; Y179-I198 HydrophobicContact CE1-CG2 4Å; A196-I198 HydrophobicContact CB-CG2 4.24Å; A196-I198 PolarHBondContact O-N 3.38Å; I198-A202 WeakPolarHBondContact O-CB 3.32Å; I198-L413 HydrophobicContact CD1-CD1 3.74Å; I198-F421 HydrophobicContact CD1-CE1 3.76Å; I198-F421 HydrophobicContact CD1-CZ 4.37Å; I198-V434 HydrophobicContact CD1-CG2 3.83Å; I198-V434 HydrophobicContact CG1-CG2 4.18Å
199	L	98.4	Very high	98	Very high	40 Å²	40	22.6 Å²	22.6	21%	0.209	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-53.7	178.4	-52.1	-179.6	0	0	0	110.1	P197 T201 A202 L204 D411 G432 G433	P197-L199 PolarHBondContact O-N 3.25Å; L199-T201 VanDerWaalsContact C-N 3.34Å; L199-T201 PolarHBondContact O-N 3.39Å; L199-A202 CarbonylContact O-C 3.51Å; L199-A202 PolarHBondContact O-N 3.28Å; L199-A202 VanDerWaalsContact O-N 3.08Å; L199-L204 HydrophobicContact CB-CB 4.25Å; L199-L204 HydrophobicContact CD2-CD1 4.32Å; L199-L204 WeakPolarHBondContact O-CB 3.27Å; L199-L204 PolarHBondContact O-N 3.07Å; L199-D411 HydrophobicContact CD2-CB 3.99Å; L199-G432 WeakPolarHBondContact CA-O 3.43Å; L199-G432 VanDerWaalsContact CB-O 3.22Å; L199-G432 WeakPolarHBondContact CB-O 3.44Å; L199-G432 PolarHBondContact N-O 3.39Å; L199-G433 WeakPolarHBondContact CD1-O 3.45Å
200	S	97.7	Very high	98	Very high	13 Å²	13	22.5 Å²	22.5	9%	0.091	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-63.7	-40	-178.7	57.5	0	0	0	0	112.3	P197 A202 G203 L204 G432	P197-S200 PolarHBondContact O-N 2.88Å; P197-S200 PolarHBondContact O-OG 3.43Å; S200-A202 PolarHBondContact O-N 3.19Å; S200-A202 VanDerWaalsContact O-N 3.16Å; S200-G203 PolarHBondContact O-N 2.92Å; S200-L204 VanDerWaalsContact CA-O 3.27Å; S200-L204 WeakPolarHBondContact CA-O 3.41Å; S200-G432 PolarHBondContact N-O 3.46Å; S200-G432 VanDerWaalsContact N-O 3.08Å; S200-G432 WeakPolarHBondContact OG-CA 3.22Å
201	T	97.6	Very high	98	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.012	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-68.1	-14	177.2	58.1	0	0	0	0	114	M175 P197 L199 V364 E365 L366 L404	M175-T201 HydrophobicContact CE-CG2 3.86Å; M175-T201 WeakPolarHBondContact CE-OG1 3.29Å; M175-T201 HydrophobicContact SD-CG2 3.82Å; P197-T201 HydrophobicContact CB-CG2 4.41Å; P197-T201 HydrophobicContact CG-CG2 3.95Å; P197-T201 WeakPolarHBondContact O-CG2 3.33Å; P197-T201 PolarHBondContact O-N 3.18Å; P197-T201 PolarHBondContact O-OG1 3.03Å; L199-T201 VanDerWaalsContact C-N 3.34Å; L199-T201 PolarHBondContact O-N 3.39Å; T201-V364 HydrophobicContact CG2-CG1 3.93Å; T201-E365 WeakPolarHBondContact CA-O 3.02Å; T201-E365 WeakPolarHBondContact O-CB 3.21Å; T201-E365 PolarHBondContact O-N 3.46Å; T201-L366 HydrophobicContact CG2-CD2 4.01Å; T201-L404 VanDerWaalsContact O-CD2 3.23Å; T201-L404 WeakPolarHBondContact O-CD2 3.03Å
202	A	97.6	Very high	98	Very high	2 Å²	2	26.6 Å²	26.6	2%	0.017	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-99.4	15.8	174.6	0	0	0	0	0	112.4	I198 L199 S200 L204 Q405	I198-A202 WeakPolarHBondContact O-CB 3.32Å; L199-A202 CarbonylContact O-C 3.51Å; L199-A202 PolarHBondContact O-N 3.28Å; L199-A202 VanDerWaalsContact O-N 3.08Å; S200-A202 PolarHBondContact O-N 3.19Å; S200-A202 VanDerWaalsContact O-N 3.16Å; A202-L204 VanDerWaalsContact C-N 3.35Å; A202-Q405 HydrophobicContact CB-CB 4.14Å
203	G	96.3	Very high	98	Very high	49 Å²	49	27.6 Å²	27.6	51%	0.505	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.8	12.7	178.2	0	0	0	0	0	114.7	S200	S200-G203 PolarHBondContact O-N 2.92Å
204	L	97.1	Very high	98	Very high	45 Å²	45	27.6 Å²	27.6	24%	0.236	17%	0.171	C	C	.	.			trans	-98.3	145	-179.5	-54.6	176.1	0	0	0	111.9	L199 S200 A202 D411	L199-L204 HydrophobicContact CB-CB 4.25Å; L199-L204 HydrophobicContact CD2-CD1 4.32Å; L199-L204 WeakPolarHBondContact O-CB 3.27Å; L199-L204 PolarHBondContact O-N 3.07Å; S200-L204 VanDerWaalsContact CA-O 3.27Å; S200-L204 WeakPolarHBondContact CA-O 3.41Å; A202-L204 VanDerWaalsContact C-N 3.35Å; L204-D411 HydrophobicContact CD1-CB 4.09Å
205	G	95.3	Very high	98	Very high	82 Å²	82	27.9 Å²	27.9	85%	0.845	17%	0.172	S	C	*	.	S	Bend	trans	103.4	-154.8	174.2	0	0	0	0	0	113.7
206	D	96.6	Very high	98	Very high	70 Å²	70	29.4 Å²	29.4	37%	0.374	19%	0.185	S	C	.	.			trans	-108.6	120.9	-173.4	175.2	9.6	0	0	0	110.2	R208 Q209 R212	D206-R208 PolarHBondContact O-N 3.01Å; D206-R208 WeakPolarHBondContact OD1-CB 3.48Å; D206-R208 PolarHBondContact OD1-N 3.29Å; D206-Q209 HydrophobicContact CB-CB 4.25Å; D206-Q209 WeakPolarHBondContact O-CB 3.31Å; D206-Q209 PolarHBondContact O-N 3.19Å; D206-R212 IonicContact OD2-CZ 3.62Å; D206-R212 IonicContact OD2-NH1 2.79Å; D206-R212 PolarHBondContact OD2-NH1 2.89Å; D206-R212 IonicContact OD2-NH2 3.55Å
207	A	96.8	Very high	98	Very high	41 Å²	41	29.9 Å²	29.9	34%	0.339	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-18.2	177.3	0	0	0	0	0	113.8	C367 F368 E369	A207-C367 WeakPolarHBondContact CB-O 3.25Å; A207-F368 CarbonylContact O-C 3.57Å; A207-F368 VanDerWaalsContact O-CA 3.27Å; A207-F368 WeakPolarHBondContact O-CA 3.49Å; A207-F368 WeakPolarHBondContact O-CD1 3.39Å; A207-E369 HydrophobicContact CB-CG 4.35Å; A207-E369 PolarHBondContact O-N 3.05Å
208	R	98.1	Very high	98	Very high	109 Å²	109	29.7 Å²	29.7	41%	0.411	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-9.4	179.3	-59.9	164.1	-176.3	171.1	5	113.2	D206 F210 R212 E369 N371	D206-R208 PolarHBondContact O-N 3.01Å; D206-R208 WeakPolarHBondContact OD1-CB 3.48Å; D206-R208 PolarHBondContact OD1-N 3.29Å; R208-F210 PolarHBondContact O-N 2.95Å; R208-R212 WeakPolarHBondContact O-CB 3.22Å; R208-R212 PolarHBondContact O-N 3.48Å; R208-R212 VanDerWaalsContact O-N 3.16Å; R208-E369 HydrophobicContact CG-CG 3.8Å; R208-E369 VanDerWaalsContact CG-OE1 3.29Å; R208-E369 WeakPolarHBondContact CG-OE1 3.46Å; R208-E369 IonicContact CZ-OE1 3.59Å; R208-E369 IonicContact NE-OE1 2.78Å; R208-E369 PolarHBondContact NE-OE1 3.46Å; R208-E369 IonicContact NH2-OE1 3.76Å; R208-E369 PolarHBondContact NH2-OE1 3.44Å; R208-N371 WeakPolarHBondContact CD-ND2 3.29Å
209	Q	98.4	Very high	98	Very high	11 Å²	11	32.7 Å²	32.7	5%	0.051	20%	0.2	C	C	.	.	H	α-helix	trans	-59.7	-49.7	-171.2	171.8	-85.6	-48.9	0	0	111.6	D206 F211 R212 D213 P428 N431	D206-Q209 HydrophobicContact CB-CB 4.25Å; D206-Q209 WeakPolarHBondContact O-CB 3.31Å; D206-Q209 PolarHBondContact O-N 3.19Å; Q209-F211 PolarHBondContact O-N 2.85Å; Q209-R212 PolarHBondContact O-N 3.43Å; Q209-D213 PolarHBondContact NE2-OD2 3.31Å; Q209-D213 WeakPolarHBondContact O-CB 3.43Å; Q209-D213 PolarHBondContact O-N 2.96Å; Q209-P428 PolarHBondContact NE2-O 2.65Å; Q209-N431 HydrophobicContact CG-CB 3.8Å
210	F	98.8	Very high	98	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-56.7	-55.9	-173	-172	-93.9	0	0	0	113	R208 R212 D213 V214 T276 M280 T345 F368 P428 W429	R208-F210 PolarHBondContact O-N 2.95Å; F210-R212 PolarHBondContact O-N 2.96Å; F210-D213 PolarHBondContact O-N 3.18Å; F210-D213 VanDerWaalsContact O-N 3.16Å; F210-V214 HydrophobicContact CD1-CG2 4.25Å; F210-V214 HydrophobicContact CE1-CG2 3.92Å; F210-V214 HydrophobicContact CZ-CG2 4.4Å; F210-V214 WeakPolarHBondContact O-CG2 3.5Å; F210-V214 PolarHBondContact O-N 3.19Å; F210-T276 HydrophobicContact CE1-CG2 3.69Å; F210-T276 HydrophobicContact CZ-CG2 3.7Å; F210-M280 HydrophobicContact CZ-SD 4.46Å; F210-T345 HydrophobicContact CD1-CG2 3.72Å; F210-T345 HydrophobicContact CD2-CG2 4.42Å; F210-T345 HydrophobicContact CE1-CG2 3.44Å; F210-T345 VanDerWaalsContact CE1-CG2 3.44Å; F210-T345 HydrophobicContact CE2-CG2 4.2Å; F210-T345 HydrophobicContact CG-CG2 4.2Å; F210-T345 HydrophobicContact CZ-CG2 3.7Å; F210-F368 HydrophobicContact CB-CB 4.35Å; F210-F368 HydrophobicContact CB-CD1 3.63Å; F210-F368 HydrophobicContact CB-CD2 4.08Å; F210-F368 HydrophobicContact CB-CE1 3.81Å; F210-F368 HydrophobicContact CB-CE2 4.24Å; F210-F368 HydrophobicContact CB-CG 3.77Å; F210-F368 HydrophobicContact CB-CZ 4.1Å; F210-F368 HydrophobicContact CD2-CE2 4.49Å; F210-F368 HydrophobicContact CG-CD2 4.37Å; F210-F368 HydrophobicContact CG-CE2 4.47Å; F210-F368 HydrophobicContact CG-CG 4.48Å; F210-P428 HydrophobicContact CD2-CB 3.92Å; F210-P428 HydrophobicContact CD2-CG 4.48Å; F210-P428 WeakPolarHBondContact CD2-O 3.38Å; F210-P428 HydrophobicContact CE1-CB 4.43Å; F210-P428 HydrophobicContact CE2-CB 3.59Å; F210-P428 HydrophobicContact CE2-CG 3.66Å; F210-P428 HydrophobicContact CG-CB 4.45Å; F210-P428 HydrophobicContact CZ-CB 3.9Å; F210-P428 HydrophobicContact CZ-CG 3.7Å; F210-W429 AromaticContact CD2-CD2 3.97Å; F210-W429 HydrophobicContact CD2-CD2 3.97Å; F210-W429 HydrophobicContact CD2-CE3 4.09Å; F210-W429 HydrophobicContact CD2-CG 4.45Å; F210-W429 HydrophobicContact CD2-CZ2 4.4Å; F210-W429 HydrophobicContact CD2-CZ3 4.4Å; F210-W429 AromaticContact CE2-CD1 3.73Å; F210-W429 AromaticContact CE2-CD2 3.46Å; F210-W429 HydrophobicContact CE2-CD2 3.46Å; F210-W429 VanDerWaalsContact CE2-CD2 3.46Å; F210-W429 AromaticContact CE2-CE2 3.29Å; F210-W429 HydrophobicContact CE2-CE3 4.03Å; F210-W429 AromaticContact CE2-CG 3.77Å; F210-W429 HydrophobicContact CE2-CG 3.77Å; F210-W429 HydrophobicContact CE2-CH2 4.31Å; F210-W429 AromaticContact CE2-CZ2 3.76Å; F210-W429 HydrophobicContact CE2-CZ2 3.76Å; F210-W429 HydrophobicContact CE2-CZ3 4.45Å; F210-W429 AromaticContact CE2-NE1 3.45Å; F210-W429 HydrophobicContact CZ-CD2 4.45Å; F210-W429 AromaticContact CZ-CE2 3.87Å; F210-W429 HydrophobicContact CZ-CZ2 4.1Å; F210-W429 AromaticContact CZ-NE1 3.81Å
211	F	98.9	Very high	98	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-75	-24	-177.5	-67.4	-63.8	0	0	0	113.7	Q209 D213 T215 R272 P344 F368 E369 D375 F377	Q209-F211 PolarHBondContact O-N 2.85Å; F211-D213 VanDerWaalsContact C-N 3.33Å; F211-T215 WeakPolarHBondContact O-CB 3.29Å; F211-T215 PolarHBondContact O-N 2.87Å; F211-T215 PolarHBondContact O-OG1 3.07Å; F211-R272 HydrophobicContact CD1-CG 3.97Å; F211-R272 VanDerWaalsContact CE1-CD 3.43Å; F211-R272 HydrophobicContact CE1-CG 3.67Å; F211-R272 HydrophobicContact CZ-CG 4.42Å; F211-R272 VanDerWaalsContact CZ-NE 3.31Å; F211-P344 HydrophobicContact CE2-CB 4.3Å; F211-P344 HydrophobicContact CZ-CB 4.45Å; F211-F368 HydrophobicContact CD2-CB 4.36Å; F211-F368 HydrophobicContact CE2-CB 4.02Å; F211-E369 WeakPolarHBondContact CD2-O 3.42Å; F211-D375 HydrophobicContact CB-CB 4.19Å; F211-D375 WeakPolarHBondContact O-CB 3.29Å; F211-F377 HydrophobicContact CB-CD2 4.08Å; F211-F377 HydrophobicContact CB-CE2 4.32Å; F211-F377 HydrophobicContact CD1-CD2 4.11Å; F211-F377 HydrophobicContact CD1-CE2 4.06Å; F211-F377 HydrophobicContact CG-CD2 4.41Å
212	R	98.9	Very high	98	Very high	86 Å²	86	40.4 Å²	40.4	33%	0.325	24%	0.241	S	C	.	.	H	α-helix	trans	-63.5	-42.5	167.2	175.4	178.7	65.1	-136.7	0.1	110.6	D206 R208 Q209 F210 T215 A216 T374	D206-R212 IonicContact OD2-CZ 3.62Å; D206-R212 IonicContact OD2-NH1 2.79Å; D206-R212 PolarHBondContact OD2-NH1 2.89Å; D206-R212 IonicContact OD2-NH2 3.55Å; R208-R212 WeakPolarHBondContact O-CB 3.22Å; R208-R212 PolarHBondContact O-N 3.48Å; R208-R212 VanDerWaalsContact O-N 3.16Å; Q209-R212 PolarHBondContact O-N 3.43Å; F210-R212 PolarHBondContact O-N 2.96Å; R212-T215 WeakPolarHBondContact O-CA 3.4Å; R212-T215 VanDerWaalsContact O-CB 3.31Å; R212-T215 WeakPolarHBondContact O-CB 3.39Å; R212-T215 PolarHBondContact O-N 3.11Å; R212-T215 VanDerWaalsContact O-N 3.15Å; R212-A216 PolarHBondContact O-N 2.96Å; R212-T374 WeakPolarHBondContact CG-O 3.34Å
213	D	98.9	Very high	98.1	Very high	22 Å²	22	43.1 Å²	43.1	12%	0.118	26%	0.259	C	S	.	.	H	α-helix	trans	-74	-38.7	-177.2	-66.9	6.9	0	0	0	110.7	Q209 F210 F211 T215 A216 D217 P428 N431	Q209-D213 PolarHBondContact NE2-OD2 3.31Å; Q209-D213 WeakPolarHBondContact O-CB 3.43Å; Q209-D213 PolarHBondContact O-N 2.96Å; F210-D213 PolarHBondContact O-N 3.18Å; F210-D213 VanDerWaalsContact O-N 3.16Å; F211-D213 VanDerWaalsContact C-N 3.33Å; D213-T215 PolarHBondContact O-N 3.33Å; D213-A216 WeakPolarHBondContact O-CB 3.26Å; D213-A216 PolarHBondContact O-N 3.19Å; D213-D217 PolarHBondContact O-N 3.29Å; D213-D217 VanDerWaalsContact O-N 3.11Å; D213-P428 HydrophobicContact CB-CB 4.37Å; D213-N431 PolarHBondContact OD2-ND2 2.81Å
214	V	98.9	Very high	98.2	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-54.5	-43	165.8	176.5	0	0	0	0	110.7	F210 A216 D217 F218 F275 A279 F377 P428	F210-V214 HydrophobicContact CD1-CG2 4.25Å; F210-V214 HydrophobicContact CE1-CG2 3.92Å; F210-V214 HydrophobicContact CZ-CG2 4.4Å; F210-V214 WeakPolarHBondContact O-CG2 3.5Å; F210-V214 PolarHBondContact O-N 3.19Å; V214-A216 VanDerWaalsContact C-N 3.32Å; V214-A216 PolarHBondContact O-N 3.1Å; V214-D217 PolarHBondContact O-N 3.11Å; V214-F218 HydrophobicContact CG1-CD2 4.46Å; V214-F218 HydrophobicContact CG1-CE2 4.25Å; V214-F218 VanDerWaalsContact O-CD2 3.26Å; V214-F218 WeakPolarHBondContact O-CD2 3.48Å; V214-F275 HydrophobicContact CG1-CB 4.03Å; V214-A279 HydrophobicContact CG1-CB 4.22Å; V214-A279 HydrophobicContact CG2-CB 4.36Å; V214-F377 HydrophobicContact CB-CE2 4.19Å; V214-F377 HydrophobicContact CB-CZ 4.5Å; V214-F377 HydrophobicContact CG1-CE2 3.85Å; V214-F377 HydrophobicContact CG1-CZ 3.66Å; V214-P428 HydrophobicContact CG2-CB 3.53Å; V214-P428 HydrophobicContact CG2-CG 3.85Å
215	T	98.9	Very high	98.2	Very high	6 Å²	6	44 Å²	44	4%	0.037	25%	0.248	C	C	.	.	H	α-helix	trans	-63.7	-39.1	177.8	-59.1	0	0	0	0	111.9	F211 R212 D213 D217 F218 E219 R226 D375 M376	F211-T215 WeakPolarHBondContact O-CB 3.29Å; F211-T215 PolarHBondContact O-N 2.87Å; F211-T215 PolarHBondContact O-OG1 3.07Å; R212-T215 WeakPolarHBondContact O-CA 3.4Å; R212-T215 VanDerWaalsContact O-CB 3.31Å; R212-T215 WeakPolarHBondContact O-CB 3.39Å; R212-T215 PolarHBondContact O-N 3.11Å; R212-T215 VanDerWaalsContact O-N 3.15Å; D213-T215 PolarHBondContact O-N 3.33Å; T215-D217 VanDerWaalsContact C-N 3.34Å; T215-D217 PolarHBondContact O-N 3.16Å; T215-F218 PolarHBondContact O-N 3.34Å; T215-E219 WeakPolarHBondContact O-CB 3.47Å; T215-E219 PolarHBondContact O-N 3.3Å; T215-R226 HydrophobicContact CG2-CG 3.77Å; T215-D375 VanDerWaalsContact OG1-CA 3.26Å; T215-D375 WeakPolarHBondContact OG1-CA 3.43Å; T215-D375 VanDerWaalsContact OG1-CB 3.31Å; T215-D375 WeakPolarHBondContact OG1-CB 3.19Å; T215-M376 HydrophobicContact CG2-CB 3.78Å; T215-M376 HydrophobicContact CG2-CG 3.9Å; T215-M376 HydrophobicContact CG2-SD 4.18Å; T215-M376 PolarHBondContact OG1-N 2.89Å
216	A	98.9	Very high	98.4	Very high	32 Å²	32	42.1 Å²	42.1	26%	0.264	22%	0.216	S	C	.	.	H	α-helix	trans	-63.2	-38.3	179.8	0	0	0	0	0	111.9	R212 D213 V214 F218 E219 N220	R212-A216 PolarHBondContact O-N 2.96Å; D213-A216 WeakPolarHBondContact O-CB 3.26Å; D213-A216 PolarHBondContact O-N 3.19Å; V214-A216 VanDerWaalsContact C-N 3.32Å; V214-A216 PolarHBondContact O-N 3.1Å; A216-F218 VanDerWaalsContact C-N 3.34Å; A216-F218 PolarHBondContact O-N 2.74Å; A216-E219 PolarHBondContact O-N 3.18Å; A216-N220 VanDerWaalsContact O-CB 3.27Å; A216-N220 WeakPolarHBondContact O-CB 3.5Å; A216-N220 PolarHBondContact O-N 2.86Å; A216-N220 PolarHBondContact O-ND2 3.22Å; A216-N220 VanDerWaalsContact O-ND2 3.09Å
217	D	98.9	Very high	98.5	Very high	10 Å²	10	43 Å²	43	5%	0.053	22%	0.22	C	C	.	.	H	α-helix	trans	-59.6	-45.3	177.8	-64.9	-31.5	0	0	0	111.9	D213 V214 T215 N220 I221 V298	D213-D217 PolarHBondContact O-N 3.29Å; D213-D217 VanDerWaalsContact O-N 3.11Å; V214-D217 PolarHBondContact O-N 3.11Å; T215-D217 VanDerWaalsContact C-N 3.34Å; T215-D217 PolarHBondContact O-N 3.16Å; D217-N220 PolarHBondContact O-N 3.32Å; D217-I221 PolarHBondContact O-N 2.73Å; D217-V298 HydrophobicContact CB-CG1 4.48Å
218	F	98.8	Very high	98.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-72.4	-38.2	178.6	-73.4	-103.8	0	0	0	112	V214 T215 A216 N220 I221 S222 F275 M278 A279 V298 A301 M376	V214-F218 HydrophobicContact CG1-CD2 4.46Å; V214-F218 HydrophobicContact CG1-CE2 4.25Å; V214-F218 VanDerWaalsContact O-CD2 3.26Å; V214-F218 WeakPolarHBondContact O-CD2 3.48Å; T215-F218 PolarHBondContact O-N 3.34Å; A216-F218 VanDerWaalsContact C-N 3.34Å; A216-F218 PolarHBondContact O-N 2.74Å; F218-N220 VanDerWaalsContact C-N 3.32Å; F218-N220 PolarHBondContact O-N 2.82Å; F218-I221 PolarHBondContact O-N 3.11Å; F218-S222 PolarHBondContact O-N 3.36Å; F218-F275 AromaticContact CD1-CD1 3.8Å; F218-F275 HydrophobicContact CD1-CD1 3.8Å; F218-F275 HydrophobicContact CD1-CE1 4.02Å; F218-F275 HydrophobicContact CD2-CD1 4.29Å; F218-F275 AromaticContact CE1-CD1 3.32Å; F218-F275 HydrophobicContact CE1-CD1 3.32Å; F218-F275 AromaticContact CE1-CE1 3.69Å; F218-F275 HydrophobicContact CE1-CE1 3.69Å; F218-F275 HydrophobicContact CE1-CG 4.44Å; F218-F275 HydrophobicContact CE2-CB 4.1Å; F218-F275 AromaticContact CE2-CD1 3.86Å; F218-F275 HydrophobicContact CE2-CD1 3.86Å; F218-F275 HydrophobicContact CE2-CG 4.48Å; F218-F275 HydrophobicContact CG-CD1 4.27Å; F218-F275 HydrophobicContact CZ-CB 4.08Å; F218-F275 AromaticContact CZ-CD1 3.37Å; F218-F275 HydrophobicContact CZ-CD1 3.37Å; F218-F275 HydrophobicContact CZ-CE1 4.21Å; F218-F275 HydrophobicContact CZ-CG 4.13Å; F218-M278 HydrophobicContact CE1-CE 4.36Å; F218-M278 HydrophobicContact CZ-CB 4.16Å; F218-M278 HydrophobicContact CZ-CE 4.09Å; F218-A279 HydrophobicContact CE2-CB 4.34Å; F218-V298 HydrophobicContact CB-CG1 4.42Å; F218-V298 HydrophobicContact CD1-CG1 3.86Å; F218-V298 HydrophobicContact CD2-CG1 3.83Å; F218-V298 HydrophobicContact CE1-CG1 3.97Å; F218-V298 HydrophobicContact CE2-CG1 3.97Å; F218-V298 HydrophobicContact CE2-CG2 4.01Å; F218-V298 HydrophobicContact CG-CG1 3.78Å; F218-V298 HydrophobicContact CZ-CB 4.39Å; F218-V298 HydrophobicContact CZ-CG1 4.02Å; F218-V298 HydrophobicContact CZ-CG2 4.06Å; F218-A301 HydrophobicContact CE1-CB 3.62Å; F218-A301 HydrophobicContact CZ-CB 4.4Å; F218-M376 HydrophobicContact CB-CE 3.93Å; F218-M376 HydrophobicContact CB-SD 4.27Å; F218-M376 HydrophobicContact CD1-CE 4.31Å; F218-M376 HydrophobicContact CD2-CE 3.8Å; F218-M376 HydrophobicContact CE2-CE 4.42Å; F218-M376 HydrophobicContact CG-CE 3.74Å
219	E	98.6	Very high	98.6	Very high	66 Å²	66	36.4 Å²	36.4	31%	0.308	19%	0.189	S	C	.	.	H	α-helix	trans	-63.2	-37.6	174.3	174.7	167.3	-156.2	0	0	112.4	T215 A216 I221 S222 R226	T215-E219 WeakPolarHBondContact O-CB 3.47Å; T215-E219 PolarHBondContact O-N 3.3Å; A216-E219 PolarHBondContact O-N 3.18Å; E219-I221 PolarHBondContact O-N 2.84Å; E219-S222 CarbonylContact O-C 3.36Å; E219-S222 PolarHBondContact O-N 2.82Å; E219-S222 VanDerWaalsContact O-N 3.14Å; E219-R226 HydrophobicContact CB-CB 4.11Å; E219-R226 HydrophobicContact CB-CG 4.35Å; E219-R226 VanDerWaalsContact CD-CZ 3.45Å; E219-R226 IonicContact OE1-CZ 3.14Å; E219-R226 IonicContact OE1-NH1 2.71Å; E219-R226 PolarHBondContact OE1-NH1 3.28Å; E219-R226 IonicContact OE1-NH2 2.83Å; E219-R226 PolarHBondContact OE1-NH2 3.4Å; E219-R226 IonicContact OE2-CZ 3.71Å; E219-R226 IonicContact OE2-NH1 2.82Å; E219-R226 PolarHBondContact OE2-NH1 3.5Å
220	N	98.3	Very high	98.6	Very high	122 Å²	122	39.3 Å²	39.3	65%	0.652	20%	0.2	S	C	*	.	H	α-helix	trans	-66.8	-25.5	179	-74.6	-27.8	0	0	0	112.7	A216 D217 F218	A216-N220 VanDerWaalsContact O-CB 3.27Å; A216-N220 WeakPolarHBondContact O-CB 3.5Å; A216-N220 PolarHBondContact O-N 2.86Å; A216-N220 PolarHBondContact O-ND2 3.22Å; A216-N220 VanDerWaalsContact O-ND2 3.09Å; D217-N220 PolarHBondContact O-N 3.32Å; F218-N220 VanDerWaalsContact C-N 3.32Å; F218-N220 PolarHBondContact O-N 2.82Å
221	I	98.2	Very high	98.6	Very high	77 Å²	77	40.4 Å²	40.4	40%	0.395	21%	0.211	S	C	.	.	H	α-helix	trans	-71.9	-49.8	168.2	-60.7	-55.6	0	0	0	110.5	D217 F218 E219 V298 K299 C302	D217-I221 PolarHBondContact O-N 2.73Å; F218-I221 PolarHBondContact O-N 3.11Å; E219-I221 PolarHBondContact O-N 2.84Å; I221-V298 HydrophobicContact CG1-CG1 3.79Å; I221-K299 HydrophobicContact CD1-CB 4.35Å; I221-C302 HydrophobicContact CB-CB 4.35Å; I221-C302 HydrophobicContact CG2-CB 3.74Å
222	S	97.4	Very high	98.6	Very high	19 Å²	19	40.4 Å²	40.4	13%	0.133	21%	0.211	C	C	.	.			trans	-165.5	128.5	176.6	153.6	0	0	0	0	110.4	F218 E219 E224 C225	F218-S222 PolarHBondContact O-N 3.36Å; E219-S222 CarbonylContact O-C 3.36Å; E219-S222 PolarHBondContact O-N 2.82Å; E219-S222 VanDerWaalsContact O-N 3.14Å; S222-E224 PolarHBondContact O-N 2.9Å; S222-E224 WeakPolarHBondContact OG-CB 3.31Å; S222-E224 PolarHBondContact OG-N 2.99Å; S222-E224 PolarHBondContact OG-OE2 3.1Å; S222-C225 VanDerWaalsContact O-CB 3.23Å; S222-C225 WeakPolarHBondContact O-CB 3.43Å; S222-C225 PolarHBondContact O-N 3.31Å; S222-C225 PolarHBondContact OG-N 3Å
223	P	98.4	Very high	98.6	Very high	59 Å²	59	36.7 Å²	36.7	38%	0.383	20%	0.197	S	C	.	.	H	α-helix	trans	-54.4	-34.6	172.2	-29.9	38.1	0	0	0	113.4	C225 R226 D227	P223-C225 VanDerWaalsContact C-N 3.3Å; P223-C225 PolarHBondContact O-N 2.92Å; P223-R226 PolarHBondContact O-N 3.02Å; P223-D227 PolarHBondContact O-N 3.15Å
224	E	98.5	Very high	98.6	Very high	113 Å²	113	40.5 Å²	40.5	53%	0.528	21%	0.214	S	C	.	.	H	α-helix	trans	-65.7	-31.6	177.7	-59	76.3	-170.1	0	0	112.2	S222 D227 A228 L306	S222-E224 PolarHBondContact O-N 2.9Å; S222-E224 WeakPolarHBondContact OG-CB 3.31Å; S222-E224 PolarHBondContact OG-N 2.99Å; S222-E224 PolarHBondContact OG-OE2 3.1Å; E224-D227 PolarHBondContact O-N 3.13Å; E224-A228 VanDerWaalsContact O-CB 3.31Å; E224-A228 WeakPolarHBondContact O-CB 3.45Å; E224-A228 PolarHBondContact O-N 3.33Å; E224-L306 HydrophobicContact CB-CD2 4.05Å
225	C	98.6	Very high	98.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.5	-49	173.8	176.3	0	0	0	0	110.9	S222 P223 D227 A228 V229 C302 L306	S222-C225 VanDerWaalsContact O-CB 3.23Å; S222-C225 WeakPolarHBondContact O-CB 3.43Å; S222-C225 PolarHBondContact O-N 3.31Å; S222-C225 PolarHBondContact OG-N 3Å; P223-C225 VanDerWaalsContact C-N 3.3Å; P223-C225 PolarHBondContact O-N 2.92Å; C225-D227 VanDerWaalsContact C-N 3.3Å; C225-D227 PolarHBondContact O-N 2.83Å; C225-A228 PolarHBondContact O-N 2.95Å; C225-V229 WeakPolarHBondContact O-CG2 3.35Å; C225-V229 PolarHBondContact O-N 3.25Å; C225-C302 HydrophobicContact CB-CB 3.63Å; C225-C302 WeakPolarHBondContact CB-SG 3.45Å; C225-C302 WeakPolarHBondContact SG-CA 3.36Å; C225-C302 WeakPolarHBondContact SG-CB 3.13Å; C225-C302 CovalentContact SG-SG 2.05Å; C225-C302 PolarHBondContact SG-SG 3Å; C225-L306 HydrophobicContact CB-CD1 4.29Å
226	R	98.4	Very high	98.6	Very high	41 Å²	41	43.3 Å²	43.3	16%	0.155	23%	0.229	C	C	.	.	H	α-helix	trans	-58.5	-41.9	175	174.3	-84.3	-48.4	-80	-12.4	111.4	T215 E219 P223 V229 R230 M376	T215-R226 HydrophobicContact CG2-CG 3.77Å; E219-R226 HydrophobicContact CB-CB 4.11Å; E219-R226 HydrophobicContact CB-CG 4.35Å; E219-R226 VanDerWaalsContact CD-CZ 3.45Å; E219-R226 IonicContact OE1-CZ 3.14Å; E219-R226 IonicContact OE1-NH1 2.71Å; E219-R226 PolarHBondContact OE1-NH1 3.28Å; E219-R226 IonicContact OE1-NH2 2.83Å; E219-R226 PolarHBondContact OE1-NH2 3.4Å; E219-R226 IonicContact OE2-CZ 3.71Å; E219-R226 IonicContact OE2-NH1 2.82Å; E219-R226 PolarHBondContact OE2-NH1 3.5Å; P223-R226 PolarHBondContact O-N 3.02Å; R226-V229 PolarHBondContact O-N 2.9Å; R226-R230 WeakPolarHBondContact O-CG 3.38Å; R226-R230 PolarHBondContact O-N 2.86Å; R226-R230 VanDerWaalsContact O-N 3.1Å; R226-M376 HydrophobicContact CB-SD 4.46Å; R226-M376 HydrophobicContact CG-CB 4.15Å; R226-M376 HydrophobicContact CG-SD 4.36Å
227	D	98.6	Very high	98.6	Very high	88 Å²	88	46.2 Å²	46.2	47%	0.471	24%	0.235	S	C	.	.	H	α-helix	trans	-67.7	-39.2	177.8	-65.9	-14.4	0	0	0	112.4	P223 E224 C225 R230 G231	P223-D227 PolarHBondContact O-N 3.15Å; E224-D227 PolarHBondContact O-N 3.13Å; C225-D227 VanDerWaalsContact C-N 3.3Å; C225-D227 PolarHBondContact O-N 2.83Å; D227-R230 PolarHBondContact O-N 2.79Å; D227-G231 PolarHBondContact O-N 3.17Å
228	A	98.8	Very high	98.5	Very high	12 Å²	12	49 Å²	49	10%	0.099	25%	0.248	C	C	.	.	H	α-helix	trans	-62.9	-41.1	175.2	0	0	0	0	0	111.9	E224 C225 G231 A232 M305 L306 L311	E224-A228 VanDerWaalsContact O-CB 3.31Å; E224-A228 WeakPolarHBondContact O-CB 3.45Å; E224-A228 PolarHBondContact O-N 3.33Å; C225-A228 PolarHBondContact O-N 2.95Å; A228-G231 PolarHBondContact O-N 2.81Å; A228-A232 WeakPolarHBondContact O-CB 3.23Å; A228-A232 PolarHBondContact O-N 3.38Å; A228-M305 HydrophobicContact CB-CB 4.4Å; A228-M305 HydrophobicContact CB-CE 4.03Å; A228-L306 HydrophobicContact CB-CD2 4.11Å; A228-L311 HydrophobicContact CB-CD2 3.92Å
229	V	98.8	Very high	98.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.3	-47.3	175.2	174.9	0	0	0	0	110.8	C225 R226 G231 A232 F233 F275 M305 M376	C225-V229 WeakPolarHBondContact O-CG2 3.35Å; C225-V229 PolarHBondContact O-N 3.25Å; R226-V229 PolarHBondContact O-N 2.9Å; V229-G231 VanDerWaalsContact C-N 3.32Å; V229-G231 PolarHBondContact O-N 3.05Å; V229-A232 PolarHBondContact O-N 3.22Å; V229-F233 HydrophobicContact CG1-CD2 3.76Å; V229-F233 HydrophobicContact CG1-CE2 3.7Å; V229-F233 WeakPolarHBondContact O-CD2 3.5Å; V229-F233 PolarHBondContact O-N 2.92Å; V229-F275 HydrophobicContact CG1-CE1 4.16Å; V229-F275 HydrophobicContact CG1-CE2 4.43Å; V229-F275 HydrophobicContact CG1-CZ 3.95Å; V229-F275 HydrophobicContact CG2-CE1 3.54Å; V229-F275 HydrophobicContact CG2-CZ 3.73Å; V229-M305 HydrophobicContact CG2-CE 4.07Å; V229-M305 HydrophobicContact CG2-CG 3.97Å; V229-M305 HydrophobicContact CG2-SD 4.32Å; V229-M376 HydrophobicContact CB-CG 4.44Å; V229-M376 HydrophobicContact CB-SD 3.84Å; V229-M376 HydrophobicContact CG1-CB 4.33Å; V229-M376 HydrophobicContact CG1-CE 4.26Å; V229-M376 HydrophobicContact CG1-CG 3.87Å; V229-M376 HydrophobicContact CG1-SD 3.73Å; V229-M376 HydrophobicContact CG2-SD 4.11Å
230	R	98.8	Very high	98.5	Very high	72 Å²	72	47.9 Å²	47.9	27%	0.272	25%	0.246	S	C	.	.	H	α-helix	trans	-59.8	-43	175.4	-68.6	-177.7	98.9	137.2	2.6	111.9	R226 D227 F233 H234 N372 D375 M376	R226-R230 WeakPolarHBondContact O-CG 3.38Å; R226-R230 PolarHBondContact O-N 2.86Å; R226-R230 VanDerWaalsContact O-N 3.1Å; D227-R230 PolarHBondContact O-N 2.79Å; R230-F233 PolarHBondContact O-N 3.06Å; R230-H234 WeakPolarHBondContact O-CB 3.39Å; R230-H234 PolarHBondContact O-N 2.89Å; R230-N372 PolarHBondContact NE-OD1 2.95Å; R230-N372 PolarHBondContact NH2-O 3.15Å; R230-N372 PolarHBondContact NH2-OD1 3.07Å; R230-D375 PolarHBondContact NH2-O 3.31Å; R230-M376 HydrophobicContact CG-CB 3.7Å
231	G	98.7	Very high	98.5	Very high	23 Å²	23	47.1 Å²	47.1	24%	0.237	24%	0.242	C	C	.	.	H	α-helix	trans	-60.3	-45	176.6	0	0	0	0	0	112.5	D227 A228 V229 H234 L235	D227-G231 PolarHBondContact O-N 3.17Å; A228-G231 PolarHBondContact O-N 2.81Å; V229-G231 VanDerWaalsContact C-N 3.32Å; V229-G231 PolarHBondContact O-N 3.05Å; G231-H234 WeakPolarHBondContact O-CB 3.2Å; G231-H234 PolarHBondContact O-N 2.68Å; G231-L235 WeakPolarHBondContact O-CG 2.95Å; G231-L235 PolarHBondContact O-N 2.73Å
232	A	98.8	Very high	98.5	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.4	-47.1	177.9	0	0	0	0	0	112.2	A228 V229 H234 L235 L236 M305 L311 L312 L315	A228-A232 WeakPolarHBondContact O-CB 3.23Å; A228-A232 PolarHBondContact O-N 3.38Å; V229-A232 PolarHBondContact O-N 3.22Å; A232-H234 VanDerWaalsContact C-N 3.3Å; A232-H234 PolarHBondContact O-N 2.81Å; A232-L235 PolarHBondContact O-N 3.16Å; A232-L236 PolarHBondContact O-N 3.18Å; A232-M305 HydrophobicContact CB-CE 4.13Å; A232-L311 HydrophobicContact CB-CB 3.92Å; A232-L311 WeakPolarHBondContact CB-O 3.29Å; A232-L312 WeakPolarHBondContact O-CD2 3.47Å; A232-L315 HydrophobicContact CB-CB 3.83Å; A232-L315 HydrophobicContact CB-CD2 3.66Å; A232-L315 HydrophobicContact CB-CG 4.26Å
233	F	98.9	Very high	98.5	Very high	9 Å²	9	58.1 Å²	58.1	4%	0.039	28%	0.282	C	S	.	.	H	α-helix	trans	-64.6	-34.3	175.4	-81.3	-63.7	0	0	0	112.7	V229 R230 L236 K237 Y268 L271 F275 L315 F377 P378	V229-F233 HydrophobicContact CG1-CD2 3.76Å; V229-F233 HydrophobicContact CG1-CE2 3.7Å; V229-F233 WeakPolarHBondContact O-CD2 3.5Å; V229-F233 PolarHBondContact O-N 2.92Å; R230-F233 PolarHBondContact O-N 3.06Å; F233-L236 HydrophobicContact CD1-CD2 4.45Å; F233-L236 PolarHBondContact O-N 3.01Å; F233-K237 WeakPolarHBondContact O-CB 3.47Å; F233-K237 PolarHBondContact O-N 2.98Å; F233-Y268 AromaticContact CD1-CD1 3.92Å; F233-Y268 HydrophobicContact CD1-CD1 3.92Å; F233-Y268 HydrophobicContact CD1-CE1 4.08Å; F233-Y268 HydrophobicContact CE1-CD1 4Å; F233-L271 HydrophobicContact CE1-CB 3.84Å; F233-L271 HydrophobicContact CE1-CD1 3.89Å; F233-L271 HydrophobicContact CZ-CB 3.73Å; F233-L271 HydrophobicContact CZ-CD1 4.46Å; F233-F275 HydrophobicContact CE2-CE2 4.46Å; F233-L315 HydrophobicContact CD1-CD2 4.23Å; F233-L315 HydrophobicContact CD2-CD2 4.48Å; F233-L315 HydrophobicContact CE1-CD2 4.18Å; F233-L315 HydrophobicContact CE2-CD1 4.37Å; F233-L315 HydrophobicContact CE2-CD2 4.42Å; F233-L315 HydrophobicContact CG-CD2 4.39Å; F233-L315 HydrophobicContact CZ-CD1 4.45Å; F233-L315 HydrophobicContact CZ-CD2 4.27Å; F233-F377 AromaticContact CE2-CD1 3.8Å; F233-F377 HydrophobicContact CE2-CD1 3.8Å; F233-F377 HydrophobicContact CE2-CE1 4.4Å; F233-F377 HydrophobicContact CZ-CD1 4.25Å; F233-P378 HydrophobicContact CB-CG 3.98Å; F233-P378 HydrophobicContact CD1-CG 3.33Å; F233-P378 HydrophobicContact CD2-CG 4.45Å; F233-P378 HydrophobicContact CE1-CG 3.84Å; F233-P378 HydrophobicContact CG-CG 3.69Å
234	H	98.7	Very high	98.4	Very high	102 Å²	102	58.1 Å²	58.1	47%	0.472	28%	0.278	S	S	.	.	H	α-helix	trans	-63.5	-44.1	173.7	-174.9	74.8	0	0	0	112	R230 G231 A232 K237 Q238	R230-H234 WeakPolarHBondContact O-CB 3.39Å; R230-H234 PolarHBondContact O-N 2.89Å; G231-H234 WeakPolarHBondContact O-CB 3.2Å; G231-H234 PolarHBondContact O-N 2.68Å; A232-H234 VanDerWaalsContact C-N 3.3Å; A232-H234 PolarHBondContact O-N 2.81Å; H234-K237 WeakPolarHBondContact O-CB 3.4Å; H234-K237 PolarHBondContact O-N 3.35Å; H234-Q238 PolarHBondContact CD2-NE2 2.78Å; H234-Q238 PolarHBondContact NE2-NE2 2.94Å; H234-Q238 WeakPolarHBondContact O-CG 3.27Å; H234-Q238 PolarHBondContact O-N 3.15Å
235	L	98.7	Very high	98.4	Very high	65 Å²	65	54.5 Å²	54.5	34%	0.34	26%	0.26	S	S	.	.	H	α-helix	trans	-63.4	-44	175.4	-69.7	173.2	0	0	0	111.8	G231 A232 K237 Q238 L239 L311 L312	G231-L235 WeakPolarHBondContact O-CG 2.95Å; G231-L235 PolarHBondContact O-N 2.73Å; A232-L235 PolarHBondContact O-N 3.16Å; L235-K237 VanDerWaalsContact C-N 3.29Å; L235-K237 PolarHBondContact O-N 3.46Å; L235-Q238 WeakPolarHBondContact O-CB 3.29Å; L235-Q238 PolarHBondContact O-N 2.85Å; L235-Q238 VanDerWaalsContact O-N 3.11Å; L235-L239 PolarHBondContact O-N 2.85Å; L235-L311 HydrophobicContact CD1-CB 4.04Å; L235-L311 HydrophobicContact CD1-CD1 4.27Å; L235-L312 HydrophobicContact CB-CD1 4.32Å; L235-L312 HydrophobicContact CB-CD2 3.8Å; L235-L312 HydrophobicContact CB-CG 4.1Å; L235-L312 HydrophobicContact CD1-CG 4.42Å
236	L	98.7	Very high	98.3	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-59.1	-42.4	175.1	173.5	54.8	0	0	0	111.1	A232 F233 Q238 L239 A240 I248 F252 L267 Y268 L271 L312	A232-L236 PolarHBondContact O-N 3.18Å; F233-L236 HydrophobicContact CD1-CD2 4.45Å; F233-L236 PolarHBondContact O-N 3.01Å; L236-Q238 VanDerWaalsContact C-N 3.35Å; L236-Q238 PolarHBondContact O-N 2.98Å; L236-L239 PolarHBondContact O-N 3.17Å; L236-A240 PolarHBondContact O-N 2.69Å; L236-I248 HydrophobicContact CD1-CB 4.48Å; L236-I248 HydrophobicContact CD1-CD1 3.82Å; L236-I248 HydrophobicContact CD1-CG1 3.81Å; L236-I248 HydrophobicContact CD1-CG2 3.89Å; L236-F252 HydrophobicContact CB-CE2 4.42Å; L236-F252 HydrophobicContact CB-CZ 4.4Å; L236-F252 HydrophobicContact CD1-CD2 4.44Å; L236-F252 HydrophobicContact CD1-CE2 3.79Å; L236-F252 HydrophobicContact CD1-CZ 4.38Å; L236-F252 HydrophobicContact CD2-CE2 4.15Å; L236-F252 HydrophobicContact CD2-CZ 3.91Å; L236-F252 HydrophobicContact CG-CE2 4.34Å; L236-F252 HydrophobicContact CG-CZ 4.46Å; L236-L267 HydrophobicContact CD1-CD2 3.93Å; L236-L267 HydrophobicContact CD2-CD2 3.83Å; L236-L267 HydrophobicContact CD2-CG 4.19Å; L236-Y268 HydrophobicContact CD2-CD1 3.84Å; L236-Y268 HydrophobicContact CD2-CE1 3.52Å; L236-Y268 HydrophobicContact CG-CE1 3.76Å; L236-L271 HydrophobicContact CD2-CD1 3.81Å; L236-L312 HydrophobicContact CB-CD2 4.1Å
237	K	98.4	Very high	98.3	Very high	93 Å²	93	57 Å²	57	40%	0.404	29%	0.286	S	S	.	.	H	α-helix	trans	-60	-43.6	174.5	-168.1	-162.4	179.5	-51.1	0	111.9	F233 H234 L235 L239 A240 D241 Y268	F233-K237 WeakPolarHBondContact O-CB 3.47Å; F233-K237 PolarHBondContact O-N 2.98Å; H234-K237 WeakPolarHBondContact O-CB 3.4Å; H234-K237 PolarHBondContact O-N 3.35Å; L235-K237 VanDerWaalsContact C-N 3.29Å; L235-K237 PolarHBondContact O-N 3.46Å; K237-L239 VanDerWaalsContact C-N 3.33Å; K237-L239 PolarHBondContact O-N 2.93Å; K237-A240 PolarHBondContact O-N 3.46Å; K237-D241 IonicContact NZ-OD1 2.63Å; K237-D241 PolarHBondContact NZ-OD1 3.22Å; K237-D241 IonicContact NZ-OD2 3.49Å; K237-D241 PolarHBondContact NZ-OD2 2.61Å; K237-D241 WeakPolarHBondContact O-CB 3.18Å; K237-D241 PolarHBondContact O-N 2.75Å; K237-Y268 WeakPolarHBondContact CA-OH 3.49Å; K237-Y268 WeakPolarHBondContact CB-OH 3.31Å
238	Q	98.5	Very high	98.3	Very high	68 Å²	68	52.8 Å²	52.8	32%	0.318	26%	0.264	S	S	.	.	H	α-helix	trans	-62.1	-39.4	178.3	-70.5	-178.4	0.8	0	0	112.4	H234 L235 L236 R242	H234-Q238 PolarHBondContact CD2-NE2 2.78Å; H234-Q238 PolarHBondContact NE2-NE2 2.94Å; H234-Q238 WeakPolarHBondContact O-CG 3.27Å; H234-Q238 PolarHBondContact O-N 3.15Å; L235-Q238 WeakPolarHBondContact O-CB 3.29Å; L235-Q238 PolarHBondContact O-N 2.85Å; L235-Q238 VanDerWaalsContact O-N 3.11Å; L236-Q238 VanDerWaalsContact C-N 3.35Å; L236-Q238 PolarHBondContact O-N 2.98Å; Q238-R242 VanDerWaalsContact O-CG 3.32Å; Q238-R242 WeakPolarHBondContact O-CG 3.18Å; Q238-R242 PolarHBondContact O-N 2.83Å
239	L	98.4	Very high	98.3	Very high	27 Å²	27	55.1 Å²	55.1	14%	0.141	27%	0.273	C	S	.	.	H	α-helix	trans	-63.8	-44.3	173.9	-66.5	177.1	0	0	0	111.1	L235 L236 K237 R242 Q243 D244 I248 L312	L235-L239 PolarHBondContact O-N 2.85Å; L236-L239 PolarHBondContact O-N 3.17Å; K237-L239 VanDerWaalsContact C-N 3.33Å; K237-L239 PolarHBondContact O-N 2.93Å; L239-R242 CarbonylContact O-C 3.16Å; L239-R242 PolarHBondContact O-N 3.48Å; L239-Q243 PolarHBondContact O-N 3.39Å; L239-Q243 VanDerWaalsContact O-N 3.11Å; L239-D244 HydrophobicContact CD2-CB 4.25Å; L239-D244 PolarHBondContact O-N 3.27Å; L239-I248 HydrophobicContact CB-CD1 3.89Å; L239-I248 HydrophobicContact CB-CG1 3.65Å; L239-I248 HydrophobicContact CD1-CG1 3.96Å; L239-I248 HydrophobicContact CG-CG1 4.47Å; L239-L312 HydrophobicContact CD1-CD1 3.61Å
240	A	97.9	Very high	98.2	Very high	15 Å²	15	59.2 Å²	59.2	12%	0.124	30%	0.302	C	S	.	.	H	α-helix	trans	-64.2	-42	178.7	0	0	0	0	0	112.4	L236 K237 R242 Q243 I248 I264	L236-A240 PolarHBondContact O-N 2.69Å; K237-A240 PolarHBondContact O-N 3.46Å; A240-R242 PolarHBondContact O-N 2.78Å; A240-Q243 WeakPolarHBondContact O-CA 3.36Å; A240-Q243 PolarHBondContact O-N 2.86Å; A240-I248 HydrophobicContact CB-CD1 4.13Å; A240-I264 HydrophobicContact CB-CD1 4.2Å; A240-I264 HydrophobicContact CB-CG1 4.02Å; A240-I264 HydrophobicContact CB-CG2 3.87Å
241	D	97.8	Very high	98.2	Very high	107 Å²	107	59 Å²	59	57%	0.572	30%	0.303	S	S	*	.	H	α-helix	trans	-62.4	-32.5	176.8	-69.8	-16.8	0	0	0	111.8	K237 Q243	K237-D241 IonicContact NZ-OD1 2.63Å; K237-D241 PolarHBondContact NZ-OD1 3.22Å; K237-D241 IonicContact NZ-OD2 3.49Å; K237-D241 PolarHBondContact NZ-OD2 2.61Å; K237-D241 WeakPolarHBondContact O-CB 3.18Å; K237-D241 PolarHBondContact O-N 2.75Å; D241-Q243 VanDerWaalsContact C-N 3.28Å
242	R	97.8	Very high	98.2	Very high	185 Å²	185	57.9 Å²	57.9	70%	0.698	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-2.1	174.1	-66.7	176.4	-169.5	176	6.8	113.5	Q238 L239 A240 D244	Q238-R242 VanDerWaalsContact O-CG 3.32Å; Q238-R242 WeakPolarHBondContact O-CG 3.18Å; Q238-R242 PolarHBondContact O-N 2.83Å; L239-R242 CarbonylContact O-C 3.16Å; L239-R242 PolarHBondContact O-N 3.48Å; A240-R242 PolarHBondContact O-N 2.78Å; R242-D244 PolarHBondContact O-N 3.43Å
243	Q	97.4	Very high	98.1	Very high	142 Å²	142	59.4 Å²	59.4	66%	0.664	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	31.1	-173.5	-56.1	-178.2	-22.2	0	0	113.3	L239 A240 D241 Y245	L239-Q243 PolarHBondContact O-N 3.39Å; L239-Q243 VanDerWaalsContact O-N 3.11Å; A240-Q243 WeakPolarHBondContact O-CA 3.36Å; A240-Q243 PolarHBondContact O-N 2.86Å; D241-Q243 VanDerWaalsContact C-N 3.28Å; Q243-Y245 HydrophobicContact CB-CE1 4.49Å; Q243-Y245 HydrophobicContact CB-CE2 4.4Å; Q243-Y245 PolarHBondContact O-N 3.41Å
244	D	97.9	Very high	98.1	Very high	58 Å²	58	59.3 Å²	59.3	31%	0.31	31%	0.305	S	S	.	.			trans	-79.8	64.7	174.7	-173.9	10.4	0	0	0	110.9	L239 R242 S246 G247 I248	L239-D244 HydrophobicContact CD2-CB 4.25Å; L239-D244 PolarHBondContact O-N 3.27Å; R242-D244 PolarHBondContact O-N 3.43Å; D244-S246 VanDerWaalsContact C-N 3.29Å; D244-S246 PolarHBondContact O-N 3.02Å; D244-S246 PolarHBondContact OD1-OG 3.44Å; D244-S246 VanDerWaalsContact OD1-OG 3.09Å; D244-G247 PolarHBondContact O-N 3.05Å; D244-G247 WeakPolarHBondContact OD1-CA 3.43Å; D244-G247 PolarHBondContact OD1-N 2.86Å; D244-I248 WeakPolarHBondContact O-CG1 3.49Å; D244-I248 PolarHBondContact O-N 3.29Å
245	Y	97.8	Very high	98.1	Very high	37 Å²	37	56.8 Å²	56.8	15%	0.145	30%	0.298	C	S	.	.	H	α-helix	trans	-68.8	-28.5	-178.3	-58.7	-31.1	0	0	0	112.6	Q243 I248 Q249 P258 I264	Q243-Y245 HydrophobicContact CB-CE1 4.49Å; Q243-Y245 HydrophobicContact CB-CE2 4.4Å; Q243-Y245 PolarHBondContact O-N 3.41Å; Y245-I248 HydrophobicContact CD1-CD1 4.3Å; Y245-Q249 WeakPolarHBondContact O-CB 3.42Å; Y245-Q249 PolarHBondContact O-N 3.5Å; Y245-P258 WeakPolarHBondContact CB-O 3.28Å; Y245-P258 HydrophobicContact CD1-CB 3.96Å; Y245-P258 WeakPolarHBondContact CD2-O 3.27Å; Y245-P258 HydrophobicContact CG-CB 4.05Å; Y245-P258 VanDerWaalsContact CG-O 3.28Å; Y245-I264 HydrophobicContact CD1-CD1 4.23Å; Y245-I264 HydrophobicContact CE1-CD1 4.15Å; Y245-I264 HydrophobicContact CE1-CG1 4.18Å
246	S	97.6	Very high	98	Very high	79 Å²	79	61 Å²	61	55%	0.552	31%	0.314	S	S	*	.	H	α-helix	trans	-65.8	-40.6	171.3	42.9	0	0	0	0	112.5	D244 Q249 S250	D244-S246 VanDerWaalsContact C-N 3.29Å; D244-S246 PolarHBondContact O-N 3.02Å; D244-S246 PolarHBondContact OD1-OG 3.44Å; D244-S246 VanDerWaalsContact OD1-OG 3.09Å; S246-Q249 PolarHBondContact O-N 2.64Å; S246-S250 PolarHBondContact O-N 3.35Å; S246-S250 VanDerWaalsContact O-N 3.1Å; S246-S250 PolarHBondContact O-OG 3.4Å
247	G	97.7	Very high	97.9	Very high	15 Å²	15	64.3 Å²	64.3	16%	0.155	34%	0.335	C	S	.	.	H	α-helix	trans	-62.1	-50.9	173.1	0	0	0	0	0	110.6	D244 Q249 S250 E251	D244-G247 PolarHBondContact O-N 3.05Å; D244-G247 WeakPolarHBondContact OD1-CA 3.43Å; D244-G247 PolarHBondContact OD1-N 2.86Å; G247-Q249 VanDerWaalsContact C-N 3.3Å; G247-Q249 PolarHBondContact O-N 2.85Å; G247-S250 PolarHBondContact O-N 3.04Å; G247-E251 WeakPolarHBondContact O-CG 3.34Å; G247-E251 PolarHBondContact O-N 3.31Å
248	I	98.5	Very high	97.8	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-57.3	-43	177.5	-64.7	171.6	0	0	0	111.7	L236 L239 A240 D244 Y245 S250 F252 L254 P258 I264 L267	L236-I248 HydrophobicContact CD1-CB 4.48Å; L236-I248 HydrophobicContact CD1-CD1 3.82Å; L236-I248 HydrophobicContact CD1-CG1 3.81Å; L236-I248 HydrophobicContact CD1-CG2 3.89Å; L239-I248 HydrophobicContact CB-CD1 3.89Å; L239-I248 HydrophobicContact CB-CG1 3.65Å; L239-I248 HydrophobicContact CD1-CG1 3.96Å; L239-I248 HydrophobicContact CG-CG1 4.47Å; A240-I248 HydrophobicContact CB-CD1 4.13Å; D244-I248 WeakPolarHBondContact O-CG1 3.49Å; D244-I248 PolarHBondContact O-N 3.29Å; Y245-I248 HydrophobicContact CD1-CD1 4.3Å; I248-S250 VanDerWaalsContact C-N 3.3Å; I248-S250 PolarHBondContact O-N 2.91Å; I248-F252 HydrophobicContact CG2-CD2 4.17Å; I248-F252 PolarHBondContact O-N 3.4Å; I248-F252 VanDerWaalsContact O-N 3.09Å; I248-L254 HydrophobicContact CG2-CD1 4.08Å; I248-P258 HydrophobicContact CB-CG 4.39Å; I248-P258 HydrophobicContact CG2-CG 3.91Å; I248-I264 HydrophobicContact CD1-CD1 3.66Å; I248-L267 HydrophobicContact CG2-CD2 3.69Å
249	Q	98.4	Very high	97.7	Very high	60 Å²	60	60.9 Å²	60.9	28%	0.28	34%	0.335	S	S	.	.	H	α-helix	trans	-56.5	-46.9	175.5	-170.9	-166.9	-5.5	0	0	111.5	Y245 S246 G247 A253 L254 P257	Y245-Q249 WeakPolarHBondContact O-CB 3.42Å; Y245-Q249 PolarHBondContact O-N 3.5Å; S246-Q249 PolarHBondContact O-N 2.64Å; G247-Q249 VanDerWaalsContact C-N 3.3Å; G247-Q249 PolarHBondContact O-N 2.85Å; Q249-A253 CarbonylContact O-C 3.24Å; Q249-A253 VanDerWaalsContact O-CA 3.27Å; Q249-A253 WeakPolarHBondContact O-CA 3.34Å; Q249-A253 PolarHBondContact O-N 3.47Å; Q249-L254 HydrophobicContact CG-CB 4.1Å; Q249-L254 VanDerWaalsContact CG-O 3.29Å; Q249-L254 WeakPolarHBondContact CG-O 3.45Å; Q249-L254 PolarHBondContact NE2-O 3.03Å; Q249-L254 PolarHBondContact O-N 2.7Å; Q249-P257 HydrophobicContact CB-CB 4.12Å; Q249-P257 HydrophobicContact CG-CB 4.34Å
250	S	97.9	Very high	97.6	Very high	87 Å²	87	61 Å²	61	61%	0.608	34%	0.338	S	S	*	.	H	α-helix	trans	-69.5	-46.9	-176.2	-56	0	0	0	0	111.4	S246 G247 I248 F252 A253	S246-S250 PolarHBondContact O-N 3.35Å; S246-S250 VanDerWaalsContact O-N 3.1Å; S246-S250 PolarHBondContact O-OG 3.4Å; G247-S250 PolarHBondContact O-N 3.04Å; I248-S250 VanDerWaalsContact C-N 3.3Å; I248-S250 PolarHBondContact O-N 2.91Å; S250-F252 PolarHBondContact O-N 3.35Å; S250-A253 PolarHBondContact O-N 2.83Å
251	E	97.9	Very high	97.5	Very high	66 Å²	66	64.2 Å²	64.2	31%	0.308	36%	0.358	S	S	.	.	H	α-helix	trans	-60.3	-46.1	-179	-70.3	-62.4	162.3	0	0	112.1	G247 L312 R316	G247-E251 WeakPolarHBondContact O-CG 3.34Å; G247-E251 PolarHBondContact O-N 3.31Å; E251-L312 HydrophobicContact CB-CB 4.28Å; E251-L312 HydrophobicContact CB-CD1 4.35Å; E251-L312 HydrophobicContact CG-CB 4.43Å; E251-L312 HydrophobicContact CG-CD1 3.89Å; E251-R316 WeakPolarHBondContact O-CD 3.47Å; E251-R316 PolarHBondContact O-NH1 3.34Å
252	F	98.1	Very high	97.4	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	5.1	-177.2	-70.2	-89	0	0	0	114	L236 I248 S250 L254 L267 L271 L312 L315 R316	L236-F252 HydrophobicContact CB-CE2 4.42Å; L236-F252 HydrophobicContact CB-CZ 4.4Å; L236-F252 HydrophobicContact CD1-CD2 4.44Å; L236-F252 HydrophobicContact CD1-CE2 3.79Å; L236-F252 HydrophobicContact CD1-CZ 4.38Å; L236-F252 HydrophobicContact CD2-CE2 4.15Å; L236-F252 HydrophobicContact CD2-CZ 3.91Å; L236-F252 HydrophobicContact CG-CE2 4.34Å; L236-F252 HydrophobicContact CG-CZ 4.46Å; I248-F252 HydrophobicContact CG2-CD2 4.17Å; I248-F252 PolarHBondContact O-N 3.4Å; I248-F252 VanDerWaalsContact O-N 3.09Å; S250-F252 PolarHBondContact O-N 3.35Å; F252-L254 VanDerWaalsContact C-N 3.28Å; F252-L254 HydrophobicContact CB-CD2 3.74Å; F252-L254 HydrophobicContact CB-CG 3.88Å; F252-L254 PolarHBondContact O-N 2.95Å; F252-L267 HydrophobicContact CD1-CD1 4.46Å; F252-L267 HydrophobicContact CD2-CD2 4.41Å; F252-L267 HydrophobicContact CG-CD2 4.49Å; F252-L271 HydrophobicContact CD1-CD1 4.21Å; F252-L271 HydrophobicContact CD1-CD2 4.19Å; F252-L271 HydrophobicContact CE1-CD1 3.64Å; F252-L271 HydrophobicContact CE1-CD2 4.07Å; F252-L271 HydrophobicContact CZ-CD1 4.21Å; F252-L312 HydrophobicContact CE2-CB 4.49Å; F252-L312 HydrophobicContact CE2-CD2 3.96Å; F252-L312 HydrophobicContact CZ-CD2 3.89Å; F252-L315 HydrophobicContact CE1-CB 4.29Å; F252-L315 HydrophobicContact CE1-CD2 4Å; F252-L315 HydrophobicContact CE1-CG 4.04Å; F252-L315 HydrophobicContact CZ-CD2 4.07Å; F252-R316 HydrophobicContact CD1-CB 4.03Å
253	A	97.6	Very high	97.4	Very high	33 Å²	33	57.3 Å²	57.3	27%	0.273	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	47.7	-174.7	0	0	0	0	0	112.2	Q249 S250 C331 F332	Q249-A253 CarbonylContact O-C 3.24Å; Q249-A253 VanDerWaalsContact O-CA 3.27Å; Q249-A253 WeakPolarHBondContact O-CA 3.34Å; Q249-A253 PolarHBondContact O-N 3.47Å; S250-A253 PolarHBondContact O-N 2.83Å; A253-C331 CarbonylContact O-C 3.55Å; A253-C331 WeakPolarHBondContact O-CA 3.41Å; A253-C331 WeakPolarHBondContact O-CB 3.32Å; A253-F332 PolarHBondContact O-N 3.5Å
254	L	98.3	Very high	97.4	Very high	6 Å²	6	51 Å²	51	3%	0.031	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-75	140.4	-179.5	-53.6	-177.6	0	0	0	110.8	I248 Q249 F252 K256 P258 L267 F332 L334	I248-L254 HydrophobicContact CG2-CD1 4.08Å; Q249-L254 HydrophobicContact CG-CB 4.1Å; Q249-L254 VanDerWaalsContact CG-O 3.29Å; Q249-L254 WeakPolarHBondContact CG-O 3.45Å; Q249-L254 PolarHBondContact NE2-O 3.03Å; Q249-L254 PolarHBondContact O-N 2.7Å; F252-L254 VanDerWaalsContact C-N 3.28Å; F252-L254 HydrophobicContact CB-CD2 3.74Å; F252-L254 HydrophobicContact CB-CG 3.88Å; F252-L254 PolarHBondContact O-N 2.95Å; L254-K256 WeakPolarHBondContact CB-O 3.48Å; L254-K256 PolarHBondContact O-N 2.76Å; L254-P258 HydrophobicContact CD1-CG 4.02Å; L254-L267 HydrophobicContact CD1-CD2 4.36Å; L254-L267 HydrophobicContact CD2-CD1 4.3Å; L254-F332 WeakPolarHBondContact CA-O 3.4Å; L254-F332 HydrophobicContact CD2-CB 4.04Å; L254-L334 HydrophobicContact CD1-CD1 4.32Å; L254-L334 HydrophobicContact CD1-CD2 4.44Å; L254-L334 HydrophobicContact CD2-CD2 3.68Å; L254-L334 HydrophobicContact CD2-CG 4.35Å
255	C	98.1	Very high	97.4	Very high	50 Å²	50	51.9 Å²	51.9	34%	0.338	30%	0.304	S	S	.	.	S	Bend	trans	-64.3	-26.5	179.8	-60.3	0	0	0	0	112.5	C331 F332 D333	C255-C331 WeakPolarHBondContact CA-SG 3.44Å; C255-C331 HydrophobicContact CB-CB 3.96Å; C255-C331 WeakPolarHBondContact CB-SG 3.4Å; C255-C331 WeakPolarHBondContact SG-CB 3.3Å; C255-C331 CovalentContact SG-SG 2.04Å; C255-C331 PolarHBondContact SG-SG 3.04Å; C255-F332 PolarHBondContact N-O 3.3Å; C255-D333 HydrophobicContact CB-CB 4.41Å
256	K	96.9	Very high	97.4	Very high	154 Å²	154	50.4 Å²	50.4	67%	0.67	30%	0.298	S	S	*	.	S	Bend	trans	-136.9	147.1	174.7	-64.5	176.5	-175.1	167.2	0	109.2	L254	L254-K256 WeakPolarHBondContact CB-O 3.48Å; L254-K256 PolarHBondContact O-N 2.76Å
257	P	96.9	Very high	97.5	Very high	68 Å²	68	46.6 Å²	46.6	44%	0.442	27%	0.272	S	S	.	.			trans	-65.7	145	171.4	28	-32.5	0	0	0	110.2	Q249	Q249-P257 HydrophobicContact CB-CB 4.12Å; Q249-P257 HydrophobicContact CG-CB 4.34Å
258	P	97.5	Very high	97.5	Very high	7 Å²	7	46.6 Å²	46.6	5%	0.045	27%	0.267	C	S	.	.			trans	-53.2	141.8	165.8	-24.5	34.5	0	0	0	110.5	Y245 I248 L254 D263 I264	Y245-P258 WeakPolarHBondContact CB-O 3.28Å; Y245-P258 HydrophobicContact CD1-CB 3.96Å; Y245-P258 WeakPolarHBondContact CD2-O 3.27Å; Y245-P258 HydrophobicContact CG-CB 4.05Å; Y245-P258 VanDerWaalsContact CG-O 3.28Å; I248-P258 HydrophobicContact CB-CG 4.39Å; I248-P258 HydrophobicContact CG2-CG 3.91Å; L254-P258 HydrophobicContact CD1-CG 4.02Å; P258-D263 HydrophobicContact CB-CB 3.84Å; P258-I264 HydrophobicContact CB-CD1 3.75Å; P258-I264 HydrophobicContact CG-CD1 3.87Å
259	A	95.1	Very high	97.5	Very high	83 Å²	83	46.6 Å²	46.6	69%	0.686	27%	0.267	S	S	*	.			trans	-110.6	-15.8	177.2	0	0	0	0	0	112.1	D263	A259-D263 WeakPolarHBondContact CA-OD2 3.43Å; A259-D263 PolarHBondContact N-OD2 2.99Å
260	S	96.1	Very high	97.5	Very high	29 Å²	29	43.8 Å²	43.8	20%	0.203	25%	0.254	C	S	.	.	S	Bend	trans	-152.3	162.4	-168.9	67	0	0	0	0	112.8	Q262 D263 I264	S260-Q262 PolarHBondContact O-N 3.48Å; S260-Q262 PolarHBondContact OG-N 3.04Å; S260-Q262 PolarHBondContact OG-OE1 3.32Å; S260-D263 PolarHBondContact N-OD2 3.3Å; S260-D263 WeakPolarHBondContact O-CB 3.4Å; S260-D263 PolarHBondContact O-N 3.16Å; S260-D263 PolarHBondContact OG-N 3.45Å; S260-D263 PolarHBondContact OG-OD2 3.06Å; S260-I264 PolarHBondContact O-N 3.44Å
261	P	96	Very high	97.5	Very high	82 Å²	82	39.7 Å²	39.7	53%	0.532	23%	0.225	S	C	.	.	H	α-helix	trans	-55.7	-28.8	168.9	-26.1	35.9	0	0	0	113.5	I264 Q265	P261-I264 WeakPolarHBondContact O-CB 3.32Å; P261-I264 PolarHBondContact O-N 2.89Å; P261-Q265 WeakPolarHBondContact O-CG 3.34Å; P261-Q265 PolarHBondContact O-N 2.98Å
262	Q	95.9	Very high	97.6	Very high	128 Å²	128	36.9 Å²	36.9	60%	0.598	21%	0.212	S	C	*	.	H	α-helix	trans	-64.8	-39.5	175.9	-69.5	73	16.7	0	0	111.6	S260 I264 Q265 Q266	S260-Q262 PolarHBondContact O-N 3.48Å; S260-Q262 PolarHBondContact OG-N 3.04Å; S260-Q262 PolarHBondContact OG-OE1 3.32Å; Q262-I264 VanDerWaalsContact C-N 3.26Å; Q262-I264 PolarHBondContact O-N 3.01Å; Q262-Q265 WeakPolarHBondContact O-CB 3.44Å; Q262-Q265 PolarHBondContact O-N 3.3Å; Q262-Q266 PolarHBondContact O-N 2.56Å
263	D	97.5	Very high	97.6	Very high	20 Å²	20	37.7 Å²	37.7	11%	0.107	22%	0.216	C	C	.	.	H	α-helix	trans	-66.2	-30.8	175.5	-59.5	-49.8	0	0	0	112	P258 A259 S260 Q266 L267 Y335	P258-D263 HydrophobicContact CB-CB 3.84Å; A259-D263 WeakPolarHBondContact CA-OD2 3.43Å; A259-D263 PolarHBondContact N-OD2 2.99Å; S260-D263 PolarHBondContact N-OD2 3.3Å; S260-D263 WeakPolarHBondContact O-CB 3.4Å; S260-D263 PolarHBondContact O-N 3.16Å; S260-D263 PolarHBondContact OG-N 3.45Å; S260-D263 PolarHBondContact OG-OD2 3.06Å; D263-Q266 WeakPolarHBondContact O-CB 3.2Å; D263-Q266 PolarHBondContact O-N 3.5Å; D263-L267 PolarHBondContact O-N 2.77Å; D263-Y335 WeakPolarHBondContact OD1-CE2 3.34Å; D263-Y335 PolarHBondContact OD1-OH 3.06Å
264	I	98.1	Very high	97.7	Very high	8 Å²	8	36.1 Å²	36.1	4%	0.041	20%	0.203	C	C	.	.	H	α-helix	trans	-69.5	-41	173.1	-56	-56.4	0	0	0	110.9	A240 Y245 I248 P258 S260 P261 Q262 Q266 L267 Y268	A240-I264 HydrophobicContact CB-CD1 4.2Å; A240-I264 HydrophobicContact CB-CG1 4.02Å; A240-I264 HydrophobicContact CB-CG2 3.87Å; Y245-I264 HydrophobicContact CD1-CD1 4.23Å; Y245-I264 HydrophobicContact CE1-CD1 4.15Å; Y245-I264 HydrophobicContact CE1-CG1 4.18Å; I248-I264 HydrophobicContact CD1-CD1 3.66Å; P258-I264 HydrophobicContact CB-CD1 3.75Å; P258-I264 HydrophobicContact CG-CD1 3.87Å; S260-I264 PolarHBondContact O-N 3.44Å; P261-I264 WeakPolarHBondContact O-CB 3.32Å; P261-I264 PolarHBondContact O-N 2.89Å; Q262-I264 VanDerWaalsContact C-N 3.26Å; Q262-I264 PolarHBondContact O-N 3.01Å; I264-Q266 VanDerWaalsContact C-N 3.3Å; I264-Q266 PolarHBondContact O-N 3.11Å; I264-L267 PolarHBondContact O-N 3.23Å; I264-Y268 HydrophobicContact CG2-CD2 4.27Å; I264-Y268 HydrophobicContact CG2-CE1 4.28Å; I264-Y268 HydrophobicContact CG2-CE2 3.74Å; I264-Y268 PolarHBondContact O-N 3.11Å
265	Q	97.4	Very high	97.7	Very high	77 Å²	77	35.8 Å²	35.8	36%	0.36	20%	0.201	S	C	.	.	H	α-helix	trans	-63.3	-37.7	173.1	-68.4	-62	-33.7	0	0	112	P261 Q262 Y268 G269 Q340	P261-Q265 WeakPolarHBondContact O-CG 3.34Å; P261-Q265 PolarHBondContact O-N 2.98Å; Q262-Q265 WeakPolarHBondContact O-CB 3.44Å; Q262-Q265 PolarHBondContact O-N 3.3Å; Q265-Y268 PolarHBondContact O-N 3.21Å; Q265-G269 PolarHBondContact O-N 3.36Å; Q265-Q340 PolarHBondContact O-NE2 3.09Å
266	Q	98.1	Very high	97.7	Very high	6 Å²	6	33.5 Å²	33.5	3%	0.028	19%	0.186	C	C	.	.	H	α-helix	trans	-61.9	-45	173.1	-177	66.5	18.8	0	0	111.4	Q262 D263 I264 G269 L270 L334 Y335 Y338	Q262-Q266 PolarHBondContact O-N 2.56Å; D263-Q266 WeakPolarHBondContact O-CB 3.2Å; D263-Q266 PolarHBondContact O-N 3.5Å; I264-Q266 VanDerWaalsContact C-N 3.3Å; I264-Q266 PolarHBondContact O-N 3.11Å; Q266-G269 PolarHBondContact O-N 3.35Å; Q266-L270 PolarHBondContact O-N 2.93Å; Q266-L334 HydrophobicContact CG-CB 3.89Å; Q266-L334 HydrophobicContact CG-CD1 4.5Å; Q266-L334 PolarHBondContact NE2-O 2.75Å; Q266-L334 VanDerWaalsContact NE2-O 3.16Å; Q266-Y335 HydrophobicContact CB-CE1 4.35Å; Q266-Y335 HydrophobicContact CG-CD1 4.11Å; Q266-Y335 HydrophobicContact CG-CE1 3.8Å; Q266-Y335 HydrophobicContact CG-CE2 4.36Å; Q266-Y338 PolarHBondContact NE2-O 2.93Å
267	L	98.6	Very high	97.8	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-63.2	-42.6	175.5	176	60.8	0	0	0	112	L236 I248 F252 L254 D263 I264 G269 L270 L271 L334	L236-L267 HydrophobicContact CD1-CD2 3.93Å; L236-L267 HydrophobicContact CD2-CD2 3.83Å; L236-L267 HydrophobicContact CD2-CG 4.19Å; I248-L267 HydrophobicContact CG2-CD2 3.69Å; F252-L267 HydrophobicContact CD1-CD1 4.46Å; F252-L267 HydrophobicContact CD2-CD2 4.41Å; F252-L267 HydrophobicContact CG-CD2 4.49Å; L254-L267 HydrophobicContact CD1-CD2 4.36Å; L254-L267 HydrophobicContact CD2-CD1 4.3Å; D263-L267 PolarHBondContact O-N 2.77Å; I264-L267 PolarHBondContact O-N 3.23Å; L267-G269 VanDerWaalsContact C-N 3.3Å; L267-G269 PolarHBondContact O-N 2.9Å; L267-L270 HydrophobicContact CD1-CD2 4.5Å; L267-L270 PolarHBondContact O-N 2.94Å; L267-L271 HydrophobicContact CD1-CD1 3.76Å; L267-L271 HydrophobicContact CD1-CD2 4.39Å; L267-L271 HydrophobicContact CD1-CG 3.84Å; L267-L271 HydrophobicContact CG-CD1 3.85Å; L267-L271 HydrophobicContact CG-CG 4.34Å; L267-L271 WeakPolarHBondContact O-CB 3.3Å; L267-L271 VanDerWaalsContact O-CG 3.26Å; L267-L271 WeakPolarHBondContact O-CG 3.45Å; L267-L271 PolarHBondContact O-N 3.05Å; L267-L334 HydrophobicContact CB-CD1 4.23Å; L267-L334 HydrophobicContact CB-CD2 4.23Å; L267-L334 HydrophobicContact CD1-CD2 3.79Å
268	Y	98.7	Very high	97.9	Very high	15 Å²	15	24 Å²	24	6%	0.059	14%	0.138	C	C	.	.	H	α-helix	trans	-59.2	-42.4	173.3	-68	-30.4	0	0	0	112	F233 L236 K237 I264 Q265 L271 R272 P378	F233-Y268 AromaticContact CD1-CD1 3.92Å; F233-Y268 HydrophobicContact CD1-CD1 3.92Å; F233-Y268 HydrophobicContact CD1-CE1 4.08Å; F233-Y268 HydrophobicContact CE1-CD1 4Å; L236-Y268 HydrophobicContact CD2-CD1 3.84Å; L236-Y268 HydrophobicContact CD2-CE1 3.52Å; L236-Y268 HydrophobicContact CG-CE1 3.76Å; K237-Y268 WeakPolarHBondContact CA-OH 3.49Å; K237-Y268 WeakPolarHBondContact CB-OH 3.31Å; I264-Y268 HydrophobicContact CG2-CD2 4.27Å; I264-Y268 HydrophobicContact CG2-CE1 4.28Å; I264-Y268 HydrophobicContact CG2-CE2 3.74Å; I264-Y268 PolarHBondContact O-N 3.11Å; Q265-Y268 PolarHBondContact O-N 3.21Å; Y268-L271 PolarHBondContact O-N 3.41Å; Y268-R272 WeakPolarHBondContact O-CB 3.28Å; Y268-R272 PolarHBondContact O-N 2.91Å; Y268-P378 HydrophobicContact CD1-CB 4.3Å; Y268-P378 HydrophobicContact CD1-CG 3.62Å; Y268-P378 HydrophobicContact CD2-CB 3.93Å; Y268-P378 HydrophobicContact CD2-CG 4.17Å; Y268-P378 HydrophobicContact CE1-CB 4.39Å; Y268-P378 HydrophobicContact CE1-CG 3.8Å; Y268-P378 HydrophobicContact CE2-CB 4.07Å; Y268-P378 HydrophobicContact CE2-CG 4.35Å; Y268-P378 HydrophobicContact CG-CB 4.07Å; Y268-P378 HydrophobicContact CG-CG 3.82Å
269	G	98.4	Very high	97.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-59.4	-51.1	175.1	0	0	0	0	0	112.6	Q265 Q266 L267 L271 R272 N273	Q265-G269 PolarHBondContact O-N 3.36Å; Q266-G269 PolarHBondContact O-N 3.35Å; L267-G269 VanDerWaalsContact C-N 3.3Å; L267-G269 PolarHBondContact O-N 2.9Å; G269-L271 PolarHBondContact O-N 3.17Å; G269-R272 PolarHBondContact O-N 2.96Å; G269-N273 WeakPolarHBondContact O-CB 3.42Å; G269-N273 PolarHBondContact O-N 2.92Å
270	L	98.6	Very high	98.1	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-55.9	-50.1	176.5	179.3	75.8	0	0	0	111.4	Q266 L267 N273 A274 Y323 L334 L337 Y338	Q266-L270 PolarHBondContact O-N 2.93Å; L267-L270 HydrophobicContact CD1-CD2 4.5Å; L267-L270 PolarHBondContact O-N 2.94Å; L270-N273 PolarHBondContact O-N 3.01Å; L270-A274 PolarHBondContact O-N 3.39Å; L270-A274 VanDerWaalsContact O-N 3.15Å; L270-Y323 HydrophobicContact CD1-CD1 4.2Å; L270-Y323 HydrophobicContact CD1-CD2 3.96Å; L270-Y323 HydrophobicContact CD1-CE1 3.72Å; L270-Y323 HydrophobicContact CD1-CE2 3.44Å; L270-Y323 VanDerWaalsContact CD1-CE2 3.44Å; L270-Y323 HydrophobicContact CD1-CG 4.3Å; L270-Y323 HydrophobicContact CG-CD2 4.28Å; L270-Y323 HydrophobicContact CG-CE2 3.77Å; L270-Y323 WeakPolarHBondContact O-CE2 3.28Å; L270-Y323 PolarHBondContact O-OH 3.27Å; L270-L334 HydrophobicContact CD2-CD2 3.63Å; L270-L337 HydrophobicContact CD1-CB 3.65Å; L270-Y338 HydrophobicContact CB-CG 4.48Å; L270-Y338 VanDerWaalsContact CD1-CB 3.48Å; L270-Y338 HydrophobicContact CD1-CG 4.48Å
271	L	98.8	Very high	98.2	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-66	-46.4	-177.8	-66.7	172.1	0	0	0	111.3	F233 L236 F252 L267 Y268 G269 N273 A274 F275 L315 A319	F233-L271 HydrophobicContact CE1-CB 3.84Å; F233-L271 HydrophobicContact CE1-CD1 3.89Å; F233-L271 HydrophobicContact CZ-CB 3.73Å; F233-L271 HydrophobicContact CZ-CD1 4.46Å; L236-L271 HydrophobicContact CD2-CD1 3.81Å; F252-L271 HydrophobicContact CD1-CD1 4.21Å; F252-L271 HydrophobicContact CD1-CD2 4.19Å; F252-L271 HydrophobicContact CE1-CD1 3.64Å; F252-L271 HydrophobicContact CE1-CD2 4.07Å; F252-L271 HydrophobicContact CZ-CD1 4.21Å; L267-L271 HydrophobicContact CD1-CD1 3.76Å; L267-L271 HydrophobicContact CD1-CD2 4.39Å; L267-L271 HydrophobicContact CD1-CG 3.84Å; L267-L271 HydrophobicContact CG-CD1 3.85Å; L267-L271 HydrophobicContact CG-CG 4.34Å; L267-L271 WeakPolarHBondContact O-CB 3.3Å; L267-L271 VanDerWaalsContact O-CG 3.26Å; L267-L271 WeakPolarHBondContact O-CG 3.45Å; L267-L271 PolarHBondContact O-N 3.05Å; Y268-L271 PolarHBondContact O-N 3.41Å; G269-L271 PolarHBondContact O-N 3.17Å; L271-N273 VanDerWaalsContact C-N 3.31Å; L271-N273 PolarHBondContact O-N 3.2Å; L271-A274 WeakPolarHBondContact O-CB 3.32Å; L271-A274 PolarHBondContact O-N 2.92Å; L271-A274 VanDerWaalsContact O-N 3.14Å; L271-F275 WeakPolarHBondContact O-CD2 3.09Å; L271-L315 HydrophobicContact CD1-CD2 3.98Å; L271-L315 HydrophobicContact CD1-CG 4.36Å; L271-L315 HydrophobicContact CD2-CG 4.32Å; L271-A319 HydrophobicContact CD2-CB 3.65Å
272	R	98.9	Very high	98.3	Very high	8 Å²	8	15.8 Å²	15.8	3%	0.03	8%	0.075	C	C	.	.	H	α-helix	trans	-59	-42.7	176.1	-175.9	179	73.1	174.7	5.3	111.3	F211 Y268 G269 A274 F275 T276 P344 S370 F377	F211-R272 HydrophobicContact CD1-CG 3.97Å; F211-R272 VanDerWaalsContact CE1-CD 3.43Å; F211-R272 HydrophobicContact CE1-CG 3.67Å; F211-R272 HydrophobicContact CZ-CG 4.42Å; F211-R272 VanDerWaalsContact CZ-NE 3.31Å; Y268-R272 WeakPolarHBondContact O-CB 3.28Å; Y268-R272 PolarHBondContact O-N 2.91Å; G269-R272 PolarHBondContact O-N 2.96Å; R272-A274 VanDerWaalsContact C-N 3.26Å; R272-A274 PolarHBondContact O-N 3Å; R272-F275 PolarHBondContact O-N 3.46Å; R272-F275 VanDerWaalsContact O-N 3.1Å; R272-T276 PolarHBondContact O-N 3.45Å; R272-T276 VanDerWaalsContact O-N 3.07Å; R272-T276 PolarHBondContact O-OG1 3.2Å; R272-P344 PolarHBondContact NH2-O 2.9Å; R272-S370 PolarHBondContact NH1-OG 3.44Å; R272-F377 HydrophobicContact CB-CD1 4.13Å; R272-F377 HydrophobicContact CB-CE1 4.49Å; R272-F377 HydrophobicContact CB-CG 4.49Å; R272-F377 HydrophobicContact CG-CB 4.3Å; R272-F377 HydrophobicContact CG-CD1 3.79Å; R272-F377 HydrophobicContact CG-CD2 4.07Å; R272-F377 HydrophobicContact CG-CE1 4.09Å; R272-F377 HydrophobicContact CG-CE2 4.34Å; R272-F377 HydrophobicContact CG-CG 3.78Å; R272-F377 HydrophobicContact CG-CZ 4.34Å
273	N	98.6	Very high	98.4	Very high	16 Å²	16	9.7 Å²	9.7	9%	0.086	5%	0.047	C	C	.	.	H	α-helix	trans	-60.1	-34.7	177.1	-173.4	94.1	0	0	0	112.2	G269 L270 L271 F275 T276 M277 Y323 Y338 T345	G269-N273 WeakPolarHBondContact O-CB 3.42Å; G269-N273 PolarHBondContact O-N 2.92Å; L270-N273 PolarHBondContact O-N 3.01Å; L271-N273 VanDerWaalsContact C-N 3.31Å; L271-N273 PolarHBondContact O-N 3.2Å; N273-F275 VanDerWaalsContact C-N 3.31Å; N273-F275 PolarHBondContact O-N 3.29Å; N273-T276 WeakPolarHBondContact O-CB 3.07Å; N273-T276 PolarHBondContact O-N 2.97Å; N273-M277 WeakPolarHBondContact ND2-CG 3.38Å; N273-M277 VanDerWaalsContact O-CG 3.29Å; N273-M277 WeakPolarHBondContact O-CG 2.99Å; N273-M277 PolarHBondContact O-N 2.97Å; N273-Y323 WeakPolarHBondContact CB-OH 3.48Å; N273-Y323 PolarHBondContact ND2-OH 2.98Å; N273-Y338 HydrophobicContact CB-CD2 3.86Å; N273-Y338 HydrophobicContact CB-CE2 3.64Å; N273-Y338 WeakPolarHBondContact OD1-CE2 3.43Å; N273-T345 PolarHBondContact OD1-O 3.42Å
274	A	98.6	Very high	98.5	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-58.3	-43.7	174.2	0	0	0	0	0	112.1	L270 L271 R272 M277 M278 A319 V322 Y323	L270-A274 PolarHBondContact O-N 3.39Å; L270-A274 VanDerWaalsContact O-N 3.15Å; L271-A274 WeakPolarHBondContact O-CB 3.32Å; L271-A274 PolarHBondContact O-N 2.92Å; L271-A274 VanDerWaalsContact O-N 3.14Å; R272-A274 VanDerWaalsContact C-N 3.26Å; R272-A274 PolarHBondContact O-N 3Å; A274-M277 PolarHBondContact O-N 2.86Å; A274-M278 HydrophobicContact CB-CE 4.4Å; A274-M278 VanDerWaalsContact O-CE 3.29Å; A274-M278 WeakPolarHBondContact O-CE 3.14Å; A274-M278 WeakPolarHBondContact O-CG 3.43Å; A274-M278 PolarHBondContact O-N 3.14Å; A274-A319 HydrophobicContact CB-CB 4.13Å; A274-V322 HydrophobicContact CB-CB 4.33Å; A274-V322 HydrophobicContact CB-CG2 3.88Å; A274-V322 WeakPolarHBondContact O-CG2 3.36Å; A274-Y323 HydrophobicContact CB-CE2 3.9Å
275	F	98.9	Very high	98.5	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-67	-41.2	176.6	-66.9	-95.3	0	0	0	111.8	V214 F218 V229 F233 L271 R272 N273 M277 M278 A279 L315 T318 M376 F377	V214-F275 HydrophobicContact CG1-CB 4.03Å; F218-F275 AromaticContact CD1-CD1 3.8Å; F218-F275 HydrophobicContact CD1-CD1 3.8Å; F218-F275 HydrophobicContact CD1-CE1 4.02Å; F218-F275 HydrophobicContact CD2-CD1 4.29Å; F218-F275 AromaticContact CE1-CD1 3.32Å; F218-F275 HydrophobicContact CE1-CD1 3.32Å; F218-F275 AromaticContact CE1-CE1 3.69Å; F218-F275 HydrophobicContact CE1-CE1 3.69Å; F218-F275 HydrophobicContact CE1-CG 4.44Å; F218-F275 HydrophobicContact CE2-CB 4.1Å; F218-F275 AromaticContact CE2-CD1 3.86Å; F218-F275 HydrophobicContact CE2-CD1 3.86Å; F218-F275 HydrophobicContact CE2-CG 4.48Å; F218-F275 HydrophobicContact CG-CD1 4.27Å; F218-F275 HydrophobicContact CZ-CB 4.08Å; F218-F275 AromaticContact CZ-CD1 3.37Å; F218-F275 HydrophobicContact CZ-CD1 3.37Å; F218-F275 HydrophobicContact CZ-CE1 4.21Å; F218-F275 HydrophobicContact CZ-CG 4.13Å; V229-F275 HydrophobicContact CG1-CE1 4.16Å; V229-F275 HydrophobicContact CG1-CE2 4.43Å; V229-F275 HydrophobicContact CG1-CZ 3.95Å; V229-F275 HydrophobicContact CG2-CE1 3.54Å; V229-F275 HydrophobicContact CG2-CZ 3.73Å; F233-F275 HydrophobicContact CE2-CE2 4.46Å; L271-F275 WeakPolarHBondContact O-CD2 3.09Å; R272-F275 PolarHBondContact O-N 3.46Å; R272-F275 VanDerWaalsContact O-N 3.1Å; N273-F275 VanDerWaalsContact C-N 3.31Å; N273-F275 PolarHBondContact O-N 3.29Å; F275-M277 PolarHBondContact O-N 3.05Å; F275-M278 HydrophobicContact CD1-CE 4.38Å; F275-M278 HydrophobicContact CG-CE 4.45Å; F275-M278 PolarHBondContact O-N 2.85Å; F275-A279 WeakPolarHBondContact O-CB 3.33Å; F275-A279 PolarHBondContact O-N 2.66Å; F275-L315 HydrophobicContact CE2-CD1 3.61Å; F275-L315 HydrophobicContact CZ-CD1 3.67Å; F275-T318 HydrophobicContact CE1-CG2 4.06Å; F275-T318 HydrophobicContact CE2-CG2 4.49Å; F275-T318 HydrophobicContact CZ-CG2 3.82Å; F275-M376 HydrophobicContact CB-CE 4.38Å; F275-M376 HydrophobicContact CD1-CE 3.5Å; F275-M376 VanDerWaalsContact CD1-CE 3.5Å; F275-M376 HydrophobicContact CE1-CE 4.06Å; F275-M376 HydrophobicContact CG-CE 4.08Å; F275-F377 HydrophobicContact CB-CE1 3.71Å; F275-F377 HydrophobicContact CB-CZ 3.58Å; F275-F377 HydrophobicContact CD1-CE1 4.39Å; F275-F377 AromaticContact CD2-CE1 3.71Å; F275-F377 HydrophobicContact CD2-CE1 3.71Å; F275-F377 HydrophobicContact CD2-CZ 4.45Å; F275-F377 HydrophobicContact CE2-CE1 4.49Å; F275-F377 AromaticContact CG-CE1 3.68Å; F275-F377 HydrophobicContact CG-CE1 3.68Å; F275-F377 AromaticContact CG-CZ 4Å; F275-F377 HydrophobicContact CG-CZ 4Å
276	T	98.8	Very high	98.5	Very high	1 Å²	1	11 Å²	11	1%	0.006	6%	0.063	C	C	.	.	H	α-helix	trans	-53.7	-52	172.6	-60.3	0	0	0	0	111.4	F210 R272 N273 M278 A279 M280	F210-T276 HydrophobicContact CE1-CG2 3.69Å; F210-T276 HydrophobicContact CZ-CG2 3.7Å; R272-T276 PolarHBondContact O-N 3.45Å; R272-T276 VanDerWaalsContact O-N 3.07Å; R272-T276 PolarHBondContact O-OG1 3.2Å; N273-T276 WeakPolarHBondContact O-CB 3.07Å; N273-T276 PolarHBondContact O-N 2.97Å; T276-M278 VanDerWaalsContact C-N 3.35Å; T276-M278 PolarHBondContact O-N 3.17Å; T276-A279 PolarHBondContact O-N 3.23Å; T276-M280 HydrophobicContact CG2-CG 4.46Å; T276-M280 HydrophobicContact CG2-SD 3.75Å; T276-M280 WeakPolarHBondContact O-CG 3.11Å; T276-M280 PolarHBondContact O-N 3.26Å
277	M	98.4	Very high	98.3	Very high	24 Å²	24	11.3 Å²	11.3	12%	0.118	7%	0.065	C	C	.	.	H	α-helix	trans	-63.1	-40.4	-178.3	-67.7	-56.5	-63.4	0	0	112.2	N273 A274 F275 L281 M290 M293 V322	N273-M277 WeakPolarHBondContact ND2-CG 3.38Å; N273-M277 VanDerWaalsContact O-CG 3.29Å; N273-M277 WeakPolarHBondContact O-CG 2.99Å; N273-M277 PolarHBondContact O-N 2.97Å; A274-M277 PolarHBondContact O-N 2.86Å; F275-M277 PolarHBondContact O-N 3.05Å; M277-L281 HydrophobicContact CE-CD1 4.06Å; M277-L281 VanDerWaalsContact O-CB 3.27Å; M277-L281 WeakPolarHBondContact O-CB 3.34Å; M277-L281 VanDerWaalsContact O-CG 3.29Å; M277-L281 WeakPolarHBondContact O-CG 3.3Å; M277-L281 PolarHBondContact O-N 2.9Å; M277-M290 HydrophobicContact CE-CB 3.43Å; M277-M290 VanDerWaalsContact CE-CB 3.43Å; M277-M290 HydrophobicContact CE-CG 4.31Å; M277-M290 HydrophobicContact CE-SD 3.92Å; M277-M293 HydrophobicContact CB-CE 3.87Å; M277-V322 HydrophobicContact CB-CG1 4.08Å; M277-V322 HydrophobicContact CB-CG2 4.26Å; M277-V322 HydrophobicContact CG-CG1 4.15Å
278	M	98.7	Very high	98	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-69.7	-37.7	178.5	-69.4	-177.2	-67.6	0	0	112.4	F218 A274 F275 T276 L281 D282 M293 P297 V298 A301 T318 I321 V322	F218-M278 HydrophobicContact CE1-CE 4.36Å; F218-M278 HydrophobicContact CZ-CB 4.16Å; F218-M278 HydrophobicContact CZ-CE 4.09Å; A274-M278 HydrophobicContact CB-CE 4.4Å; A274-M278 VanDerWaalsContact O-CE 3.29Å; A274-M278 WeakPolarHBondContact O-CE 3.14Å; A274-M278 WeakPolarHBondContact O-CG 3.43Å; A274-M278 PolarHBondContact O-N 3.14Å; F275-M278 HydrophobicContact CD1-CE 4.38Å; F275-M278 HydrophobicContact CG-CE 4.45Å; F275-M278 PolarHBondContact O-N 2.85Å; T276-M278 VanDerWaalsContact C-N 3.35Å; T276-M278 PolarHBondContact O-N 3.17Å; M278-L281 CarbonylContact O-C 3.57Å; M278-D282 PolarHBondContact O-N 2.04Å; M278-D282 VanDerWaalsContact O-N 3.09Å; M278-M293 HydrophobicContact CG-CE 4.46Å; M278-M293 HydrophobicContact CG-SD 4.44Å; M278-P297 HydrophobicContact CB-CB 4.18Å; M278-P297 HydrophobicContact CG-CB 4.13Å; M278-P297 WeakPolarHBondContact O-CG 3.35Å; M278-V298 HydrophobicContact CB-CG2 4.47Å; M278-V298 WeakPolarHBondContact O-CG2 3.35Å; M278-A301 HydrophobicContact CE-CB 3.82Å; M278-A301 HydrophobicContact SD-CB 3.65Å; M278-T318 HydrophobicContact CE-CG2 3.69Å; M278-I321 HydrophobicContact CG-CG2 4.45Å; M278-I321 HydrophobicContact SD-CB 3.93Å; M278-I321 HydrophobicContact SD-CD1 3.91Å; M278-I321 HydrophobicContact SD-CG2 3.86Å; M278-V322 HydrophobicContact CG-CG2 3.75Å; M278-V322 HydrophobicContact SD-CG2 4.22Å
279	A	98.8	Very high	97.3	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-64.8	-51.4	174.5	0	0	0	0	0	111.5	V214 F218 F275 T276 L281 D282 P428	V214-A279 HydrophobicContact CG1-CB 4.22Å; V214-A279 HydrophobicContact CG2-CB 4.36Å; F218-A279 HydrophobicContact CE2-CB 4.34Å; F275-A279 WeakPolarHBondContact O-CB 3.33Å; F275-A279 PolarHBondContact O-N 2.66Å; T276-A279 PolarHBondContact O-N 3.23Å; A279-L281 PolarHBondContact O-N 2.96Å; A279-D282 WeakPolarHBondContact O-CB 3.25Å; A279-D282 PolarHBondContact O-N 3.35Å; A279-P428 HydrophobicContact CB-CG 4.27Å
280	M	98.6	Very high	96.5	Very high	14 Å²	14	18.2 Å²	18.2	7%	0.069	11%	0.106	C	C	.	.	H	α-helix	trans	-58.3	-36.3	177.9	-71.3	174.6	61.8	0	0	112.3	F210 T276 P428 W429 A451 H452	F210-M280 HydrophobicContact CZ-SD 4.46Å; T276-M280 HydrophobicContact CG2-CG 4.46Å; T276-M280 HydrophobicContact CG2-SD 3.75Å; T276-M280 WeakPolarHBondContact O-CG 3.11Å; T276-M280 PolarHBondContact O-N 3.26Å; M280-P428 HydrophobicContact CG-CG 3.84Å; M280-W429 PolarHBondContact SD-NE1 2.79Å; M280-W429 VanDerWaalsContact SD-NE1 3.4Å; M280-A451 WeakPolarHBondContact O-CB 3.44Å; M280-H452 HydrophobicContact CB-CB 4.17Å; M280-H452 WeakPolarHBondContact O-CB 3.28Å; M280-H452 PolarHBondContact O-N 2.94Å
281	L	98	Very high	95.8	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.005	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	27.2	-177.9	-54.6	178.8	0	0	0	112.9	M277 M278 A279 Y283 F289 M290 M293 P297	M277-L281 HydrophobicContact CE-CD1 4.06Å; M277-L281 VanDerWaalsContact O-CB 3.27Å; M277-L281 WeakPolarHBondContact O-CB 3.34Å; M277-L281 VanDerWaalsContact O-CG 3.29Å; M277-L281 WeakPolarHBondContact O-CG 3.3Å; M277-L281 PolarHBondContact O-N 2.9Å; M278-L281 CarbonylContact O-C 3.57Å; A279-L281 PolarHBondContact O-N 2.96Å; L281-Y283 HydrophobicContact CB-CD2 4.31Å; L281-Y283 HydrophobicContact CB-CE2 4.19Å; L281-Y283 HydrophobicContact CD2-CE2 3.69Å; L281-Y283 PolarHBondContact O-N 2.98Å; L281-F289 HydrophobicContact CD2-CD1 4.13Å; L281-M290 HydrophobicContact CD1-CB 4.32Å; L281-M293 HydrophobicContact CB-CG 4Å; L281-M293 HydrophobicContact CD1-CE 3.83Å; L281-M293 HydrophobicContact CD1-CG 3.71Å; L281-P297 WeakPolarHBondContact O-CG 3.47Å
282	D	98.6	Very high	95.5	Very high	13 Å²	13	23.5 Å²	23.5	7%	0.07	14%	0.141	C	C	.	.			trans	-72.8	53.7	-179.7	-158.7	36.8	0	0	0	113.5	M278 A279 N296 P297 V298 A451	M278-D282 PolarHBondContact O-N 2.04Å; M278-D282 VanDerWaalsContact O-N 3.09Å; A279-D282 WeakPolarHBondContact O-CB 3.25Å; A279-D282 PolarHBondContact O-N 3.35Å; D282-N296 VanDerWaalsContact OD1-C 3.22Å; D282-N296 WeakPolarHBondContact OD1-CA 3.42Å; D282-P297 HydrophobicContact CB-CG 4.47Å; D282-P297 WeakPolarHBondContact OD1-CD 3.41Å; D282-V298 HydrophobicContact CB-CG2 3.72Å; D282-V298 VanDerWaalsContact CG-CG2 3.4Å; D282-V298 WeakPolarHBondContact OD1-CB 3.36Å; D282-V298 PolarHBondContact OD1-N 3.47Å; D282-A451 HydrophobicContact CB-CB 4.08Å
283	Y	98.6	Very high	95.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.142	C	C	.	.			trans	-79.3	149.6	-178.2	-59.7	-54.7	0	0	0	111.6	L281 Y285 T287 N296 A451 H452 L454	L281-Y283 HydrophobicContact CB-CD2 4.31Å; L281-Y283 HydrophobicContact CB-CE2 4.19Å; L281-Y283 HydrophobicContact CD2-CE2 3.69Å; L281-Y283 PolarHBondContact O-N 2.98Å; Y283-Y285 PolarHBondContact O-N 2.85Å; Y283-T287 HydrophobicContact CD2-CG2 3.49Å; Y283-T287 VanDerWaalsContact CD2-CG2 3.49Å; Y283-T287 HydrophobicContact CE2-CG2 4.18Å; Y283-T287 HydrophobicContact CG-CG2 4.12Å; Y283-N296 PolarHBondContact O-N 2.83Å; Y283-A451 HydrophobicContact CD1-CB 4.21Å; Y283-A451 HydrophobicContact CE1-CB 4.28Å; Y283-H452 WeakPolarHBondContact CE1-O 3.44Å; Y283-H452 PolarHBondContact OH-O 3.12Å; Y283-L454 HydrophobicContact CD1-CB 4.29Å; Y283-L454 HydrophobicContact CD1-CD1 3.73Å; Y283-L454 HydrophobicContact CD1-CG 4.47Å; Y283-L454 HydrophobicContact CE1-CB 4.09Å; Y283-L454 HydrophobicContact CE1-CD1 4.12Å
284	P	98.2	Very high	95.3	Very high	26 Å²	26	24.8 Å²	24.8	17%	0.169	15%	0.151	C	C	.	.	S	Bend	trans	-73.5	-0.3	-177.2	30.8	-36.5	0	0	0	114.1	S462	P284-S462 WeakPolarHBondContact CB-O 3.46Å; P284-S462 VanDerWaalsContact CG-O 3.3Å; P284-S462 WeakPolarHBondContact CG-O 3.38Å
285	Y	98.3	Very high	95.2	Very high	21 Å²	21	26.4 Å²	26.4	8%	0.082	16%	0.164	C	C	.	.	S	Bend	trans	-141.8	161.3	179.1	47	-99.3	0	0	0	110.2	Y283 T287 L454 R457 N460 D463	Y283-Y285 PolarHBondContact O-N 2.85Å; Y285-T287 HydrophobicContact CD2-CG2 3.77Å; Y285-T287 HydrophobicContact CE2-CG2 3.71Å; Y285-L454 HydrophobicContact CE1-CD1 4.34Å; Y285-L454 WeakPolarHBondContact OH-CD1 3.18Å; Y285-R457 WeakPolarHBondContact OH-CB 3.13Å; Y285-N460 HydrophobicContact CD1-CB 3.73Å; Y285-N460 WeakPolarHBondContact CD1-OD1 3.35Å; Y285-N460 HydrophobicContact CE1-CB 3.45Å; Y285-N460 VanDerWaalsContact CE1-CB 3.45Å; Y285-N460 HydrophobicContact CG-CB 4.47Å; Y285-D463 WeakPolarHBondContact CE1-OD1 3.26Å
286	S	96.9	Very high	95.2	Very high	86 Å²	86	29.5 Å²	29.5	60%	0.601	18%	0.181	S	C	*	.			trans	-66.2	142	178.7	-55.8	0	0	0	0	111.7	M293 A295	S286-M293 VanDerWaalsContact CA-O 3.28Å; S286-M293 WeakPolarHBondContact CA-O 3.42Å; S286-M293 WeakPolarHBondContact CB-O 3.36Å; S286-A295 PolarHBondContact OG-N 3.32Å
287	T	95.4	Very high	95.2	Very high	11 Å²	11	29.4 Å²	29.4	7%	0.067	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	155.7	-177.1	56	0	0	0	0	112.5	Y283 Y285 N292 M293	Y283-T287 HydrophobicContact CD2-CG2 3.49Å; Y283-T287 VanDerWaalsContact CD2-CG2 3.49Å; Y283-T287 HydrophobicContact CE2-CG2 4.18Å; Y283-T287 HydrophobicContact CG-CG2 4.12Å; Y285-T287 HydrophobicContact CD2-CG2 3.77Å; Y285-T287 HydrophobicContact CE2-CG2 3.71Å; T287-N292 WeakPolarHBondContact O-CA 3.29Å; T287-M293 PolarHBondContact N-O 3.5Å; T287-M293 PolarHBondContact O-N 3.13Å
288	S	91.2	Very high	95.2	Very high	63 Å²	63	28.3 Å²	28.3	44%	0.441	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	100.5	168.8	-160.9	0	0	0	0	108.1	N96 N292	N96-S288 PolarHBondContact ND2-O 3.29Å; N96-S288 PolarHBondContact OD1-O 3.44Å; S288-N292 WeakPolarHBondContact CB-OD1 3.21Å; S288-N292 PolarHBondContact OG-OD1 3.29Å
289	F	83.6	Confident	95.2	Very high	22 Å²	22	34.9 Å²	34.9	10%	0.096	20%	0.204	C	C	.	.	S	Bend	trans	-136.5	-90.7	179.5	-180	-143	0	0	0	108.9	E92 F93 N96 L281 G291 H453	E92-F289 HydrophobicContact CB-CD2 4.38Å; E92-F289 HydrophobicContact CB-CE2 4.19Å; F93-F289 HydrophobicContact CD1-CE2 4.04Å; F93-F289 HydrophobicContact CD1-CZ 4.04Å; F93-F289 HydrophobicContact CE1-CE2 4.2Å; F93-F289 HydrophobicContact CE1-CZ 4.02Å; N96-F289 HydrophobicContact CB-CD2 3.91Å; N96-F289 HydrophobicContact CB-CE2 4.25Å; N96-F289 HydrophobicContact CB-CG 4.28Å; N96-F289 WeakPolarHBondContact ND2-CD2 3.45Å; L281-F289 HydrophobicContact CD2-CD1 4.13Å; F289-G291 PolarHBondContact N-O 2.02Å; F289-G291 PolarHBondContact O-N 3.28Å; F289-G291 VanDerWaalsContact O-N 3.09Å; F289-H453 AromaticContact CE1-CE1 3.9Å; F289-H453 AromaticContact CE1-NE2 3.92Å
290	M	81.4	Confident	95.2	Very high	75 Å²	75	37.6 Å²	37.6	37%	0.369	22%	0.22	S	C	.	.	S	Bend	trans	-86	33.8	172.4	-52.9	-177.5	-164.6	0	0	112.3	M277 L281	M277-M290 HydrophobicContact CE-CB 3.43Å; M277-M290 VanDerWaalsContact CE-CB 3.43Å; M277-M290 HydrophobicContact CE-CG 4.31Å; M277-M290 HydrophobicContact CE-SD 3.92Å; L281-M290 HydrophobicContact CD1-CB 4.32Å
291	G	85.1	Confident	95.2	Very high	32 Å²	32	37 Å²	37	33%	0.33	22%	0.217	S	C	.	.	S	Bend	trans	126.3	163.7	-168.3	0	0	0	0	0	112.6	F289	F289-G291 PolarHBondContact N-O 2.02Å; F289-G291 PolarHBondContact O-N 3.28Å; F289-G291 VanDerWaalsContact O-N 3.09Å
292	N	92.4	Very high	95.2	Very high	80 Å²	80	37 Å²	37	43%	0.428	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	117.9	174.7	-66.6	-37.9	0	0	0	109.3	T287 S288	T287-N292 WeakPolarHBondContact O-CA 3.29Å; S288-N292 WeakPolarHBondContact CB-OD1 3.21Å; S288-N292 PolarHBondContact OG-OD1 3.29Å
293	M	95.3	Very high	95.2	Very high	7 Å²	7	38.7 Å²	38.7	3%	0.034	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	139.2	175.7	-66.9	-62	-175.2	0	0	110.5	M277 M278 L281 S286 T287 I321 V322	M277-M293 HydrophobicContact CB-CE 3.87Å; M278-M293 HydrophobicContact CG-CE 4.46Å; M278-M293 HydrophobicContact CG-SD 4.44Å; L281-M293 HydrophobicContact CB-CG 4Å; L281-M293 HydrophobicContact CD1-CE 3.83Å; L281-M293 HydrophobicContact CD1-CG 3.71Å; S286-M293 VanDerWaalsContact CA-O 3.28Å; S286-M293 WeakPolarHBondContact CA-O 3.42Å; S286-M293 WeakPolarHBondContact CB-O 3.36Å; T287-M293 PolarHBondContact N-O 3.5Å; T287-M293 PolarHBondContact O-N 3.13Å; M293-I321 HydrophobicContact SD-CG2 4.38Å; M293-V322 HydrophobicContact CE-CB 4.32Å; M293-V322 HydrophobicContact CE-CG1 4.1Å; M293-V322 HydrophobicContact CE-CG2 3.82Å
294	P	97.1	Very high	95.2	Very high	44 Å²	44	39.3 Å²	39.3	29%	0.286	24%	0.242	S	C	.	.			trans	-67.7	167.8	168.6	32.5	-35.9	0	0	0	110.4	N296 P297 V300 I321	P294-N296 PolarHBondContact O-N 2.71Å; P294-P297 HydrophobicContact CG-CB 4.22Å; P294-P297 VanDerWaalsContact O-CD 3.3Å; P294-P297 WeakPolarHBondContact O-CD 3.07Å; P294-V300 HydrophobicContact CB-CG2 4.34Å; P294-V300 HydrophobicContact CG-CB 4.34Å; P294-V300 HydrophobicContact CG-CG1 4.38Å; P294-V300 HydrophobicContact CG-CG2 4.04Å; P294-I321 HydrophobicContact CG-CG2 4.25Å
295	A	98.1	Very high	95.3	Very high	34 Å²	34	38.1 Å²	38.1	28%	0.281	23%	0.234	S	C	.	.	S	Bend	trans	-62.2	134.1	167.8	0	0	0	0	0	111.2	S286	S286-A295 PolarHBondContact OG-N 3.32Å
296	N	98.4	Very high	95.3	Very high	65 Å²	65	41 Å²	41	35%	0.348	25%	0.25	S	S	.	.	S	Bend	trans	53.7	56.9	179.9	-45.8	-95	0	0	0	111.9	D282 Y283 P294 V298 K299 V300	D282-N296 VanDerWaalsContact OD1-C 3.22Å; D282-N296 WeakPolarHBondContact OD1-CA 3.42Å; Y283-N296 PolarHBondContact O-N 2.83Å; P294-N296 PolarHBondContact O-N 2.71Å; N296-V298 PolarHBondContact O-N 3.47Å; N296-K299 HydrophobicContact CB-CB 4.05Å; N296-K299 WeakPolarHBondContact O-CB 3.31Å; N296-K299 PolarHBondContact O-N 2.96Å; N296-V300 PolarHBondContact O-N 2.91Å; N296-V300 VanDerWaalsContact O-N 3.11Å
297	P	98.5	Very high	95.2	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-57.6	-30.9	-174.4	25.9	-36.4	0	0	0	113.9	M278 L281 D282 P294 K299 V300 A301	M278-P297 HydrophobicContact CB-CB 4.18Å; M278-P297 HydrophobicContact CG-CB 4.13Å; M278-P297 WeakPolarHBondContact O-CG 3.35Å; L281-P297 WeakPolarHBondContact O-CG 3.47Å; D282-P297 HydrophobicContact CB-CG 4.47Å; D282-P297 WeakPolarHBondContact OD1-CD 3.41Å; P294-P297 HydrophobicContact CG-CB 4.22Å; P294-P297 VanDerWaalsContact O-CD 3.3Å; P294-P297 WeakPolarHBondContact O-CD 3.07Å; P297-K299 VanDerWaalsContact C-N 3.33Å; P297-K299 PolarHBondContact O-N 3.14Å; P297-V300 PolarHBondContact O-N 3.3Å; P297-A301 WeakPolarHBondContact O-CB 3.32Å; P297-A301 PolarHBondContact O-N 3.1Å
298	V	98.8	Very high	95.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.6	-40.9	175.7	179.1	0	0	0	0	110.5	D217 F218 I221 M278 D282 N296 A301 C302	D217-V298 HydrophobicContact CB-CG1 4.48Å; F218-V298 HydrophobicContact CB-CG1 4.42Å; F218-V298 HydrophobicContact CD1-CG1 3.86Å; F218-V298 HydrophobicContact CD2-CG1 3.83Å; F218-V298 HydrophobicContact CE1-CG1 3.97Å; F218-V298 HydrophobicContact CE2-CG1 3.97Å; F218-V298 HydrophobicContact CE2-CG2 4.01Å; F218-V298 HydrophobicContact CG-CG1 3.78Å; F218-V298 HydrophobicContact CZ-CB 4.39Å; F218-V298 HydrophobicContact CZ-CG1 4.02Å; F218-V298 HydrophobicContact CZ-CG2 4.06Å; I221-V298 HydrophobicContact CG1-CG1 3.79Å; M278-V298 HydrophobicContact CB-CG2 4.47Å; M278-V298 WeakPolarHBondContact O-CG2 3.35Å; D282-V298 HydrophobicContact CB-CG2 3.72Å; D282-V298 VanDerWaalsContact CG-CG2 3.4Å; D282-V298 WeakPolarHBondContact OD1-CB 3.36Å; D282-V298 PolarHBondContact OD1-N 3.47Å; N296-V298 PolarHBondContact O-N 3.47Å; V298-A301 PolarHBondContact O-N 2.96Å; V298-C302 PolarHBondContact O-N 2.87Å
299	K	98.6	Very high	95.2	Very high	138 Å²	138	50.8 Å²	50.8	60%	0.6	29%	0.288	S	S	*	.	H	α-helix	trans	-64.1	-40.9	174.1	-175.4	178.9	179.2	177.5	0	112.1	I221 N296 P297 A301 C302 G303	I221-K299 HydrophobicContact CD1-CB 4.35Å; N296-K299 HydrophobicContact CB-CB 4.05Å; N296-K299 WeakPolarHBondContact O-CB 3.31Å; N296-K299 PolarHBondContact O-N 2.96Å; P297-K299 VanDerWaalsContact C-N 3.33Å; P297-K299 PolarHBondContact O-N 3.14Å; K299-A301 VanDerWaalsContact C-N 3.35Å; K299-C302 PolarHBondContact O-N 3.15Å; K299-G303 PolarHBondContact O-N 3.44Å
300	V	98.6	Very high	95.9	Very high	58 Å²	58	53.8 Å²	53.8	35%	0.352	31%	0.305	S	S	.	.	H	α-helix	trans	-64.2	-41.7	176.4	178	0	0	0	0	111	P294 N296 P297 G303 T304 I321	P294-V300 HydrophobicContact CB-CG2 4.34Å; P294-V300 HydrophobicContact CG-CB 4.34Å; P294-V300 HydrophobicContact CG-CG1 4.38Å; P294-V300 HydrophobicContact CG-CG2 4.04Å; N296-V300 PolarHBondContact O-N 2.91Å; N296-V300 VanDerWaalsContact O-N 3.11Å; P297-V300 PolarHBondContact O-N 3.3Å; V300-G303 PolarHBondContact O-N 3.25Å; V300-T304 WeakPolarHBondContact O-CB 3.25Å; V300-T304 PolarHBondContact O-N 2.84Å; V300-T304 PolarHBondContact O-OG1 3.09Å; V300-I321 HydrophobicContact CB-CD1 4.49Å; V300-I321 HydrophobicContact CG1-CD1 3.91Å
301	A	98.6	Very high	96.7	Very high	0 Å²	0	52 Å²	52	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-63.1	-46	176.2	0	0	0	0	0	111.8	F218 M278 P297 V298 K299 G303 T304 M305 T318 I321	F218-A301 HydrophobicContact CE1-CB 3.62Å; F218-A301 HydrophobicContact CZ-CB 4.4Å; M278-A301 HydrophobicContact CE-CB 3.82Å; M278-A301 HydrophobicContact SD-CB 3.65Å; P297-A301 WeakPolarHBondContact O-CB 3.32Å; P297-A301 PolarHBondContact O-N 3.1Å; V298-A301 PolarHBondContact O-N 2.96Å; K299-A301 VanDerWaalsContact C-N 3.35Å; A301-G303 PolarHBondContact O-N 2.03Å; A301-T304 CarbonylContact O-C 3.01Å; A301-T304 WeakPolarHBondContact O-CA 3.5Å; A301-T304 WeakPolarHBondContact O-CB 3.33Å; A301-T304 PolarHBondContact O-N 3.44Å; A301-M305 PolarHBondContact O-N 3.18Å; A301-T318 HydrophobicContact CB-CG2 3.81Å; A301-I321 HydrophobicContact CB-CD1 3.98Å
302	C	98.8	Very high	97.4	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.014	28%	0.284	C	S	.	.	H	α-helix	trans	-64.1	-39.5	175.7	-75.6	0	0	0	0	113.1	I221 C225 V298 K299 T304 M305 L306	I221-C302 HydrophobicContact CB-CB 4.35Å; I221-C302 HydrophobicContact CG2-CB 3.74Å; C225-C302 HydrophobicContact CB-CB 3.63Å; C225-C302 WeakPolarHBondContact CB-SG 3.45Å; C225-C302 WeakPolarHBondContact SG-CA 3.36Å; C225-C302 WeakPolarHBondContact SG-CB 3.13Å; C225-C302 CovalentContact SG-SG 2.05Å; C225-C302 PolarHBondContact SG-SG 3Å; V298-C302 PolarHBondContact O-N 2.87Å; K299-C302 PolarHBondContact O-N 3.15Å; C302-T304 PolarHBondContact O-N 3.1Å; C302-M305 PolarHBondContact O-N 2.89Å; C302-L306 WeakPolarHBondContact O-CB 3.3Å; C302-L306 VanDerWaalsContact O-CG 3.28Å; C302-L306 WeakPolarHBondContact O-CG 3.02Å; C302-L306 PolarHBondContact O-N 3.49Å; C302-L306 VanDerWaalsContact O-N 3.07Å
303	G	98.6	Very high	97.6	Very high	48 Å²	48	47.9 Å²	47.9	50%	0.495	27%	0.269	S	S	.	.	H	α-helix	trans	-60.4	-34.2	170.9	0	0	0	0	0	112.9	K299 V300 A301 R307	K299-G303 PolarHBondContact O-N 3.44Å; V300-G303 PolarHBondContact O-N 3.25Å; A301-G303 PolarHBondContact O-N 2.03Å; G303-R307 PolarHBondContact O-N 2.91Å
304	T	98.4	Very high	97.8	Very high	14 Å²	14	48.1 Å²	48.1	9%	0.086	27%	0.27	C	S	.	.	H	α-helix	trans	-72.2	-45	175.7	-64.5	0	0	0	0	112.1	V300 A301 C302 L306 R307 D317 T318	V300-T304 WeakPolarHBondContact O-CB 3.25Å; V300-T304 PolarHBondContact O-N 2.84Å; V300-T304 PolarHBondContact O-OG1 3.09Å; A301-T304 CarbonylContact O-C 3.01Å; A301-T304 WeakPolarHBondContact O-CA 3.5Å; A301-T304 WeakPolarHBondContact O-CB 3.33Å; A301-T304 PolarHBondContact O-N 3.44Å; C302-T304 PolarHBondContact O-N 3.1Å; T304-L306 PolarHBondContact O-N 3.33Å; T304-R307 VanDerWaalsContact CG2-NH2 3.26Å; T304-R307 WeakPolarHBondContact O-CB 3.42Å; T304-R307 PolarHBondContact O-N 3.45Å; T304-D317 HydrophobicContact CG2-CB 3.68Å; T304-T318 WeakPolarHBondContact CG2-OG1 3.23Å
305	M	98.6	Very high	97.9	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.6	-31.4	177	-75.9	-55.7	-53.8	0	0	113.3	A228 V229 A232 A301 C302 N314 L315 T318	A228-M305 HydrophobicContact CB-CB 4.4Å; A228-M305 HydrophobicContact CB-CE 4.03Å; V229-M305 HydrophobicContact CG2-CE 4.07Å; V229-M305 HydrophobicContact CG2-CG 3.97Å; V229-M305 HydrophobicContact CG2-SD 4.32Å; A232-M305 HydrophobicContact CB-CE 4.13Å; A301-M305 PolarHBondContact O-N 3.18Å; C302-M305 PolarHBondContact O-N 2.89Å; M305-N314 HydrophobicContact CE-CB 4.39Å; M305-N314 PolarHBondContact O-ND2 3.11Å; M305-N314 HydrophobicContact SD-CB 4.16Å; M305-L315 HydrophobicContact CE-CB 4.47Å; M305-L315 HydrophobicContact SD-CB 4.24Å; M305-L315 HydrophobicContact SD-CD1 4.31Å; M305-T318 HydrophobicContact CG-CG2 4.4Å; M305-T318 WeakPolarHBondContact CG-OG1 3Å; M305-T318 PolarHBondContact SD-OG1 2.86Å
306	L	98.3	Very high	97.9	Very high	81 Å²	81	47.5 Å²	47.5	42%	0.424	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	10.8	-175.5	-61.7	176.1	0	0	0	114.3	E224 C225 A228 C302 T304 G308	E224-L306 HydrophobicContact CB-CD2 4.05Å; C225-L306 HydrophobicContact CB-CD1 4.29Å; A228-L306 HydrophobicContact CB-CD2 4.11Å; C302-L306 WeakPolarHBondContact O-CB 3.3Å; C302-L306 VanDerWaalsContact O-CG 3.28Å; C302-L306 WeakPolarHBondContact O-CG 3.02Å; C302-L306 PolarHBondContact O-N 3.49Å; C302-L306 VanDerWaalsContact O-N 3.07Å; T304-L306 PolarHBondContact O-N 3.33Å; L306-G308 VanDerWaalsContact C-N 3.25Å; L306-G308 PolarHBondContact O-N 3.44Å
307	R	95.8	Very high	97.9	Very high	149 Å²	149	46.7 Å²	46.7	56%	0.562	25%	0.25	S	S	*	.	S	Bend	trans	-68.9	-17.9	-174.5	-161.3	-169.3	-55.6	158	1.4	114.4	G303 T304 D317	G303-R307 PolarHBondContact O-N 2.91Å; T304-R307 VanDerWaalsContact CG2-NH2 3.26Å; T304-R307 WeakPolarHBondContact O-CB 3.42Å; T304-R307 PolarHBondContact O-N 3.45Å; R307-D317 IonicContact CZ-OD2 3.33Å; R307-D317 IonicContact NH1-OD2 3.68Å; R307-D317 PolarHBondContact NH1-OD2 3.44Å; R307-D317 IonicContact NH2-OD2 3.68Å
308	G	93.1	Very high	97.9	Very high	39 Å²	39	46.7 Å²	46.7	40%	0.402	25%	0.25	S	S	.	.	S	Bend	trans	177.1	-168	-175.4	0	0	0	0	0	112.4	L306 N314	L306-G308 VanDerWaalsContact C-N 3.25Å; L306-G308 PolarHBondContact O-N 3.44Å; G308-N314 PolarHBondContact O-ND2 2.93Å
309	L	94.3	Very high	97.9	Very high	179 Å²	179	46.7 Å²	46.7	94%	0.937	25%	0.25	S	S	*	.	S	Bend	trans	-85.6	-12.5	-175.7	-60.1	177.8	0	0	0	114.2	L311	L309-L311 PolarHBondContact O-N 2.83Å; L309-L311 VanDerWaalsContact O-N 3.11Å
310	D	97.6	Very high	97.8	Very high	84 Å²	84	40.7 Å²	40.7	45%	0.449	23%	0.228	S	C	.	.			trans	-83.7	84.7	-179.2	-170.3	-14.9	0	0	0	111.2	L312 A313 N314	D310-L312 VanDerWaalsContact C-N 3.32Å; D310-L312 PolarHBondContact O-N 3.18Å; D310-L312 PolarHBondContact OD1-N 3.24Å; D310-A313 HydrophobicContact CB-CB 4.16Å; D310-A313 WeakPolarHBondContact OD1-CB 3.49Å; D310-A313 PolarHBondContact OD1-N 2.83Å; D310-A313 VanDerWaalsContact OD1-N 3.11Å; D310-A313 WeakPolarHBondContact OD2-CB 3.48Å; D310-N314 WeakPolarHBondContact O-CB 3.45Å; D310-N314 PolarHBondContact O-N 3.43Å; D310-N314 PolarHBondContact O-ND2 3.19Å; D310-N314 PolarHBondContact O-OD1 3.17Å
311	L	98.4	Very high	97.8	Very high	39 Å²	39	39 Å²	39	20%	0.204	22%	0.217	C	C	.	.	H	α-helix	trans	-65.8	-30.3	-175.4	-65.8	-176.1	0	0	0	113.6	A228 A232 L235 L309 L315	A228-L311 HydrophobicContact CB-CD2 3.92Å; A232-L311 HydrophobicContact CB-CB 3.92Å; A232-L311 WeakPolarHBondContact CB-O 3.29Å; L235-L311 HydrophobicContact CD1-CB 4.04Å; L235-L311 HydrophobicContact CD1-CD1 4.27Å; L309-L311 PolarHBondContact O-N 2.83Å; L309-L311 VanDerWaalsContact O-N 3.11Å; L311-L315 WeakPolarHBondContact O-CB 3.29Å; L311-L315 PolarHBondContact O-N 3.18Å
312	L	98.6	Very high	97.7	Very high	13 Å²	13	40.1 Å²	40.1	7%	0.068	22%	0.223	C	C	.	.	H	α-helix	trans	-74	-45.6	180	-66.4	-179.2	0	0	0	110.9	A232 L235 L236 L239 E251 F252 D310 N314 L315 R316	A232-L312 WeakPolarHBondContact O-CD2 3.47Å; L235-L312 HydrophobicContact CB-CD1 4.32Å; L235-L312 HydrophobicContact CB-CD2 3.8Å; L235-L312 HydrophobicContact CB-CG 4.1Å; L235-L312 HydrophobicContact CD1-CG 4.42Å; L236-L312 HydrophobicContact CB-CD2 4.1Å; L239-L312 HydrophobicContact CD1-CD1 3.61Å; E251-L312 HydrophobicContact CB-CB 4.28Å; E251-L312 HydrophobicContact CB-CD1 4.35Å; E251-L312 HydrophobicContact CG-CB 4.43Å; E251-L312 HydrophobicContact CG-CD1 3.89Å; F252-L312 HydrophobicContact CE2-CB 4.49Å; F252-L312 HydrophobicContact CE2-CD2 3.96Å; F252-L312 HydrophobicContact CZ-CD2 3.89Å; D310-L312 VanDerWaalsContact C-N 3.32Å; D310-L312 PolarHBondContact O-N 3.18Å; D310-L312 PolarHBondContact OD1-N 3.24Å; L312-N314 VanDerWaalsContact C-N 3.32Å; L312-N314 PolarHBondContact O-N 3.47Å; L312-L315 PolarHBondContact O-N 3.39Å; L312-R316 PolarHBondContact O-N 2.78Å
313	A	98.2	Very high	97.6	Very high	12 Å²	12	41.5 Å²	41.5	10%	0.099	23%	0.228	C	C	.	.	H	α-helix	trans	-61.5	-41.3	173.1	0	0	0	0	0	111.7	D310 L315 R316 D317	D310-A313 HydrophobicContact CB-CB 4.16Å; D310-A313 WeakPolarHBondContact OD1-CB 3.49Å; D310-A313 PolarHBondContact OD1-N 2.83Å; D310-A313 VanDerWaalsContact OD1-N 3.11Å; D310-A313 WeakPolarHBondContact OD2-CB 3.48Å; A313-L315 VanDerWaalsContact C-N 3.34Å; A313-L315 PolarHBondContact O-N 3.37Å; A313-R316 PolarHBondContact O-N 3.27Å; A313-D317 WeakPolarHBondContact O-CB 2.9Å; A313-D317 PolarHBondContact O-N 2.94Å
314	N	98.6	Very high	97.5	Very high	11 Å²	11	41 Å²	41	6%	0.059	21%	0.214	C	C	.	.	H	α-helix	trans	-64.3	-37.8	177.3	-66.3	-10.9	0	0	0	112.2	M305 G308 D310 L312 D317 T318	M305-N314 HydrophobicContact CE-CB 4.39Å; M305-N314 PolarHBondContact O-ND2 3.11Å; M305-N314 HydrophobicContact SD-CB 4.16Å; G308-N314 PolarHBondContact O-ND2 2.93Å; D310-N314 WeakPolarHBondContact O-CB 3.45Å; D310-N314 PolarHBondContact O-N 3.43Å; D310-N314 PolarHBondContact O-ND2 3.19Å; D310-N314 PolarHBondContact O-OD1 3.17Å; L312-N314 VanDerWaalsContact C-N 3.32Å; L312-N314 PolarHBondContact O-N 3.47Å; N314-D317 PolarHBondContact O-N 2.97Å; N314-T318 WeakPolarHBondContact O-CB 2.94Å; N314-T318 PolarHBondContact O-N 3.18Å; N314-T318 PolarHBondContact O-OG1 3.41Å
315	L	98.8	Very high	97.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-67.1	-41.9	175.8	-177.5	59.8	0	0	0	111.7	A232 F233 F252 L271 F275 M305 L311 L312 A313 T318 A319	A232-L315 HydrophobicContact CB-CB 3.83Å; A232-L315 HydrophobicContact CB-CD2 3.66Å; A232-L315 HydrophobicContact CB-CG 4.26Å; F233-L315 HydrophobicContact CD1-CD2 4.23Å; F233-L315 HydrophobicContact CD2-CD2 4.48Å; F233-L315 HydrophobicContact CE1-CD2 4.18Å; F233-L315 HydrophobicContact CE2-CD1 4.37Å; F233-L315 HydrophobicContact CE2-CD2 4.42Å; F233-L315 HydrophobicContact CG-CD2 4.39Å; F233-L315 HydrophobicContact CZ-CD1 4.45Å; F233-L315 HydrophobicContact CZ-CD2 4.27Å; F252-L315 HydrophobicContact CE1-CB 4.29Å; F252-L315 HydrophobicContact CE1-CD2 4Å; F252-L315 HydrophobicContact CE1-CG 4.04Å; F252-L315 HydrophobicContact CZ-CD2 4.07Å; L271-L315 HydrophobicContact CD1-CD2 3.98Å; L271-L315 HydrophobicContact CD1-CG 4.36Å; L271-L315 HydrophobicContact CD2-CG 4.32Å; F275-L315 HydrophobicContact CE2-CD1 3.61Å; F275-L315 HydrophobicContact CZ-CD1 3.67Å; M305-L315 HydrophobicContact CE-CB 4.47Å; M305-L315 HydrophobicContact SD-CB 4.24Å; M305-L315 HydrophobicContact SD-CD1 4.31Å; L311-L315 WeakPolarHBondContact O-CB 3.29Å; L311-L315 PolarHBondContact O-N 3.18Å; L312-L315 PolarHBondContact O-N 3.39Å; A313-L315 VanDerWaalsContact C-N 3.34Å; A313-L315 PolarHBondContact O-N 3.37Å; L315-T318 PolarHBondContact O-N 3.16Å; L315-A319 PolarHBondContact O-N 3.17Å
316	R	98.4	Very high	96.6	Very high	65 Å²	65	47.6 Å²	47.6	25%	0.245	26%	0.257	C	S	.	.	H	α-helix	trans	-58.1	-51.1	171.7	177.8	-158.1	60.7	-142.2	1.7	111.2	E251 F252 L312 A313 T318 A319 G320 F332	E251-R316 WeakPolarHBondContact O-CD 3.47Å; E251-R316 PolarHBondContact O-NH1 3.34Å; F252-R316 HydrophobicContact CD1-CB 4.03Å; L312-R316 PolarHBondContact O-N 2.78Å; A313-R316 PolarHBondContact O-N 3.27Å; R316-T318 VanDerWaalsContact C-N 3.26Å; R316-T318 PolarHBondContact O-N 2.93Å; R316-A319 PolarHBondContact O-N 3.24Å; R316-G320 PolarHBondContact O-N 3.05Å; R316-F332 HydrophobicContact CG-CE2 4.01Å
317	D	98.3	Very high	96.3	Very high	48 Å²	48	46.4 Å²	46.4	26%	0.257	27%	0.265	S	S	.	.	H	α-helix	trans	-62.8	-36.3	-178.4	-75	11.5	0	0	0	111.3	T304 R307 A313 N314 G320 I321	T304-D317 HydrophobicContact CG2-CB 3.68Å; R307-D317 IonicContact CZ-OD2 3.33Å; R307-D317 IonicContact NH1-OD2 3.68Å; R307-D317 PolarHBondContact NH1-OD2 3.44Å; R307-D317 IonicContact NH2-OD2 3.68Å; A313-D317 WeakPolarHBondContact O-CB 2.9Å; A313-D317 PolarHBondContact O-N 2.94Å; N314-D317 PolarHBondContact O-N 2.97Å; D317-G320 WeakPolarHBondContact O-CA 3.47Å; D317-G320 PolarHBondContact O-N 3.21Å; D317-G320 VanDerWaalsContact O-N 3.14Å; D317-I321 PolarHBondContact O-N 3.16Å
318	T	98.6	Very high	96.1	Very high	0 Å²	0	46 Å²	46	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.5	-46.3	174.4	-62.2	0	0	0	0	111.4	F275 M278 A301 T304 M305 N314 L315 R316 G320 I321	F275-T318 HydrophobicContact CE1-CG2 4.06Å; F275-T318 HydrophobicContact CE2-CG2 4.49Å; F275-T318 HydrophobicContact CZ-CG2 3.82Å; M278-T318 HydrophobicContact CE-CG2 3.69Å; A301-T318 HydrophobicContact CB-CG2 3.81Å; T304-T318 WeakPolarHBondContact CG2-OG1 3.23Å; M305-T318 HydrophobicContact CG-CG2 4.4Å; M305-T318 WeakPolarHBondContact CG-OG1 3Å; M305-T318 PolarHBondContact SD-OG1 2.86Å; N314-T318 WeakPolarHBondContact O-CB 2.94Å; N314-T318 PolarHBondContact O-N 3.18Å; N314-T318 PolarHBondContact O-OG1 3.41Å; L315-T318 PolarHBondContact O-N 3.16Å; R316-T318 VanDerWaalsContact C-N 3.26Å; R316-T318 PolarHBondContact O-N 2.93Å; T318-G320 PolarHBondContact O-N 3.3Å; T318-I321 WeakPolarHBondContact O-CB 3.25Å; T318-I321 WeakPolarHBondContact O-CG1 2.96Å; T318-I321 PolarHBondContact O-N 3.49Å; T318-I321 VanDerWaalsContact O-N 3.11Å
319	A	98.3	Very high	96.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61.8	-29.9	172.8	0	0	0	0	0	112.3	L271 A274 L315 R316 I321 V322 Y323 F332	L271-A319 HydrophobicContact CD2-CB 3.65Å; A274-A319 HydrophobicContact CB-CB 4.13Å; L315-A319 PolarHBondContact O-N 3.17Å; R316-A319 PolarHBondContact O-N 3.24Å; A319-I321 PolarHBondContact O-N 3.27Å; A319-V322 PolarHBondContact O-N 3.06Å; A319-V322 VanDerWaalsContact O-N 3.13Å; A319-Y323 HydrophobicContact CB-CD2 4.3Å; A319-Y323 VanDerWaalsContact O-CD2 3.32Å; A319-Y323 WeakPolarHBondContact O-CD2 3.47Å; A319-Y323 PolarHBondContact O-N 2.89Å; A319-F332 HydrophobicContact CB-CE2 4.27Å
320	G	97.7	Very high	96.2	Very high	13 Å²	13	45.3 Å²	45.3	13%	0.134	27%	0.266	C	S	.	.	H	α-helix	trans	-61.2	-24	173.8	0	0	0	0	0	114.7	R316 D317 T318 V322 N324 S325	R316-G320 PolarHBondContact O-N 3.05Å; D317-G320 WeakPolarHBondContact O-CA 3.47Å; D317-G320 PolarHBondContact O-N 3.21Å; D317-G320 VanDerWaalsContact O-N 3.14Å; T318-G320 PolarHBondContact O-N 3.3Å; G320-V322 PolarHBondContact O-N 2.72Å; G320-N324 CarbonylContact O-C 3.52Å; G320-N324 VanDerWaalsContact O-CA 3.27Å; G320-N324 WeakPolarHBondContact O-CA 3.4Å; G320-N324 PolarHBondContact O-N 3.4Å; G320-S325 PolarHBondContact O-N 2.9Å
321	I	97.5	Very high	96.2	Very high	22 Å²	22	43.2 Å²	43.2	11%	0.113	26%	0.257	C	S	.	.	H	α-helix	trans	-58.8	-38.5	173.5	-62.6	168.8	0	0	0	110.3	M278 M293 P294 V300 A301 D317 T318 A319	M278-I321 HydrophobicContact CG-CG2 4.45Å; M278-I321 HydrophobicContact SD-CB 3.93Å; M278-I321 HydrophobicContact SD-CD1 3.91Å; M278-I321 HydrophobicContact SD-CG2 3.86Å; M293-I321 HydrophobicContact SD-CG2 4.38Å; P294-I321 HydrophobicContact CG-CG2 4.25Å; V300-I321 HydrophobicContact CB-CD1 4.49Å; V300-I321 HydrophobicContact CG1-CD1 3.91Å; A301-I321 HydrophobicContact CB-CD1 3.98Å; D317-I321 PolarHBondContact O-N 3.16Å; T318-I321 WeakPolarHBondContact O-CB 3.25Å; T318-I321 WeakPolarHBondContact O-CG1 2.96Å; T318-I321 PolarHBondContact O-N 3.49Å; T318-I321 VanDerWaalsContact O-N 3.11Å; A319-I321 PolarHBondContact O-N 3.27Å
322	V	97	Very high	96.2	Very high	23 Å²	23	41.9 Å²	41.9	14%	0.139	25%	0.249	C	C	.	.	H	α-helix	trans	-87.6	-53.4	-179.8	-174.9	0	0	0	0	110.8	A274 M277 M278 M293 A319 G320	A274-V322 HydrophobicContact CB-CB 4.33Å; A274-V322 HydrophobicContact CB-CG2 3.88Å; A274-V322 WeakPolarHBondContact O-CG2 3.36Å; M277-V322 HydrophobicContact CB-CG1 4.08Å; M277-V322 HydrophobicContact CB-CG2 4.26Å; M277-V322 HydrophobicContact CG-CG1 4.15Å; M278-V322 HydrophobicContact CG-CG2 3.75Å; M278-V322 HydrophobicContact SD-CG2 4.22Å; M293-V322 HydrophobicContact CE-CB 4.32Å; M293-V322 HydrophobicContact CE-CG1 4.1Å; M293-V322 HydrophobicContact CE-CG2 3.82Å; A319-V322 PolarHBondContact O-N 3.06Å; A319-V322 VanDerWaalsContact O-N 3.13Å; G320-V322 PolarHBondContact O-N 2.72Å
323	Y	96.4	Very high	96.1	Very high	31 Å²	31	44 Å²	44	12%	0.122	26%	0.261	C	S	.	.	H	α-helix	trans	-90.8	-16.3	-167.4	-61.2	-63.7	0	0	0	114.5	L270 N273 A274 A319 L329 L337	L270-Y323 HydrophobicContact CD1-CD1 4.2Å; L270-Y323 HydrophobicContact CD1-CD2 3.96Å; L270-Y323 HydrophobicContact CD1-CE1 3.72Å; L270-Y323 HydrophobicContact CD1-CE2 3.44Å; L270-Y323 VanDerWaalsContact CD1-CE2 3.44Å; L270-Y323 HydrophobicContact CD1-CG 4.3Å; L270-Y323 HydrophobicContact CG-CD2 4.28Å; L270-Y323 HydrophobicContact CG-CE2 3.77Å; L270-Y323 WeakPolarHBondContact O-CE2 3.28Å; L270-Y323 PolarHBondContact O-OH 3.27Å; N273-Y323 WeakPolarHBondContact CB-OH 3.48Å; N273-Y323 PolarHBondContact ND2-OH 2.98Å; A274-Y323 HydrophobicContact CB-CE2 3.9Å; A319-Y323 HydrophobicContact CB-CD2 4.3Å; A319-Y323 VanDerWaalsContact O-CD2 3.32Å; A319-Y323 WeakPolarHBondContact O-CD2 3.47Å; A319-Y323 PolarHBondContact O-N 2.89Å; Y323-L329 WeakPolarHBondContact O-CD1 3.49Å; Y323-L337 HydrophobicContact CD1-CB 4.15Å; Y323-L337 HydrophobicContact CD1-CD2 4.26Å; Y323-L337 HydrophobicContact CE1-CB 4.43Å; Y323-L337 HydrophobicContact CG-CD1 4.45Å
324	N	95.8	Very high	96	Very high	38 Å²	38	44 Å²	44	20%	0.203	26%	0.26	C	S	.	.			trans	-134.5	38.9	-178	-162.1	16.8	0	0	0	112.4	G320 T326 G327 L328 L329 F332	G320-N324 CarbonylContact O-C 3.52Å; G320-N324 VanDerWaalsContact O-CA 3.27Å; G320-N324 WeakPolarHBondContact O-CA 3.4Å; G320-N324 PolarHBondContact O-N 3.4Å; N324-T326 PolarHBondContact O-N 3.5Å; N324-T326 VanDerWaalsContact O-N 3.11Å; N324-G327 PolarHBondContact O-N 3.04Å; N324-G327 VanDerWaalsContact OD1-CA 3.32Å; N324-G327 WeakPolarHBondContact OD1-CA 3.36Å; N324-G327 PolarHBondContact OD1-N 3.28Å; N324-L328 PolarHBondContact OD1-N 3.09Å; N324-L329 HydrophobicContact CB-CB 4.4Å; N324-L329 HydrophobicContact CB-CD1 4.48Å; N324-L329 PolarHBondContact ND2-O 3.42Å; N324-L329 WeakPolarHBondContact OD1-CB 3.39Å; N324-L329 PolarHBondContact OD1-N 3.1Å; N324-F332 HydrophobicContact CB-CE1 3.98Å; N324-F332 HydrophobicContact CB-CZ 4.48Å
325	S	91	Very high	95.8	Very high	61 Å²	61	49.3 Å²	49.3	43%	0.427	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-23.6	-179	57.2	0	0	0	0	113.9	G320	G320-S325 PolarHBondContact O-N 2.9Å
326	T	89	Confident	95.7	Very high	91 Å²	91	52.6 Å²	52.6	56%	0.558	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-15.5	174.6	62.6	0	0	0	0	113.7	N324 L328	N324-T326 PolarHBondContact O-N 3.5Å; N324-T326 VanDerWaalsContact O-N 3.11Å; T326-L328 PolarHBondContact O-N 2.75Å; T326-L328 PolarHBondContact OG1-N 2.73Å
327	G	91.3	Very high	95.5	Very high	56 Å²	56	51.3 Å²	51.3	58%	0.577	30%	0.3	S	S	*	.	S	Bend	trans	69.6	8.7	-172.6	0	0	0	0	0	114.7	N324	N324-G327 PolarHBondContact O-N 3.04Å; N324-G327 VanDerWaalsContact OD1-CA 3.32Å; N324-G327 WeakPolarHBondContact OD1-CA 3.36Å; N324-G327 PolarHBondContact OD1-N 3.28Å
328	L	92.2	Very high	95.5	Very high	141 Å²	141	49.7 Å²	49.7	74%	0.738	29%	0.29	S	S	*	.			trans	-85.3	-21.8	-176	-62.4	176.8	0	0	0	113.5	N324 T326 T330	N324-L328 PolarHBondContact OD1-N 3.09Å; T326-L328 PolarHBondContact O-N 2.75Å; T326-L328 PolarHBondContact OG1-N 2.73Å; L328-T330 PolarHBondContact O-N 2.57Å
329	L	94	Very high	95.3	Very high	71 Å²	71	52.5 Å²	52.5	37%	0.372	31%	0.308	S	S	.	.			trans	-73	125.5	176.8	-61.7	-176.9	0	0	0	109.8	Y323 N324 F332 L337	Y323-L329 WeakPolarHBondContact O-CD1 3.49Å; N324-L329 HydrophobicContact CB-CB 4.4Å; N324-L329 HydrophobicContact CB-CD1 4.48Å; N324-L329 PolarHBondContact ND2-O 3.42Å; N324-L329 WeakPolarHBondContact OD1-CB 3.39Å; N324-L329 PolarHBondContact OD1-N 3.1Å; L329-F332 HydrophobicContact CD1-CD1 4.43Å; L329-L337 HydrophobicContact CD1-CD1 4.45Å; L329-L337 HydrophobicContact CD1-CD2 4.19Å
330	T	95.1	Very high	95.1	Very high	133 Å²	133	56.6 Å²	56.6	82%	0.816	33%	0.327	S	S	*	.	S	Bend	trans	-87.9	-17.6	172.9	55.8	0	0	0	0	112.5	L328	L328-T330 PolarHBondContact O-N 2.57Å
331	C	97.6	Very high	95.1	Very high	39 Å²	39	56.6 Å²	56.6	26%	0.264	32%	0.324	S	S	.	.	S	Bend	trans	-153.7	160.5	175.8	63.4	0	0	0	0	112	A253 C255	A253-C331 CarbonylContact O-C 3.55Å; A253-C331 WeakPolarHBondContact O-CA 3.41Å; A253-C331 WeakPolarHBondContact O-CB 3.32Å; C255-C331 WeakPolarHBondContact CA-SG 3.44Å; C255-C331 HydrophobicContact CB-CB 3.96Å; C255-C331 WeakPolarHBondContact CB-SG 3.4Å; C255-C331 WeakPolarHBondContact SG-CB 3.3Å; C255-C331 CovalentContact SG-SG 2.04Å; C255-C331 PolarHBondContact SG-SG 3.04Å
332	F	97.9	Very high	95.1	Very high	11 Å²	11	55.5 Å²	55.5	5%	0.048	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-95.7	119.2	173.9	-65.2	-12.5	0	0	0	111.2	A253 L254 C255 R316 A319 N324 L329 L337	A253-F332 PolarHBondContact O-N 3.5Å; L254-F332 WeakPolarHBondContact CA-O 3.4Å; L254-F332 HydrophobicContact CD2-CB 4.04Å; C255-F332 PolarHBondContact N-O 3.3Å; R316-F332 HydrophobicContact CG-CE2 4.01Å; A319-F332 HydrophobicContact CB-CE2 4.27Å; N324-F332 HydrophobicContact CB-CE1 3.98Å; N324-F332 HydrophobicContact CB-CZ 4.48Å; L329-F332 HydrophobicContact CD1-CD1 4.43Å; F332-L337 HydrophobicContact CB-CD1 3.83Å; F332-L337 HydrophobicContact CD1-CD1 4.05Å; F332-L337 HydrophobicContact CG-CD1 4.06Å
333	D	97.1	Very high	95.2	Very high	59 Å²	59	54.6 Å²	54.6	32%	0.316	31%	0.313	S	S	.	.			trans	-93.1	104.1	169	-177.6	1.1	0	0	0	109.5	C255 Y335 S336 L337	C255-D333 HydrophobicContact CB-CB 4.41Å; D333-Y335 VanDerWaalsContact C-N 3.28Å; D333-Y335 PolarHBondContact O-N 3.42Å; D333-S336 VanDerWaalsContact CG-OG 3.29Å; D333-S336 PolarHBondContact O-N 3.3Å; D333-S336 VanDerWaalsContact O-N 3.17Å; D333-S336 WeakPolarHBondContact OD2-CB 3.22Å; D333-S336 PolarHBondContact OD2-OG 2.89Å; D333-L337 WeakPolarHBondContact O-CB 3.48Å; D333-L337 WeakPolarHBondContact O-CG 3.48Å; D333-L337 PolarHBondContact O-N 2.91Å
334	L	95.1	Very high	95.3	Very high	12 Å²	12	53.6 Å²	53.6	6%	0.063	31%	0.31	C	S	.	.	H	α-helix	trans	-53.6	-41.4	-170.5	-62.5	-175.7	0	0	0	114	L254 Q266 L267 L270 Y338	L254-L334 HydrophobicContact CD1-CD1 4.32Å; L254-L334 HydrophobicContact CD1-CD2 4.44Å; L254-L334 HydrophobicContact CD2-CD2 3.68Å; L254-L334 HydrophobicContact CD2-CG 4.35Å; Q266-L334 HydrophobicContact CG-CB 3.89Å; Q266-L334 HydrophobicContact CG-CD1 4.5Å; Q266-L334 PolarHBondContact NE2-O 2.75Å; Q266-L334 VanDerWaalsContact NE2-O 3.16Å; L267-L334 HydrophobicContact CB-CD1 4.23Å; L267-L334 HydrophobicContact CB-CD2 4.23Å; L267-L334 HydrophobicContact CD1-CD2 3.79Å; L270-L334 HydrophobicContact CD2-CD2 3.63Å; L334-Y338 PolarHBondContact O-N 2.86Å; L334-Y338 VanDerWaalsContact O-O 3.11Å
335	Y	95.2	Very high	95.4	Very high	122 Å²	122	52.2 Å²	52.2	48%	0.478	30%	0.304	S	S	.	.	H	α-helix	trans	-89	-18.3	-173.7	-68.1	-81.1	0	0	0	112.6	D263 Q266 D333	D263-Y335 WeakPolarHBondContact OD1-CE2 3.34Å; D263-Y335 PolarHBondContact OD1-OH 3.06Å; Q266-Y335 HydrophobicContact CB-CE1 4.35Å; Q266-Y335 HydrophobicContact CG-CD1 4.11Å; Q266-Y335 HydrophobicContact CG-CE1 3.8Å; Q266-Y335 HydrophobicContact CG-CE2 4.36Å; D333-Y335 VanDerWaalsContact C-N 3.28Å; D333-Y335 PolarHBondContact O-N 3.42Å
336	S	95.3	Very high	95.7	Very high	69 Å²	69	50.1 Å²	50.1	48%	0.483	29%	0.291	S	S	.	.	H	α-helix	trans	-85.8	-28	173.4	-62.3	0	0	0	0	112.1	D333 L349	D333-S336 VanDerWaalsContact CG-OG 3.29Å; D333-S336 PolarHBondContact O-N 3.3Å; D333-S336 VanDerWaalsContact O-N 3.17Å; D333-S336 WeakPolarHBondContact OD2-CB 3.22Å; D333-S336 PolarHBondContact OD2-OG 2.89Å; S336-L349 VanDerWaalsContact O-CD1 3.28Å; S336-L349 WeakPolarHBondContact O-CD1 3.45Å
337	L	96	Very high	96	Very high	37 Å²	37	46.5 Å²	46.5	19%	0.194	27%	0.27	C	S	.	.	H	α-helix	trans	-91.9	-24.4	-178.2	-68.6	175.4	0	0	0	114	L270 Y323 L329 F332 D333	L270-L337 HydrophobicContact CD1-CB 3.65Å; Y323-L337 HydrophobicContact CD1-CB 4.15Å; Y323-L337 HydrophobicContact CD1-CD2 4.26Å; Y323-L337 HydrophobicContact CE1-CB 4.43Å; Y323-L337 HydrophobicContact CG-CD1 4.45Å; L329-L337 HydrophobicContact CD1-CD1 4.45Å; L329-L337 HydrophobicContact CD1-CD2 4.19Å; F332-L337 HydrophobicContact CB-CD1 3.83Å; F332-L337 HydrophobicContact CD1-CD1 4.05Å; F332-L337 HydrophobicContact CG-CD1 4.06Å; D333-L337 WeakPolarHBondContact O-CB 3.48Å; D333-L337 WeakPolarHBondContact O-CG 3.48Å; D333-L337 PolarHBondContact O-N 2.91Å
338	Y	96.7	Very high	96.2	Very high	14 Å²	14	46 Å²	46	6%	0.055	26%	0.264	C	S	.	.			trans	-147.3	137.4	179.6	179.7	-104.3	0	0	0	110	Q266 L270 N273 L334 Q340	Q266-Y338 PolarHBondContact NE2-O 2.93Å; L270-Y338 HydrophobicContact CB-CG 4.48Å; L270-Y338 VanDerWaalsContact CD1-CB 3.48Å; L270-Y338 HydrophobicContact CD1-CG 4.48Å; N273-Y338 HydrophobicContact CB-CD2 3.86Å; N273-Y338 HydrophobicContact CB-CE2 3.64Å; N273-Y338 WeakPolarHBondContact OD1-CE2 3.43Å; L334-Y338 PolarHBondContact O-N 2.86Å; L334-Y338 VanDerWaalsContact O-O 3.11Å; Y338-Q340 HydrophobicContact CD1-CG 4.38Å; Y338-Q340 HydrophobicContact CE1-CG 3.69Å
339	V	94.8	Very high	96.3	Very high	60 Å²	60	43.7 Å²	43.7	36%	0.364	25%	0.252	S	S	.	.			trans	-120	119.1	176.4	177.1	0	0	0	0	107.6	C341 L349	V339-C341 PolarHBondContact O-N 2.92Å; V339-L349 HydrophobicContact CG2-CD2 3.79Å
340	Q	94.7	Very high	96.3	Very high	85 Å²	85	43 Å²	43	40%	0.397	26%	0.262	S	S	.	.			trans	-66.5	133.2	171.2	-78.4	-178.4	3.1	0	0	110.1	Q265 Y338	Q265-Q340 PolarHBondContact O-NE2 3.09Å; Y338-Q340 HydrophobicContact CD1-CG 4.38Å; Y338-Q340 HydrophobicContact CE1-CG 3.69Å
341	C	97.6	Very high	96.3	Very high	13 Å²	13	40.8 Å²	40.8	9%	0.088	25%	0.245	C	C	.	.			trans	-146.1	-175.3	-175.3	68	0	0	0	0	110.6	V339 D343 C347 D357	V339-C341 PolarHBondContact O-N 2.92Å; C341-D343 PolarHBondContact O-N 3.36Å; C341-D343 PolarHBondContact SG-N 3.2Å; C341-D343 PolarHBondContact SG-O 2.92Å; C341-D343 VanDerWaalsContact SG-O 3.35Å; C341-C347 HydrophobicContact CB-CB 3.84Å; C341-C347 WeakPolarHBondContact CB-SG 3.41Å; C341-C347 WeakPolarHBondContact SG-CB 3.36Å; C341-C347 PolarHBondContact SG-N 3.29Å; C341-C347 CovalentContact SG-SG 2.02Å; C341-C347 PolarHBondContact SG-SG 3.02Å; C341-D357 HydrophobicContact CB-CB 4.17Å; C341-D357 VanDerWaalsContact CB-OD1 3.29Å; C341-D357 WeakPolarHBondContact CB-OD1 3.48Å
342	A	98.3	Very high	96.3	Very high	0 Å²	0	41 Å²	41	0%	0	24%	0.243	C	C	.	.	S	Bend	trans	-71.7	-1.4	177	0	0	0	0	0	114.5	D357 A360 C361 F382 Y390	A342-D357 WeakPolarHBondContact CB-OD1 3.48Å; A342-D357 PolarHBondContact N-OD1 3.18Å; A342-A360 HydrophobicContact CB-CB 3.83Å; A342-C361 VanDerWaalsContact CB-SG 3.5Å; A342-F382 HydrophobicContact CB-CZ 4.39Å; A342-F382 VanDerWaalsContact O-CE1 3.29Å; A342-F382 WeakPolarHBondContact O-CE1 3.34Å; A342-Y390 HydrophobicContact CB-CD1 4.01Å; A342-Y390 HydrophobicContact CB-CE1 4.05Å
343	D	98.5	Very high	96.2	Very high	4 Å²	4	40.9 Å²	40.9	2%	0.021	24%	0.244	C	C	.	.			trans	-106.2	110	168	-174.8	-13.2	0	0	0	110.6	C341 T345 G346 W356 L366	C341-D343 PolarHBondContact O-N 3.36Å; C341-D343 PolarHBondContact SG-N 3.2Å; C341-D343 PolarHBondContact SG-O 2.92Å; C341-D343 VanDerWaalsContact SG-O 3.35Å; D343-T345 VanDerWaalsContact CG-OG1 3.23Å; D343-T345 PolarHBondContact O-N 3.46Å; D343-T345 VanDerWaalsContact O-N 3.15Å; D343-T345 WeakPolarHBondContact OD1-CA 3.16Å; D343-T345 VanDerWaalsContact OD1-CB 3.31Å; D343-T345 WeakPolarHBondContact OD1-CB 3.35Å; D343-T345 WeakPolarHBondContact OD1-CG2 3.3Å; D343-T345 PolarHBondContact OD1-N 3.22Å; D343-T345 PolarHBondContact OD1-OG1 2.86Å; D343-T345 PolarHBondContact OD2-OG1 2.78Å; D343-G346 PolarHBondContact O-N 3.3Å; D343-W356 PolarHBondContact OD2-NE1 3.47Å; D343-L366 HydrophobicContact CB-CD1 3.89Å; D343-L366 VanDerWaalsContact CG-CD1 3.48Å; D343-L366 WeakPolarHBondContact OD2-CD1 3.26Å
344	P	97.9	Very high	96.3	Very high	9 Å²	9	40.3 Å²	40.3	6%	0.058	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-17.6	177.5	-25.5	36.1	0	0	0	114.8	F211 R272 G346 L366 F368 F382	F211-P344 HydrophobicContact CE2-CB 4.3Å; F211-P344 HydrophobicContact CZ-CB 4.45Å; R272-P344 PolarHBondContact NH2-O 2.9Å; P344-G346 VanDerWaalsContact C-N 3.35Å; P344-L366 WeakPolarHBondContact CD-O 3.4Å; P344-L366 WeakPolarHBondContact CG-O 3.14Å; P344-F368 HydrophobicContact CB-CB 4.46Å; P344-F368 WeakPolarHBondContact CG-O 3.46Å; P344-F382 HydrophobicContact CG-CB 3.93Å; P344-F382 HydrophobicContact CG-CD1 3.42Å; P344-F382 VanDerWaalsContact CG-CD1 3.42Å; P344-F382 HydrophobicContact CG-CE1 4.18Å; P344-F382 HydrophobicContact CG-CG 3.89Å
345	T	97.7	Very high	96.4	Very high	10 Å²	10	39.8 Å²	39.8	6%	0.061	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-11.5	177.3	77.6	0	0	0	0	112.7	F210 N273 D343 F368 W429	F210-T345 HydrophobicContact CD1-CG2 3.72Å; F210-T345 HydrophobicContact CD2-CG2 4.42Å; F210-T345 HydrophobicContact CE1-CG2 3.44Å; F210-T345 VanDerWaalsContact CE1-CG2 3.44Å; F210-T345 HydrophobicContact CE2-CG2 4.2Å; F210-T345 HydrophobicContact CG-CG2 4.2Å; F210-T345 HydrophobicContact CZ-CG2 3.7Å; N273-T345 PolarHBondContact OD1-O 3.42Å; D343-T345 VanDerWaalsContact CG-OG1 3.23Å; D343-T345 PolarHBondContact O-N 3.46Å; D343-T345 VanDerWaalsContact O-N 3.15Å; D343-T345 WeakPolarHBondContact OD1-CA 3.16Å; D343-T345 VanDerWaalsContact OD1-CB 3.31Å; D343-T345 WeakPolarHBondContact OD1-CB 3.35Å; D343-T345 WeakPolarHBondContact OD1-CG2 3.3Å; D343-T345 PolarHBondContact OD1-N 3.22Å; D343-T345 PolarHBondContact OD1-OG1 2.86Å; D343-T345 PolarHBondContact OD2-OG1 2.78Å; T345-F368 HydrophobicContact CG2-CD2 4.18Å; T345-W429 HydrophobicContact CG2-CH2 3.82Å; T345-W429 HydrophobicContact CG2-CZ2 3.68Å; T345-W429 WeakPolarHBondContact OG1-CZ2 3.44Å
346	G	96.9	Very high	96.6	Very high	16 Å²	16	34.9 Å²	34.9	17%	0.165	22%	0.219	C	C	.	.			trans	105.6	130.6	173.9	0	0	0	0	0	113.5	D343 P344	D343-G346 PolarHBondContact O-N 3.3Å; P344-G346 VanDerWaalsContact C-N 3.35Å
347	C	97.1	Very high	96.8	Very high	16 Å²	16	31.8 Å²	31.8	11%	0.108	20%	0.197	C	C	.	.			trans	-86.7	-3.1	179.4	-63.4	0	0	0	0	114.6	C341 S353	C341-C347 HydrophobicContact CB-CB 3.84Å; C341-C347 WeakPolarHBondContact CB-SG 3.41Å; C341-C347 WeakPolarHBondContact SG-CB 3.36Å; C341-C347 PolarHBondContact SG-N 3.29Å; C341-C347 CovalentContact SG-SG 2.02Å; C341-C347 PolarHBondContact SG-SG 3.02Å; C347-S353 VanDerWaalsContact O-CA 3.31Å; C347-S353 WeakPolarHBondContact O-CA 3.41Å; C347-S353 WeakPolarHBondContact O-CB 3.35Å
348	G	94.6	Very high	96.9	Very high	45 Å²	45	31 Å²	31	46%	0.464	19%	0.191	S	C	.	.			trans	72.9	-153.3	-168.9	0	0	0	0	0	112.9	S353	G348-S353 VanDerWaalsContact C-CB 3.48Å; G348-S353 WeakPolarHBondContact O-CB 3.39Å
349	L	94.1	Very high	97	Very high	92 Å²	92	30.3 Å²	30.3	48%	0.482	19%	0.188	S	C	.	.	S	Bend	trans	-128.7	166.5	-172.5	-57.4	176	0	0	0	111.4	S336 V339	S336-L349 VanDerWaalsContact O-CD1 3.28Å; S336-L349 WeakPolarHBondContact O-CD1 3.45Å; V339-L349 HydrophobicContact CG2-CD2 3.79Å
350	G	94.4	Very high	97.2	Very high	56 Å²	56	27.4 Å²	27.4	58%	0.577	17%	0.171	S	C	*	.	H	α-helix	trans	80	-155.7	174.4	0	0	0	0	0	113.7	S353	G350-S353 PolarHBondContact O-OG 3.24Å
351	L	95.4	Very high	97.4	Very high	87 Å²	87	23.4 Å²	23.4	46%	0.455	15%	0.152	S	C	.	.	H	α-helix	trans	-76.4	-34.9	-176.7	-65.6	-179.6	0	0	0	112.5	F130 S353 L354 A355	F130-L351 HydrophobicContact CD2-CD2 3.92Å; F130-L351 HydrophobicContact CE2-CB 3.69Å; F130-L351 HydrophobicContact CE2-CD1 4.08Å; F130-L351 HydrophobicContact CE2-CD2 3.82Å; F130-L351 HydrophobicContact CE2-CG 4.05Å; F130-L351 HydrophobicContact CZ-CB 3.93Å; L351-S353 PolarHBondContact O-N 2.95Å; L351-L354 HydrophobicContact CD2-CD1 4.08Å; L351-L354 WeakPolarHBondContact O-CB 3.48Å; L351-L354 PolarHBondContact O-N 3.39Å; L351-A355 PolarHBondContact O-N 2.76Å
352	D	96.5	Very high	97.4	Very high	44 Å²	44	23.7 Å²	23.7	24%	0.235	15%	0.154	C	C	.	.	H	α-helix	trans	-61.3	-33.5	177.6	-66.3	-17.2	0	0	0	110.9	N89 Y119 G120 L354 A355 W356	N89-D352 PolarHBondContact N-OD2 3.42Å; Y119-D352 WeakPolarHBondContact CA-OD1 3.38Å; Y119-D352 HydrophobicContact CD1-CB 3.85Å; Y119-D352 HydrophobicContact CE1-CB 4.33Å; Y119-D352 WeakPolarHBondContact CE1-O 3.48Å; G120-D352 PolarHBondContact N-OD1 2.88Å; D352-L354 VanDerWaalsContact C-N 3.3Å; D352-L354 PolarHBondContact O-N 3.4Å; D352-A355 WeakPolarHBondContact O-CB 3.48Å; D352-A355 PolarHBondContact O-N 2.94Å; D352-W356 PolarHBondContact O-N 2.66Å
353	S	96.9	Very high	97.5	Very high	9 Å²	9	24.2 Å²	24.2	6%	0.063	16%	0.156	C	C	.	.	H	α-helix	trans	-68.1	-28.7	174.7	77.2	0	0	0	0	113.5	C347 G348 G350 L351 D357	C347-S353 VanDerWaalsContact O-CA 3.31Å; C347-S353 WeakPolarHBondContact O-CA 3.41Å; C347-S353 WeakPolarHBondContact O-CB 3.35Å; G348-S353 VanDerWaalsContact C-CB 3.48Å; G348-S353 WeakPolarHBondContact O-CB 3.39Å; G350-S353 PolarHBondContact O-OG 3.24Å; L351-S353 PolarHBondContact O-N 2.95Å; S353-D357 WeakPolarHBondContact O-CB 3.43Å; S353-D357 PolarHBondContact O-N 3.48Å
354	L	98	Very high	97.4	Very high	47 Å²	47	24 Å²	24	25%	0.246	16%	0.155	C	C	.	.	H	α-helix	trans	-70.9	-40.1	174.2	-59.6	-174	0	0	0	111.6	F130 L351 D352 Y358 R394 W395	F130-L354 HydrophobicContact CB-CD1 4.29Å; F130-L354 HydrophobicContact CD1-CB 3.84Å; F130-L354 HydrophobicContact CD2-CD1 4.44Å; F130-L354 HydrophobicContact CE1-CB 4.18Å; F130-L354 HydrophobicContact CG-CB 4.21Å; F130-L354 HydrophobicContact CG-CD1 4.18Å; L351-L354 HydrophobicContact CD2-CD1 4.08Å; L351-L354 WeakPolarHBondContact O-CB 3.48Å; L351-L354 PolarHBondContact O-N 3.39Å; D352-L354 VanDerWaalsContact C-N 3.3Å; D352-L354 PolarHBondContact O-N 3.4Å; L354-Y358 PolarHBondContact O-N 2.93Å; L354-Y358 VanDerWaalsContact O-N 3.07Å; L354-R394 VanDerWaalsContact CD2-NH2 3.35Å; L354-W395 HydrophobicContact CB-CH2 4.11Å; L354-W395 HydrophobicContact CB-CZ2 4.32Å; L354-W395 HydrophobicContact CD2-CZ2 4.48Å; L354-W395 WeakPolarHBondContact O-CZ2 3.47Å
355	A	98.5	Very high	97.4	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.2	-50.6	174.3	0	0	0	0	0	110.6	Y119 F130 L138 L351 D352 D357 Y358 Q359	Y119-A355 HydrophobicContact CD1-CB 3.89Å; Y119-A355 HydrophobicContact CD2-CB 4.35Å; Y119-A355 HydrophobicContact CE1-CB 3.35Å; Y119-A355 HydrophobicContact CE2-CB 3.89Å; Y119-A355 HydrophobicContact CG-CB 4.37Å; F130-A355 HydrophobicContact CE1-CB 3.86Å; L138-A355 HydrophobicContact CD2-CB 3.73Å; L138-A355 WeakPolarHBondContact CD2-O 3.29Å; L351-A355 PolarHBondContact O-N 2.76Å; D352-A355 WeakPolarHBondContact O-CB 3.48Å; D352-A355 PolarHBondContact O-N 2.94Å; A355-D357 PolarHBondContact O-N 2.6Å; A355-Y358 WeakPolarHBondContact O-CB 3.45Å; A355-Y358 PolarHBondContact O-N 3.11Å; A355-Q359 PolarHBondContact O-N 2.84Å
356	W	98.8	Very high	97.3	Very high	19 Å²	19	23.7 Å²	23.7	7%	0.072	15%	0.152	C	C	.	.	H	α-helix	trans	-63.9	-43.3	-179.1	-175.8	-117.2	0	0	0	112.3	E87 Y119 Y172 D343 D352 Y358 Q359 A360 V364 L366	E87-W356 HydrophobicContact CB-CB 4.38Å; E87-W356 HydrophobicContact CB-CD2 4.1Å; E87-W356 HydrophobicContact CB-CE3 3.66Å; E87-W356 HydrophobicContact CB-CG 4.42Å; E87-W356 HydrophobicContact CB-CZ3 4.28Å; E87-W356 HydrophobicContact CG-CD2 4.13Å; E87-W356 HydrophobicContact CG-CE3 4.02Å; E87-W356 HydrophobicContact CG-CG 4.49Å; E87-W356 HydrophobicContact CG-CZ3 4.44Å; Y119-W356 VanDerWaalsContact OH-CA 3.29Å; Y119-W356 WeakPolarHBondContact OH-CA 3.21Å; Y119-W356 PolarHBondContact OH-N 2.73Å; Y172-W356 HydrophobicContact CD1-CE3 4.45Å; Y172-W356 HydrophobicContact CD1-CH2 4.5Å; Y172-W356 AromaticContact CD1-CZ3 3.69Å; Y172-W356 HydrophobicContact CD1-CZ3 3.69Å; Y172-W356 HydrophobicContact CD2-CZ3 4.33Å; Y172-W356 HydrophobicContact CE1-CZ3 4.25Å; Y172-W356 HydrophobicContact CG-CH2 4.15Å; Y172-W356 AromaticContact CG-CZ3 3.76Å; Y172-W356 HydrophobicContact CG-CZ3 3.76Å; D343-W356 PolarHBondContact OD2-NE1 3.47Å; D352-W356 PolarHBondContact O-N 2.66Å; W356-Y358 VanDerWaalsContact C-N 3.28Å; W356-Y358 PolarHBondContact O-N 3.34Å; W356-Q359 HydrophobicContact CE3-CB 4.41Å; W356-Q359 PolarHBondContact O-N 3.07Å; W356-Q359 VanDerWaalsContact O-N 3.11Å; W356-A360 WeakPolarHBondContact O-CB 3.28Å; W356-A360 PolarHBondContact O-N 3.21Å; W356-V364 HydrophobicContact CH2-CG1 3.96Å; W356-V364 HydrophobicContact CH2-CG2 4.46Å; W356-V364 HydrophobicContact CZ2-CG1 4.33Å; W356-V364 HydrophobicContact CZ3-CG2 4.45Å; W356-L366 HydrophobicContact CZ2-CD1 3.75Å
357	D	98.8	Very high	97.2	Very high	4 Å²	4	24.5 Å²	24.5	2%	0.021	16%	0.155	C	C	.	.	H	α-helix	trans	-59.2	-39.2	175.6	-177.4	49	0	0	0	111.9	C341 A342 S353 A355 A360 C361 Y390 W395	C341-D357 HydrophobicContact CB-CB 4.17Å; C341-D357 VanDerWaalsContact CB-OD1 3.29Å; C341-D357 WeakPolarHBondContact CB-OD1 3.48Å; A342-D357 WeakPolarHBondContact CB-OD1 3.48Å; A342-D357 PolarHBondContact N-OD1 3.18Å; S353-D357 WeakPolarHBondContact O-CB 3.43Å; S353-D357 PolarHBondContact O-N 3.48Å; A355-D357 PolarHBondContact O-N 2.6Å; D357-A360 PolarHBondContact O-N 3.09Å; D357-C361 VanDerWaalsContact O-CB 3.25Å; D357-C361 WeakPolarHBondContact O-CB 3.38Å; D357-C361 PolarHBondContact O-N 3.37Å; D357-Y390 VanDerWaalsContact OD1-CE1 3.28Å; D357-Y390 WeakPolarHBondContact OD1-CE1 3.24Å; D357-Y390 PolarHBondContact OD1-OH 2.97Å; D357-Y390 PolarHBondContact OD2-OH 3.15Å; D357-Y390 VanDerWaalsContact OD2-OH 3.1Å; D357-W395 PolarHBondContact OD2-NE1 3.19Å
358	Y	98.8	Very high	97.2	Very high	20 Å²	20	24.1 Å²	24.1	8%	0.078	15%	0.152	C	C	.	.	H	α-helix	trans	-64.2	-43	174.5	-174.6	-97	0	0	0	112.4	V135 G136 L138 L354 A355 W356 C361 T362 W395 V397	V135-Y358 HydrophobicContact CB-CD2 4.4Å; V135-Y358 HydrophobicContact CB-CE2 4.38Å; V135-Y358 HydrophobicContact CG1-CD2 3.83Å; V135-Y358 HydrophobicContact CG1-CE2 3.51Å; V135-Y358 HydrophobicContact CG2-CD1 3.8Å; V135-Y358 HydrophobicContact CG2-CD2 3.67Å; V135-Y358 HydrophobicContact CG2-CE1 4.17Å; V135-Y358 HydrophobicContact CG2-CE2 4.07Å; V135-Y358 HydrophobicContact CG2-CG 3.52Å; V135-Y358 WeakPolarHBondContact O-CE1 3.23Å; G136-Y358 WeakPolarHBondContact CA-OH 3.24Å; L138-Y358 HydrophobicContact CB-CD1 4.01Å; L138-Y358 HydrophobicContact CB-CE1 4.28Å; L138-Y358 HydrophobicContact CD2-CD1 4.13Å; L138-Y358 HydrophobicContact CG-CD1 4.18Å; L354-Y358 PolarHBondContact O-N 2.93Å; L354-Y358 VanDerWaalsContact O-N 3.07Å; A355-Y358 WeakPolarHBondContact O-CB 3.45Å; A355-Y358 PolarHBondContact O-N 3.11Å; W356-Y358 VanDerWaalsContact C-N 3.28Å; W356-Y358 PolarHBondContact O-N 3.34Å; Y358-C361 CarbonylContact O-C 3.56Å; Y358-C361 WeakPolarHBondContact O-CA 3.44Å; Y358-C361 WeakPolarHBondContact O-CB 3.31Å; Y358-C361 PolarHBondContact O-N 2.82Å; Y358-C361 VanDerWaalsContact O-N 3.1Å; Y358-T362 HydrophobicContact CD1-CG2 4.3Å; Y358-T362 HydrophobicContact CE1-CG2 3.83Å; Y358-T362 HydrophobicContact CE2-CG2 4.16Å; Y358-T362 WeakPolarHBondContact O-CG2 3.19Å; Y358-T362 PolarHBondContact O-N 2.75Å; Y358-T362 VanDerWaalsContact O-N 3.15Å; Y358-T362 PolarHBondContact O-OG1 3.15Å; Y358-W395 HydrophobicContact CD2-CB 4.03Å; Y358-W395 AromaticContact CD2-CD2 3.76Å; Y358-W395 HydrophobicContact CD2-CD2 3.76Å; Y358-W395 AromaticContact CD2-CE3 3.99Å; Y358-W395 HydrophobicContact CD2-CE3 3.99Å; Y358-W395 AromaticContact CD2-CG 3.78Å; Y358-W395 HydrophobicContact CD2-CG 3.78Å; Y358-W395 HydrophobicContact CE2-CB 4.2Å; Y358-W395 HydrophobicContact CE2-CG 4.43Å; Y358-V397 HydrophobicContact CE2-CG1 3.96Å
359	Q	98.8	Very high	97.3	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-63.6	-43.8	175.8	-68.3	-167	-104.5	0	0	112	Y119 L138 Y172 A355 W356 C361 T362 E363 V364	Y119-Q359 PolarHBondContact OH-OE1 2.82Å; L138-Q359 HydrophobicContact CD1-CG 4.06Å; L138-Q359 HydrophobicContact CD2-CG 4.03Å; L138-Q359 HydrophobicContact CG-CG 3.76Å; Y172-Q359 PolarHBondContact OH-NE2 3.01Å; A355-Q359 PolarHBondContact O-N 2.84Å; W356-Q359 HydrophobicContact CE3-CB 4.41Å; W356-Q359 PolarHBondContact O-N 3.07Å; W356-Q359 VanDerWaalsContact O-N 3.11Å; Q359-C361 PolarHBondContact O-N 3.14Å; Q359-T362 WeakPolarHBondContact CA-OG1 3.34Å; Q359-T362 PolarHBondContact O-N 3.24Å; Q359-T362 VanDerWaalsContact O-N 3.14Å; Q359-T362 PolarHBondContact O-OG1 3.07Å; Q359-E363 PolarHBondContact O-N 3.18Å; Q359-V364 HydrophobicContact CB-CG2 4.16Å; Q359-V364 PolarHBondContact O-N 3.11Å
360	A	98.7	Very high	97.5	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-63.4	-24.9	172.7	0	0	0	0	0	112.2	A342 W356 D357 V364 L366 R387	A342-A360 HydrophobicContact CB-CB 3.83Å; W356-A360 WeakPolarHBondContact O-CB 3.28Å; W356-A360 PolarHBondContact O-N 3.21Å; D357-A360 PolarHBondContact O-N 3.09Å; A360-V364 WeakPolarHBondContact CA-O 3.48Å; A360-L366 HydrophobicContact CB-CD1 4.43Å; A360-R387 PolarHBondContact O-NE 3.43Å; A360-R387 PolarHBondContact O-NH2 3.15Å
361	C	98.8	Very high	97.7	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-4.9	174.7	-90.4	0	0	0	0	115.9	A342 D357 Y358 Q359 C391 V397 P399	A342-C361 VanDerWaalsContact CB-SG 3.5Å; D357-C361 VanDerWaalsContact O-CB 3.25Å; D357-C361 WeakPolarHBondContact O-CB 3.38Å; D357-C361 PolarHBondContact O-N 3.37Å; Y358-C361 CarbonylContact O-C 3.56Å; Y358-C361 WeakPolarHBondContact O-CA 3.44Å; Y358-C361 WeakPolarHBondContact O-CB 3.31Å; Y358-C361 PolarHBondContact O-N 2.82Å; Y358-C361 VanDerWaalsContact O-N 3.1Å; Q359-C361 PolarHBondContact O-N 3.14Å; C361-C391 WeakPolarHBondContact CA-SG 3.49Å; C361-C391 HydrophobicContact CB-CB 3.57Å; C361-C391 WeakPolarHBondContact CB-SG 3.38Å; C361-C391 WeakPolarHBondContact SG-CA 3.24Å; C361-C391 WeakPolarHBondContact SG-CB 3.48Å; C361-C391 CovalentContact SG-SG 2.03Å; C361-C391 PolarHBondContact SG-SG 2.78Å; C361-V397 HydrophobicContact CB-CG2 4.22Å; C361-P399 WeakPolarHBondContact O-CA 3.4Å; C361-P399 WeakPolarHBondContact O-CG 3.39Å
362	T	98.8	Very high	97.8	Very high	19 Å²	19	17.4 Å²	17.4	12%	0.117	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.3	-63.8	-173.9	47	0	0	0	0	111.8	Y358 Q359 V397 R400	Y358-T362 HydrophobicContact CD1-CG2 4.3Å; Y358-T362 HydrophobicContact CE1-CG2 3.83Å; Y358-T362 HydrophobicContact CE2-CG2 4.16Å; Y358-T362 WeakPolarHBondContact O-CG2 3.19Å; Y358-T362 PolarHBondContact O-N 2.75Å; Y358-T362 VanDerWaalsContact O-N 3.15Å; Y358-T362 PolarHBondContact O-OG1 3.15Å; Q359-T362 WeakPolarHBondContact CA-OG1 3.34Å; Q359-T362 PolarHBondContact O-N 3.24Å; Q359-T362 VanDerWaalsContact O-N 3.14Å; Q359-T362 PolarHBondContact O-OG1 3.07Å; T362-V397 HydrophobicContact CG2-CB 4.32Å; T362-V397 HydrophobicContact CG2-CG1 4.41Å; T362-V397 HydrophobicContact CG2-CG2 3.91Å; T362-R400 PolarHBondContact O-N 2.9Å; T362-R400 VanDerWaalsContact O-N 3.09Å
363	E	98.6	Very high	97.9	Very high	11 Å²	11	20.7 Å²	20.7	5%	0.051	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.5	-42.5	-168.4	-55.8	-170.7	134.5	0	0	113.3	T139 V140 E141 Q359 E365 W403 L404	T139-E363 WeakPolarHBondContact CA-OE2 3.39Å; T139-E363 WeakPolarHBondContact CB-OE2 3.31Å; V140-E363 WeakPolarHBondContact CG2-OE2 3.32Å; V140-E363 PolarHBondContact N-OE2 3.16Å; E141-E363 VanDerWaalsContact OE2-OE1 3.13Å; Q359-E363 PolarHBondContact O-N 3.18Å; E363-E365 PolarHBondContact O-N 3.29Å; E363-W403 PolarHBondContact OE1-NE1 3.03Å; E363-W403 VanDerWaalsContact OE1-NE1 3.14Å; E363-L404 HydrophobicContact CB-CD1 4.21Å
364	V	98.4	Very high	98	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.124	C	C	.	.			trans	-82.1	118.4	-174.2	-174.8	0	0	0	0	109.5	T201 W356 Q359 A360 L366 R387	T201-V364 HydrophobicContact CG2-CG1 3.93Å; W356-V364 HydrophobicContact CH2-CG1 3.96Å; W356-V364 HydrophobicContact CH2-CG2 4.46Å; W356-V364 HydrophobicContact CZ2-CG1 4.33Å; W356-V364 HydrophobicContact CZ3-CG2 4.45Å; Q359-V364 HydrophobicContact CB-CG2 4.16Å; Q359-V364 PolarHBondContact O-N 3.11Å; A360-V364 WeakPolarHBondContact CA-O 3.48Å; V364-L366 HydrophobicContact CG1-CD1 3.93Å; V364-L366 HydrophobicContact CG1-CG 4.02Å; V364-R387 PolarHBondContact O-NH2 2.93Å
365	E	97.2	Very high	98	Very high	12 Å²	12	20.3 Å²	20.3	6%	0.056	11%	0.112	C	C	.	.			trans	-94.2	113	-173.4	-52.8	-172.1	-136.1	0	0	112.1	T201 E363 P401 G402	T201-E365 WeakPolarHBondContact CA-O 3.02Å; T201-E365 WeakPolarHBondContact O-CB 3.21Å; T201-E365 PolarHBondContact O-N 3.46Å; E363-E365 PolarHBondContact O-N 3.29Å; E365-P401 WeakPolarHBondContact OE2-CA 3.36Å; E365-G402 PolarHBondContact OE1-N 2.8Å
366	L	94.9	Very high	98	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.005	11%	0.112	C	C	.	.			trans	-133.2	67.7	-175.3	-64	170.4	0	0	0	110.3	T201 D343 P344 W356 A360 V364 F368 F382 W429	T201-L366 HydrophobicContact CG2-CD2 4.01Å; D343-L366 HydrophobicContact CB-CD1 3.89Å; D343-L366 VanDerWaalsContact CG-CD1 3.48Å; D343-L366 WeakPolarHBondContact OD2-CD1 3.26Å; P344-L366 WeakPolarHBondContact CD-O 3.4Å; P344-L366 WeakPolarHBondContact CG-O 3.14Å; W356-L366 HydrophobicContact CZ2-CD1 3.75Å; A360-L366 HydrophobicContact CB-CD1 4.43Å; V364-L366 HydrophobicContact CG1-CD1 3.93Å; V364-L366 HydrophobicContact CG1-CG 4.02Å; L366-F368 HydrophobicContact CD2-CD2 4.41Å; L366-F368 HydrophobicContact CD2-CE2 3.84Å; L366-F368 PolarHBondContact O-N 3.42Å; L366-F382 WeakPolarHBondContact O-CD1 3.45Å; L366-W429 HydrophobicContact CD2-CH2 3.77Å; L366-W429 HydrophobicContact CD2-CZ3 3.85Å
367	C	94.8	Very high	98	Very high	33 Å²	33	19.4 Å²	19.4	22%	0.223	11%	0.109	C	C	.	.			trans	-97.7	50.5	178.6	-68.5	0	0	0	0	112.3	A207 F382	A207-C367 WeakPolarHBondContact CB-O 3.25Å; C367-F382 WeakPolarHBondContact CB-O 3.39Å
368	F	97.7	Very high	98	Very high	8 Å²	8	19.6 Å²	19.6	4%	0.035	11%	0.11	C	C	.	.			trans	-77.8	144.4	177	-64.5	-63.7	0	0	0	112.7	A207 F210 F211 P344 T345 L366 W429	A207-F368 CarbonylContact O-C 3.57Å; A207-F368 VanDerWaalsContact O-CA 3.27Å; A207-F368 WeakPolarHBondContact O-CA 3.49Å; A207-F368 WeakPolarHBondContact O-CD1 3.39Å; F210-F368 HydrophobicContact CB-CB 4.35Å; F210-F368 HydrophobicContact CB-CD1 3.63Å; F210-F368 HydrophobicContact CB-CD2 4.08Å; F210-F368 HydrophobicContact CB-CE1 3.81Å; F210-F368 HydrophobicContact CB-CE2 4.24Å; F210-F368 HydrophobicContact CB-CG 3.77Å; F210-F368 HydrophobicContact CB-CZ 4.1Å; F210-F368 HydrophobicContact CD2-CE2 4.49Å; F210-F368 HydrophobicContact CG-CD2 4.37Å; F210-F368 HydrophobicContact CG-CE2 4.47Å; F210-F368 HydrophobicContact CG-CG 4.48Å; F211-F368 HydrophobicContact CD2-CB 4.36Å; F211-F368 HydrophobicContact CE2-CB 4.02Å; P344-F368 HydrophobicContact CB-CB 4.46Å; P344-F368 WeakPolarHBondContact CG-O 3.46Å; T345-F368 HydrophobicContact CG2-CD2 4.18Å; L366-F368 HydrophobicContact CD2-CD2 4.41Å; L366-F368 HydrophobicContact CD2-CE2 3.84Å; L366-F368 PolarHBondContact O-N 3.42Å; F368-W429 HydrophobicContact CE2-CE3 4.41Å; F368-W429 AromaticContact CE2-CH2 3.86Å; F368-W429 HydrophobicContact CE2-CH2 3.86Å; F368-W429 AromaticContact CE2-CZ3 3.51Å; F368-W429 HydrophobicContact CE2-CZ3 3.51Å; F368-W429 HydrophobicContact CZ-CZ3 4.03Å
369	E	97.1	Very high	98	Very high	40 Å²	40	22.7 Å²	22.7	19%	0.187	13%	0.132	C	C	.	.			trans	-124.8	147	177.1	66.1	173.6	-169.9	0	0	112.3	A207 R208 F211	A207-E369 HydrophobicContact CB-CG 4.35Å; A207-E369 PolarHBondContact O-N 3.05Å; R208-E369 HydrophobicContact CG-CG 3.8Å; R208-E369 VanDerWaalsContact CG-OE1 3.29Å; R208-E369 WeakPolarHBondContact CG-OE1 3.46Å; R208-E369 IonicContact CZ-OE1 3.59Å; R208-E369 IonicContact NE-OE1 2.78Å; R208-E369 PolarHBondContact NE-OE1 3.46Å; R208-E369 IonicContact NH2-OE1 3.76Å; R208-E369 PolarHBondContact NH2-OE1 3.44Å; F211-E369 WeakPolarHBondContact CD2-O 3.42Å
370	S	98.7	Very high	97.9	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.007	14%	0.138	C	C	.	.	B	Isolated β-bridge	trans	-104.8	145.7	158.3	57.7	0	0	0	0	109.5	R272 D375 P378 P379 M380	R272-S370 PolarHBondContact NH1-OG 3.44Å; S370-D375 WeakPolarHBondContact CA-OD2 3.48Å; S370-D375 WeakPolarHBondContact CB-OD1 3.34Å; S370-P378 PolarHBondContact OG-O 3.3Å; S370-P379 CarbonylContact O-C 3.59Å; S370-P379 VanDerWaalsContact O-CA 3.3Å; S370-P379 WeakPolarHBondContact O-CA 3.34Å; S370-M380 PolarHBondContact N-O 2.84Å; S370-M380 PolarHBondContact O-N 2.99Å
371	N	98.2	Very high	97.8	Very high	28 Å²	28	26.9 Å²	26.9	15%	0.15	16%	0.163	C	C	.	.			trans	-137.1	1.1	-170.7	65.4	35.3	0	0	0	115	R208 V373 T374 D375	R208-N371 WeakPolarHBondContact CD-ND2 3.29Å; N371-V373 PolarHBondContact O-N 2.97Å; N371-V373 VanDerWaalsContact O-N 3.14Å; N371-V373 WeakPolarHBondContact OD1-CA 3.29Å; N371-V373 WeakPolarHBondContact OD1-CB 3.44Å; N371-V373 PolarHBondContact OD1-N 3.46Å; N371-T374 PolarHBondContact ND2-OG1 3.25Å; N371-T374 PolarHBondContact OD1-N 2.95Å; N371-T374 PolarHBondContact OD1-OG1 2.87Å; N371-T374 VanDerWaalsContact OD1-OG1 3.06Å; N371-D375 PolarHBondContact N-OD1 2.81Å; N371-D375 PolarHBondContact N-OD2 3.45Å; N371-D375 PolarHBondContact OD1-OD2 3.45Å
372	N	98	Very high	97.6	Very high	69 Å²	69	28.5 Å²	28.5	37%	0.369	17%	0.171	S	C	.	.	S	Bend	trans	55.2	26.4	-177	-167.1	24.2	0	0	0	113.8	R230 D375 F377 P379	R230-N372 PolarHBondContact NE-OD1 2.95Å; R230-N372 PolarHBondContact NH2-O 3.15Å; R230-N372 PolarHBondContact NH2-OD1 3.07Å; N372-D375 WeakPolarHBondContact CA-O 3.29Å; N372-D375 PolarHBondContact N-OD1 2.94Å; N372-F377 WeakPolarHBondContact CA-O 3.19Å; N372-F377 WeakPolarHBondContact CB-O 3.42Å; N372-F377 PolarHBondContact N-O 3.38Å; N372-F377 VanDerWaalsContact N-O 3.1Å; N372-P379 HydrophobicContact CB-CG 4.03Å
373	V	98.1	Very high	97.5	Very high	113 Å²	113	30.6 Å²	30.6	69%	0.685	18%	0.184	S	C	*	.	S	Bend	trans	-124.7	-62.3	173.6	179.1	0	0	0	0	108.3	N371 D375	N371-V373 PolarHBondContact O-N 2.97Å; N371-V373 VanDerWaalsContact O-N 3.14Å; N371-V373 WeakPolarHBondContact OD1-CA 3.29Å; N371-V373 WeakPolarHBondContact OD1-CB 3.44Å; N371-V373 PolarHBondContact OD1-N 3.46Å; V373-D375 VanDerWaalsContact C-N 3.31Å
374	T	98.3	Very high	97.4	Very high	48 Å²	48	35.8 Å²	35.8	29%	0.294	21%	0.208	S	C	.	.	S	Bend	trans	-81.2	-13	177	50.8	0	0	0	0	113.2	R212 N371	R212-T374 WeakPolarHBondContact CG-O 3.34Å; N371-T374 PolarHBondContact ND2-OG1 3.25Å; N371-T374 PolarHBondContact OD1-N 2.95Å; N371-T374 PolarHBondContact OD1-OG1 2.87Å; N371-T374 VanDerWaalsContact OD1-OG1 3.06Å
375	D	98.8	Very high	97.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.241	C	C	.	.	S	Bend	trans	-137	170	-177.5	60	81.8	0	0	0	111	F211 T215 R230 S370 N371 N372 V373 F377	F211-D375 HydrophobicContact CB-CB 4.19Å; F211-D375 WeakPolarHBondContact O-CB 3.29Å; T215-D375 VanDerWaalsContact OG1-CA 3.26Å; T215-D375 WeakPolarHBondContact OG1-CA 3.43Å; T215-D375 VanDerWaalsContact OG1-CB 3.31Å; T215-D375 WeakPolarHBondContact OG1-CB 3.19Å; R230-D375 PolarHBondContact NH2-O 3.31Å; S370-D375 WeakPolarHBondContact CA-OD2 3.48Å; S370-D375 WeakPolarHBondContact CB-OD1 3.34Å; N371-D375 PolarHBondContact N-OD1 2.81Å; N371-D375 PolarHBondContact N-OD2 3.45Å; N371-D375 PolarHBondContact OD1-OD2 3.45Å; N372-D375 WeakPolarHBondContact CA-O 3.29Å; N372-D375 PolarHBondContact N-OD1 2.94Å; V373-D375 VanDerWaalsContact C-N 3.31Å; D375-F377 HydrophobicContact CB-CD2 4.27Å; D375-F377 PolarHBondContact OD1-N 2.95Å; D375-F377 VanDerWaalsContact OD1-N 3.07Å
376	M	98.8	Very high	97.3	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.257	C	S	.	.	S	Bend	trans	-89.5	2.6	-177.9	67.4	-176.2	177	0	0	115	T215 F218 R226 V229 R230 F275	T215-M376 HydrophobicContact CG2-CB 3.78Å; T215-M376 HydrophobicContact CG2-CG 3.9Å; T215-M376 HydrophobicContact CG2-SD 4.18Å; T215-M376 PolarHBondContact OG1-N 2.89Å; F218-M376 HydrophobicContact CB-CE 3.93Å; F218-M376 HydrophobicContact CB-SD 4.27Å; F218-M376 HydrophobicContact CD1-CE 4.31Å; F218-M376 HydrophobicContact CD2-CE 3.8Å; F218-M376 HydrophobicContact CE2-CE 4.42Å; F218-M376 HydrophobicContact CG-CE 3.74Å; R226-M376 HydrophobicContact CB-SD 4.46Å; R226-M376 HydrophobicContact CG-CB 4.15Å; R226-M376 HydrophobicContact CG-SD 4.36Å; V229-M376 HydrophobicContact CB-CG 4.44Å; V229-M376 HydrophobicContact CB-SD 3.84Å; V229-M376 HydrophobicContact CG1-CB 4.33Å; V229-M376 HydrophobicContact CG1-CE 4.26Å; V229-M376 HydrophobicContact CG1-CG 3.87Å; V229-M376 HydrophobicContact CG1-SD 3.73Å; V229-M376 HydrophobicContact CG2-SD 4.11Å; R230-M376 HydrophobicContact CG-CB 3.7Å; F275-M376 HydrophobicContact CB-CE 4.38Å; F275-M376 HydrophobicContact CD1-CE 3.5Å; F275-M376 VanDerWaalsContact CD1-CE 3.5Å; F275-M376 HydrophobicContact CE1-CE 4.06Å; F275-M376 HydrophobicContact CG-CE 4.08Å
377	F	98.9	Very high	97.5	Very high	1 Å²	1	46.3 Å²	46.3	0%	0.004	26%	0.257	C	S	.	.	S	Bend	trans	-101.5	161.2	-171.7	-56.2	-67.9	0	0	0	112.1	F211 V214 F233 R272 F275 N372 D375	F211-F377 HydrophobicContact CB-CD2 4.08Å; F211-F377 HydrophobicContact CB-CE2 4.32Å; F211-F377 HydrophobicContact CD1-CD2 4.11Å; F211-F377 HydrophobicContact CD1-CE2 4.06Å; F211-F377 HydrophobicContact CG-CD2 4.41Å; V214-F377 HydrophobicContact CB-CE2 4.19Å; V214-F377 HydrophobicContact CB-CZ 4.5Å; V214-F377 HydrophobicContact CG1-CE2 3.85Å; V214-F377 HydrophobicContact CG1-CZ 3.66Å; F233-F377 AromaticContact CE2-CD1 3.8Å; F233-F377 HydrophobicContact CE2-CD1 3.8Å; F233-F377 HydrophobicContact CE2-CE1 4.4Å; F233-F377 HydrophobicContact CZ-CD1 4.25Å; R272-F377 HydrophobicContact CB-CD1 4.13Å; R272-F377 HydrophobicContact CB-CE1 4.49Å; R272-F377 HydrophobicContact CB-CG 4.49Å; R272-F377 HydrophobicContact CG-CB 4.3Å; R272-F377 HydrophobicContact CG-CD1 3.79Å; R272-F377 HydrophobicContact CG-CD2 4.07Å; R272-F377 HydrophobicContact CG-CE1 4.09Å; R272-F377 HydrophobicContact CG-CE2 4.34Å; R272-F377 HydrophobicContact CG-CG 3.78Å; R272-F377 HydrophobicContact CG-CZ 4.34Å; F275-F377 HydrophobicContact CB-CE1 3.71Å; F275-F377 HydrophobicContact CB-CZ 3.58Å; F275-F377 HydrophobicContact CD1-CE1 4.39Å; F275-F377 AromaticContact CD2-CE1 3.71Å; F275-F377 HydrophobicContact CD2-CE1 3.71Å; F275-F377 HydrophobicContact CD2-CZ 4.45Å; F275-F377 HydrophobicContact CE2-CE1 4.49Å; F275-F377 AromaticContact CG-CE1 3.68Å; F275-F377 HydrophobicContact CG-CE1 3.68Å; F275-F377 AromaticContact CG-CZ 4Å; F275-F377 HydrophobicContact CG-CZ 4Å; N372-F377 WeakPolarHBondContact CA-O 3.19Å; N372-F377 WeakPolarHBondContact CB-O 3.42Å; N372-F377 PolarHBondContact N-O 3.38Å; N372-F377 VanDerWaalsContact N-O 3.1Å; D375-F377 HydrophobicContact CB-CD2 4.27Å; D375-F377 PolarHBondContact OD1-N 2.95Å; D375-F377 VanDerWaalsContact OD1-N 3.07Å
378	P	98.6	Very high	97.7	Very high	8 Å²	8	49.9 Å²	49.9	5%	0.052	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-56	153.1	171.7	-25.2	35.2	0	0	0	112.6	F233 Y268 S370 M380	F233-P378 HydrophobicContact CB-CG 3.98Å; F233-P378 HydrophobicContact CD1-CG 3.33Å; F233-P378 HydrophobicContact CD2-CG 4.45Å; F233-P378 HydrophobicContact CE1-CG 3.84Å; F233-P378 HydrophobicContact CG-CG 3.69Å; Y268-P378 HydrophobicContact CD1-CB 4.3Å; Y268-P378 HydrophobicContact CD1-CG 3.62Å; Y268-P378 HydrophobicContact CD2-CB 3.93Å; Y268-P378 HydrophobicContact CD2-CG 4.17Å; Y268-P378 HydrophobicContact CE1-CB 4.39Å; Y268-P378 HydrophobicContact CE1-CG 3.8Å; Y268-P378 HydrophobicContact CE2-CB 4.07Å; Y268-P378 HydrophobicContact CE2-CG 4.35Å; Y268-P378 HydrophobicContact CG-CB 4.07Å; Y268-P378 HydrophobicContact CG-CG 3.82Å; S370-P378 PolarHBondContact OG-O 3.3Å; P378-M380 PolarHBondContact O-N 3.08Å; P378-M380 VanDerWaalsContact O-N 3.14Å
379	P	98.1	Very high	97.7	Very high	84 Å²	84	52.7 Å²	52.7	55%	0.545	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-62.3	116.9	172.5	-19.9	32.7	0	0	0	111.1	S370 N372	S370-P379 CarbonylContact O-C 3.59Å; S370-P379 VanDerWaalsContact O-CA 3.3Å; S370-P379 WeakPolarHBondContact O-CA 3.34Å; N372-P379 HydrophobicContact CB-CG 4.03Å
380	M	97.2	Very high	97.8	Very high	23 Å²	23	53.9 Å²	53.9	11%	0.113	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-140.9	87	177.3	-63.5	179.8	73.1	0	0	107.6	S370 P378	S370-M380 PolarHBondContact N-O 2.84Å; S370-M380 PolarHBondContact O-N 2.99Å; P378-M380 PolarHBondContact O-N 3.08Å; P378-M380 VanDerWaalsContact O-N 3.14Å
381	A	95.7	Very high	97.8	Very high	65 Å²	65	53.9 Å²	53.9	54%	0.537	30%	0.298	S	S	.	.			trans	-75.2	144.9	176.1	0	0	0	0	0	110.6
382	F	95.9	Very high	97.8	Very high	34 Å²	34	56 Å²	56	15%	0.149	32%	0.315	C	S	.	.			trans	-141	89.4	171.2	-171.9	-115.4	0	0	0	109.2	A342 P344 L366 C367 D386 R387	A342-F382 HydrophobicContact CB-CZ 4.39Å; A342-F382 VanDerWaalsContact O-CE1 3.29Å; A342-F382 WeakPolarHBondContact O-CE1 3.34Å; P344-F382 HydrophobicContact CG-CB 3.93Å; P344-F382 HydrophobicContact CG-CD1 3.42Å; P344-F382 VanDerWaalsContact CG-CD1 3.42Å; P344-F382 HydrophobicContact CG-CE1 4.18Å; P344-F382 HydrophobicContact CG-CG 3.89Å; L366-F382 WeakPolarHBondContact O-CD1 3.45Å; C367-F382 WeakPolarHBondContact CB-O 3.39Å; F382-D386 HydrophobicContact CD2-CB 3.99Å; F382-D386 HydrophobicContact CE2-CB 4.16Å; F382-R387 HydrophobicContact CE1-CB 3.88Å; F382-R387 HydrophobicContact CE1-CG 4.17Å; F382-R387 HydrophobicContact CE2-CB 4.43Å; F382-R387 HydrophobicContact CZ-CB 3.68Å; F382-R387 HydrophobicContact CZ-CG 4.08Å
383	T	96.2	Very high	97.8	Very high	64 Å²	64	61.9 Å²	61.9	39%	0.393	34%	0.337	S	S	.	.			trans	-83.7	166.4	-176.1	68.6	0	0	0	0	111.7	K385 D386 R387	T383-K385 PolarHBondContact O-N 2.87Å; T383-K385 PolarHBondContact OG1-N 2.79Å; T383-D386 WeakPolarHBondContact CB-OD2 3.43Å; T383-D386 PolarHBondContact N-OD2 3.43Å; T383-D386 PolarHBondContact O-N 3.38Å; T383-D386 VanDerWaalsContact OG1-CG 3.23Å; T383-D386 PolarHBondContact OG1-N 3.48Å; T383-D386 PolarHBondContact OG1-OD2 2.86Å; T383-R387 PolarHBondContact O-N 3.04Å
384	E	95.9	Very high	97.8	Very high	120 Å²	120	61.1 Å²	61.1	56%	0.561	32%	0.322	S	S	*	.	H	α-helix	trans	-54.3	-35.5	171.8	-69.2	178.5	-174.2	0	0	112.5	R387 E388	E384-R387 WeakPolarHBondContact O-CB 3.44Å; E384-R387 PolarHBondContact O-N 2.83Å; E384-E388 WeakPolarHBondContact O-CB 3.49Å; E384-E388 PolarHBondContact O-N 2.9Å
385	K	97.2	Very high	97.7	Very high	159 Å²	159	59.1 Å²	59.1	69%	0.691	31%	0.309	S	S	*	.	H	α-helix	trans	-69	-38.7	177.3	-175.2	178.9	178.2	-177.6	0	112.2	T383 R387 E388 A389	T383-K385 PolarHBondContact O-N 2.87Å; T383-K385 PolarHBondContact OG1-N 2.79Å; K385-R387 VanDerWaalsContact C-N 3.35Å; K385-E388 PolarHBondContact O-N 3.06Å; K385-A389 WeakPolarHBondContact O-CB 3.32Å; K385-A389 PolarHBondContact O-N 3.29Å
386	D	97.3	Very high	97.7	Very high	73 Å²	73	62.7 Å²	62.7	39%	0.39	34%	0.339	S	S	.	.	H	α-helix	trans	-66.3	-42.5	175.9	-57.5	-48.8	0	0	0	110.2	F382 T383 A389 Y390	F382-D386 HydrophobicContact CD2-CB 3.99Å; F382-D386 HydrophobicContact CE2-CB 4.16Å; T383-D386 WeakPolarHBondContact CB-OD2 3.43Å; T383-D386 PolarHBondContact N-OD2 3.43Å; T383-D386 PolarHBondContact O-N 3.38Å; T383-D386 VanDerWaalsContact OG1-CG 3.23Å; T383-D386 PolarHBondContact OG1-N 3.48Å; T383-D386 PolarHBondContact OG1-OD2 2.86Å; D386-A389 PolarHBondContact O-N 2.78Å; D386-Y390 WeakPolarHBondContact O-CB 3.25Å; D386-Y390 PolarHBondContact O-N 3.17Å
387	R	98.1	Very high	97.7	Very high	1 Å²	1	64.2 Å²	64.2	0%	0.004	35%	0.348	C	S	.	.	H	α-helix	trans	-58.7	-50.3	173	-175.1	-175.6	172.4	-154.9	-0	111.3	A360 V364 F382 T383 E384 K385 A389 Y390 C391 P399	A360-R387 PolarHBondContact O-NE 3.43Å; A360-R387 PolarHBondContact O-NH2 3.15Å; V364-R387 PolarHBondContact O-NH2 2.93Å; F382-R387 HydrophobicContact CE1-CB 3.88Å; F382-R387 HydrophobicContact CE1-CG 4.17Å; F382-R387 HydrophobicContact CE2-CB 4.43Å; F382-R387 HydrophobicContact CZ-CB 3.68Å; F382-R387 HydrophobicContact CZ-CG 4.08Å; T383-R387 PolarHBondContact O-N 3.04Å; E384-R387 WeakPolarHBondContact O-CB 3.44Å; E384-R387 PolarHBondContact O-N 2.83Å; K385-R387 VanDerWaalsContact C-N 3.35Å; R387-A389 PolarHBondContact O-N 3.26Å; R387-Y390 PolarHBondContact O-N 3.42Å; R387-C391 VanDerWaalsContact O-CB 3.27Å; R387-C391 WeakPolarHBondContact O-CB 3.48Å; R387-C391 PolarHBondContact O-N 3.03Å; R387-C391 PolarHBondContact O-SG 3.08Å; R387-P399 HydrophobicContact CG-CG 3.99Å
388	E	98.3	Very high	97.7	Very high	109 Å²	109	67.1 Å²	67.1	51%	0.509	37%	0.372	S	S	.	.	H	α-helix	trans	-57.2	-47.2	177.8	-174.6	-176.3	-174.5	0	0	111.8	E384 K385 Y390 C391 S392	E384-E388 WeakPolarHBondContact O-CB 3.49Å; E384-E388 PolarHBondContact O-N 2.9Å; K385-E388 PolarHBondContact O-N 3.06Å; E388-Y390 PolarHBondContact O-N 3.47Å; E388-C391 PolarHBondContact O-N 3.37Å; E388-S392 WeakPolarHBondContact O-CB 3.27Å; E388-S392 PolarHBondContact O-N 3.11Å
389	A	98.4	Very high	97.7	Very high	66 Å²	66	67.6 Å²	67.6	55%	0.545	38%	0.375	S	S	.	.	H	α-helix	trans	-63.2	-43.3	179	0	0	0	0	0	112.4	K385 D386 R387 K393	K385-A389 WeakPolarHBondContact O-CB 3.32Å; K385-A389 PolarHBondContact O-N 3.29Å; D386-A389 PolarHBondContact O-N 2.78Å; R387-A389 PolarHBondContact O-N 3.26Å; A389-K393 WeakPolarHBondContact O-CB 3.44Å; A389-K393 PolarHBondContact O-N 2.66Å
390	Y	98.3	Very high	97.6	Very high	66 Å²	66	71.4 Å²	71.4	26%	0.259	38%	0.379	S	S	.	.	H	α-helix	trans	-61.4	-52.6	175.9	175.1	-90.2	0	0	0	111.1	A342 D357 D386 R387 E388 S392 K393 R394	A342-Y390 HydrophobicContact CB-CD1 4.01Å; A342-Y390 HydrophobicContact CB-CE1 4.05Å; D357-Y390 VanDerWaalsContact OD1-CE1 3.28Å; D357-Y390 WeakPolarHBondContact OD1-CE1 3.24Å; D357-Y390 PolarHBondContact OD1-OH 2.97Å; D357-Y390 PolarHBondContact OD2-OH 3.15Å; D357-Y390 VanDerWaalsContact OD2-OH 3.1Å; D386-Y390 WeakPolarHBondContact O-CB 3.25Å; D386-Y390 PolarHBondContact O-N 3.17Å; R387-Y390 PolarHBondContact O-N 3.42Å; E388-Y390 PolarHBondContact O-N 3.47Å; Y390-S392 PolarHBondContact O-N 3.05Å; Y390-K393 PolarHBondContact O-N 2.99Å; Y390-R394 HydrophobicContact CD1-CB 4.47Å; Y390-R394 HydrophobicContact CE1-CB 4.07Å; Y390-R394 HydrophobicContact CE1-CG 4.19Å; Y390-R394 VanDerWaalsContact O-CB 3.32Å; Y390-R394 WeakPolarHBondContact O-CB 3.5Å; Y390-R394 PolarHBondContact O-N 3.44Å
391	C	98.7	Very high	97.6	Very high	0 Å²	0	73.4 Å²	73.4	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-68.2	-38	-174	-63	0	0	0	0	112.9	C361 R387 E388 K393 R394 W395 A396 V397 P399	C361-C391 WeakPolarHBondContact CA-SG 3.49Å; C361-C391 HydrophobicContact CB-CB 3.57Å; C361-C391 WeakPolarHBondContact CB-SG 3.38Å; C361-C391 WeakPolarHBondContact SG-CA 3.24Å; C361-C391 WeakPolarHBondContact SG-CB 3.48Å; C361-C391 CovalentContact SG-SG 2.03Å; C361-C391 PolarHBondContact SG-SG 2.78Å; R387-C391 VanDerWaalsContact O-CB 3.27Å; R387-C391 WeakPolarHBondContact O-CB 3.48Å; R387-C391 PolarHBondContact O-N 3.03Å; R387-C391 PolarHBondContact O-SG 3.08Å; E388-C391 PolarHBondContact O-N 3.37Å; C391-K393 VanDerWaalsContact C-N 3.31Å; C391-K393 PolarHBondContact O-N 2.93Å; C391-R394 PolarHBondContact O-N 3.47Å; C391-W395 PolarHBondContact O-N 2.8Å; C391-A396 PolarHBondContact O-N 2.92Å; C391-V397 CarbonylContact C-O 3.51Å; C391-V397 HydrophobicContact CB-CG2 4.26Å; C391-P399 HydrophobicContact CB-CG 3.9Å
392	S	98.4	Very high	97.6	Very high	72 Å²	72	71.3 Å²	71.3	50%	0.503	38%	0.378	S	S	.	.	H	α-helix	trans	-60.2	-43.5	172.9	-177.7	0	0	0	0	111	E388 Y390 A396 V397	E388-S392 WeakPolarHBondContact O-CB 3.27Å; E388-S392 PolarHBondContact O-N 3.11Å; Y390-S392 PolarHBondContact O-N 3.05Å; S392-A396 VanDerWaalsContact O-CA 3.25Å; S392-A396 WeakPolarHBondContact O-CA 3.5Å; S392-A396 PolarHBondContact O-N 2.93Å; S392-A396 VanDerWaalsContact O-N 3.15Å; S392-V397 VanDerWaalsContact CA-O 3.3Å; S392-V397 WeakPolarHBondContact CA-O 3.25Å; S392-V397 PolarHBondContact N-O 2.62Å
393	K	98.3	Very high	97.7	Very high	193 Å²	193	73.2 Å²	73.2	84%	0.839	38%	0.384	S	S	*	.	H	α-helix	trans	-71.2	-42.4	178.7	-175.9	-178.6	176.9	-173.5	0	112.8	A389 Y390 C391	A389-K393 WeakPolarHBondContact O-CB 3.44Å; A389-K393 PolarHBondContact O-N 2.66Å; Y390-K393 PolarHBondContact O-N 2.99Å; C391-K393 VanDerWaalsContact C-N 3.31Å; C391-K393 PolarHBondContact O-N 2.93Å
394	R	97.6	Very high	97.8	Very high	98 Å²	98	70.2 Å²	70.2	37%	0.37	37%	0.366	S	S	.	.	H	α-helix	trans	-81.9	-38	-170.7	178.8	60.9	-172.9	83.7	-1.4	113.2	L354 Y390 C391	L354-R394 VanDerWaalsContact CD2-NH2 3.35Å; Y390-R394 HydrophobicContact CD1-CB 4.47Å; Y390-R394 HydrophobicContact CE1-CB 4.07Å; Y390-R394 HydrophobicContact CE1-CG 4.19Å; Y390-R394 VanDerWaalsContact O-CB 3.32Å; Y390-R394 WeakPolarHBondContact O-CB 3.5Å; Y390-R394 PolarHBondContact O-N 3.44Å; C391-R394 PolarHBondContact O-N 3.47Å
395	W	98.3	Very high	97.8	Very high	5 Å²	5	67.9 Å²	67.9	2%	0.019	36%	0.355	C	S	.	.	H	α-helix	trans	-128.6	-0.9	-168.4	-65	118.5	0	0	0	113.7	F130 I132 V135 L354 D357 Y358 C391 V397	F130-W395 WeakPolarHBondContact O-CZ3 3.21Å; I132-W395 VanDerWaalsContact CD1-O 3.27Å; I132-W395 WeakPolarHBondContact CD1-O 3.47Å; V135-W395 HydrophobicContact CG1-CE3 4.41Å; L354-W395 HydrophobicContact CB-CH2 4.11Å; L354-W395 HydrophobicContact CB-CZ2 4.32Å; L354-W395 HydrophobicContact CD2-CZ2 4.48Å; L354-W395 WeakPolarHBondContact O-CZ2 3.47Å; D357-W395 PolarHBondContact OD2-NE1 3.19Å; Y358-W395 HydrophobicContact CD2-CB 4.03Å; Y358-W395 AromaticContact CD2-CD2 3.76Å; Y358-W395 HydrophobicContact CD2-CD2 3.76Å; Y358-W395 AromaticContact CD2-CE3 3.99Å; Y358-W395 HydrophobicContact CD2-CE3 3.99Å; Y358-W395 AromaticContact CD2-CG 3.78Å; Y358-W395 HydrophobicContact CD2-CG 3.78Å; Y358-W395 HydrophobicContact CE2-CB 4.2Å; Y358-W395 HydrophobicContact CE2-CG 4.43Å; C391-W395 PolarHBondContact O-N 2.8Å; W395-V397 HydrophobicContact CB-CG1 4.44Å; W395-V397 HydrophobicContact CB-CG2 3.84Å; W395-V397 PolarHBondContact O-N 3.37Å
396	A	98.3	Very high	97.8	Very high	76 Å²	76	66 Å²	66	63%	0.628	35%	0.351	S	S	*	.	S	Bend	trans	54.7	33.3	-174.5	0	0	0	0	0	113.3	I132 C391 S392	I132-A396 HydrophobicContact CD1-CB 3.98Å; C391-A396 PolarHBondContact O-N 2.92Å; S392-A396 VanDerWaalsContact O-CA 3.25Å; S392-A396 WeakPolarHBondContact O-CA 3.5Å; S392-A396 PolarHBondContact O-N 2.93Å; S392-A396 VanDerWaalsContact O-N 3.15Å
397	V	98.4	Very high	97.8	Very high	31 Å²	31	64.6 Å²	64.6	19%	0.188	34%	0.342	C	S	.	.			trans	-120.2	153.5	176.9	-58.8	0	0	0	0	111.1	Y358 C361 T362 C391 S392 W395	Y358-V397 HydrophobicContact CE2-CG1 3.96Å; C361-V397 HydrophobicContact CB-CG2 4.22Å; T362-V397 HydrophobicContact CG2-CB 4.32Å; T362-V397 HydrophobicContact CG2-CG1 4.41Å; T362-V397 HydrophobicContact CG2-CG2 3.91Å; C391-V397 CarbonylContact C-O 3.51Å; C391-V397 HydrophobicContact CB-CG2 4.26Å; S392-V397 VanDerWaalsContact CA-O 3.3Å; S392-V397 WeakPolarHBondContact CA-O 3.25Å; S392-V397 PolarHBondContact N-O 2.62Å; W395-V397 HydrophobicContact CB-CG1 4.44Å; W395-V397 HydrophobicContact CB-CG2 3.84Å; W395-V397 PolarHBondContact O-N 3.37Å
398	A	98.1	Very high	97.8	Very high	63 Å²	63	64.7 Å²	64.7	52%	0.521	34%	0.343	S	S	.	.			trans	-101.4	124.7	165.1	0	0	0	0	0	108.2
399	P	98.3	Very high	97.8	Very high	18 Å²	18	63.1 Å²	63.1	12%	0.117	33%	0.332	C	S	.	.			trans	-54.5	152.4	171.4	-21.3	30.4	0	0	0	111.2	C361 R387 C391 P401	C361-P399 WeakPolarHBondContact O-CA 3.4Å; C361-P399 WeakPolarHBondContact O-CG 3.39Å; R387-P399 HydrophobicContact CG-CG 3.99Å; C391-P399 HydrophobicContact CB-CG 3.9Å; P399-P401 VanDerWaalsContact C-CD 3.44Å; P399-P401 VanDerWaalsContact O-CD 3.29Å; P399-P401 WeakPolarHBondContact O-CD 3.4Å
400	R	97.8	Very high	97.6	Very high	163 Å²	163	60 Å²	60	62%	0.615	31%	0.307	S	S	*	.			trans	-117.4	75.4	177.5	-61.7	178.4	-175.9	164.2	2.7	111.3	T362 G402 W403	T362-R400 PolarHBondContact O-N 2.9Å; T362-R400 VanDerWaalsContact O-N 3.09Å; R400-G402 PolarHBondContact O-N 3.39Å; R400-W403 HydrophobicContact CB-CB 3.85Å; R400-W403 WeakPolarHBondContact O-CB 3.25Å; R400-W403 PolarHBondContact O-N 3.34Å
401	P	95.8	Very high	97.5	Very high	66 Å²	66	62 Å²	62	43%	0.429	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	138	175.1	-25.1	34.2	0	0	0	112.1	E365 P399 W403	E365-P401 WeakPolarHBondContact OE2-CA 3.36Å; P399-P401 VanDerWaalsContact C-CD 3.44Å; P399-P401 VanDerWaalsContact O-CD 3.29Å; P399-P401 WeakPolarHBondContact O-CD 3.4Å; P401-W403 VanDerWaalsContact C-N 3.29Å; P401-W403 PolarHBondContact O-N 3.27Å
402	G	96.6	Very high	97.4	Very high	20 Å²	20	64.8 Å²	64.8	21%	0.206	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	-9.9	-174.1	0	0	0	0	0	115.2	E365 R400 L404 Q405 I406	E365-G402 PolarHBondContact OE1-N 2.8Å; R400-G402 PolarHBondContact O-N 3.39Å; G402-L404 PolarHBondContact O-N 3.21Å; G402-Q405 WeakPolarHBondContact O-CB 3.35Å; G402-Q405 PolarHBondContact O-N 2.93Å; G402-I406 VanDerWaalsContact O-CG1 3.31Å; G402-I406 WeakPolarHBondContact O-CG1 3.33Å; G402-I406 PolarHBondContact O-N 3.18Å
403	W	98.1	Very high	97.3	Very high	74 Å²	74	61.5 Å²	61.5	28%	0.28	32%	0.322	S	S	.	.	H	α-helix	trans	-62.5	-44.6	-179.6	178.4	-114.2	0	0	0	112.2	E141 E363 R400 P401 Q405 I406 Q407	E141-W403 PolarHBondContact OE1-NE1 2.95Å; E141-W403 VanDerWaalsContact OE1-NE1 3.09Å; E363-W403 PolarHBondContact OE1-NE1 3.03Å; E363-W403 VanDerWaalsContact OE1-NE1 3.14Å; R400-W403 HydrophobicContact CB-CB 3.85Å; R400-W403 WeakPolarHBondContact O-CB 3.25Å; R400-W403 PolarHBondContact O-N 3.34Å; P401-W403 VanDerWaalsContact C-N 3.29Å; P401-W403 PolarHBondContact O-N 3.27Å; W403-Q405 VanDerWaalsContact C-N 3.28Å; W403-Q405 PolarHBondContact O-N 3.38Å; W403-I406 HydrophobicContact CE3-CG2 4.49Å; W403-I406 HydrophobicContact CZ3-CG2 4.44Å; W403-I406 PolarHBondContact O-N 3.18Å; W403-Q407 HydrophobicContact CD2-CG 3.93Å; W403-Q407 VanDerWaalsContact CE2-CG 3.48Å; W403-Q407 HydrophobicContact CE3-CG 4.34Å; W403-Q407 HydrophobicContact CH2-CG 4.09Å; W403-Q407 HydrophobicContact CZ2-CG 3.58Å; W403-Q407 HydrophobicContact CZ3-CG 4.41Å; W403-Q407 PolarHBondContact O-N 3.35Å
404	L	96.9	Very high	97.1	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-64	-36.5	178.9	-152.2	73.9	0	0	0	111.2	V140 M175 T201 E363 G402 Q407 F408	V140-L404 HydrophobicContact CG2-CD1 4.1Å; M175-L404 HydrophobicContact CE-CD2 4.08Å; T201-L404 VanDerWaalsContact O-CD2 3.23Å; T201-L404 WeakPolarHBondContact O-CD2 3.03Å; E363-L404 HydrophobicContact CB-CD1 4.21Å; G402-L404 PolarHBondContact O-N 3.21Å; L404-Q407 PolarHBondContact O-N 2.98Å; L404-F408 HydrophobicContact CD1-CD2 3.58Å; L404-F408 HydrophobicContact CD1-CE2 3.69Å; L404-F408 HydrophobicContact CG-CD2 3.89Å; L404-F408 HydrophobicContact CG-CE2 4.49Å; L404-F408 WeakPolarHBondContact O-CA 3.36Å; L404-F408 WeakPolarHBondContact O-CB 3.49Å; L404-F408 PolarHBondContact O-N 3.08Å
405	Q	96.9	Very high	97	Very high	72 Å²	72	58 Å²	58	34%	0.336	33%	0.333	S	S	.	.	H	α-helix	trans	-64.9	-44	173.3	-167	-174.4	10.5	0	0	111.9	A202 G402 W403 Q407 W409	A202-Q405 HydrophobicContact CB-CB 4.14Å; G402-Q405 WeakPolarHBondContact O-CB 3.35Å; G402-Q405 PolarHBondContact O-N 2.93Å; W403-Q405 VanDerWaalsContact C-N 3.28Å; W403-Q405 PolarHBondContact O-N 3.38Å; Q405-Q407 VanDerWaalsContact C-N 3.34Å; Q405-Q407 PolarHBondContact O-N 3.49Å; Q405-W409 CarbonylContact O-C 3.49Å; Q405-W409 WeakPolarHBondContact O-CA 3.33Å; Q405-W409 PolarHBondContact O-N 3.5Å
406	I	97.6	Very high	96.9	Very high	120 Å²	120	58.2 Å²	58.2	62%	0.615	34%	0.335	S	S	*	.	H	α-helix	trans	-60.6	-46.3	176.9	-70.1	166.7	0	0	0	110.2	G402 W403	G402-I406 VanDerWaalsContact O-CG1 3.31Å; G402-I406 WeakPolarHBondContact O-CG1 3.33Å; G402-I406 PolarHBondContact O-N 3.18Å; W403-I406 HydrophobicContact CE3-CG2 4.49Å; W403-I406 HydrophobicContact CZ3-CG2 4.44Å; W403-I406 PolarHBondContact O-N 3.18Å
407	Q	97.1	Very high	96.9	Very high	42 Å²	42	57.5 Å²	57.5	20%	0.196	32%	0.321	C	S	.	.	H	α-helix	trans	-74.4	-42.8	-175.8	-72.9	-59.9	-24.6	0	0	112.6	E141 K183 W403 L404 Q405	E141-Q407 WeakPolarHBondContact OE1-CG 3.4Å; K183-Q407 WeakPolarHBondContact CE-O 3.5Å; K183-Q407 PolarHBondContact NZ-O 2.98Å; W403-Q407 HydrophobicContact CD2-CG 3.93Å; W403-Q407 VanDerWaalsContact CE2-CG 3.48Å; W403-Q407 HydrophobicContact CE3-CG 4.34Å; W403-Q407 HydrophobicContact CH2-CG 4.09Å; W403-Q407 HydrophobicContact CZ2-CG 3.58Å; W403-Q407 HydrophobicContact CZ3-CG 4.41Å; W403-Q407 PolarHBondContact O-N 3.35Å; L404-Q407 PolarHBondContact O-N 2.98Å; Q405-Q407 VanDerWaalsContact C-N 3.34Å; Q405-Q407 PolarHBondContact O-N 3.49Å
408	F	98.2	Very high	96.9	Very high	4 Å²	4	57 Å²	57	2%	0.018	32%	0.317	C	S	.	.	H	α-helix	trans	-119.5	18.6	-167.6	-53.6	-68.1	0	0	0	114.1	V140 E141 L144 Y179 K183 L404 G410	V140-F408 HydrophobicContact CB-CE2 4.02Å; V140-F408 HydrophobicContact CB-CZ 4.13Å; V140-F408 HydrophobicContact CG1-CE1 4.38Å; V140-F408 HydrophobicContact CG1-CE2 3.62Å; V140-F408 HydrophobicContact CG1-CZ 3.51Å; E141-F408 HydrophobicContact CG-CZ 4.08Å; L144-F408 HydrophobicContact CD1-CD1 4.47Å; L144-F408 HydrophobicContact CD1-CE1 3.42Å; L144-F408 VanDerWaalsContact CD1-CE1 3.42Å; L144-F408 HydrophobicContact CD1-CZ 3.76Å; Y179-F408 HydrophobicContact CD1-CB 3.49Å; Y179-F408 VanDerWaalsContact CD1-CB 3.49Å; Y179-F408 AromaticContact CD1-CD1 3.74Å; Y179-F408 HydrophobicContact CD1-CD1 3.74Å; Y179-F408 AromaticContact CD1-CG 3.69Å; Y179-F408 HydrophobicContact CD1-CG 3.69Å; Y179-F408 HydrophobicContact CD2-CB 4.41Å; Y179-F408 AromaticContact CD2-CD1 3.84Å; Y179-F408 HydrophobicContact CD2-CD1 3.84Å; Y179-F408 HydrophobicContact CD2-CD2 4.02Å; Y179-F408 HydrophobicContact CD2-CE1 4.07Å; Y179-F408 HydrophobicContact CD2-CE2 4.23Å; Y179-F408 AromaticContact CD2-CG 3.81Å; Y179-F408 HydrophobicContact CD2-CG 3.81Å; Y179-F408 HydrophobicContact CD2-CZ 4.25Å; Y179-F408 HydrophobicContact CE1-CB 3.37Å; Y179-F408 HydrophobicContact CE1-CD1 4.38Å; Y179-F408 AromaticContact CE1-CG 3.86Å; Y179-F408 HydrophobicContact CE1-CG 3.86Å; Y179-F408 HydrophobicContact CE2-CB 4.29Å; Y179-F408 HydrophobicContact CE2-CD1 4.45Å; Y179-F408 AromaticContact CE2-CD2 3.91Å; Y179-F408 HydrophobicContact CE2-CD2 3.91Å; Y179-F408 HydrophobicContact CE2-CE2 4.36Å; Y179-F408 AromaticContact CE2-CG 3.95Å; Y179-F408 HydrophobicContact CE2-CG 3.95Å; Y179-F408 HydrophobicContact CG-CB 4.04Å; Y179-F408 AromaticContact CG-CD1 3.43Å; Y179-F408 HydrophobicContact CG-CD1 3.43Å; Y179-F408 VanDerWaalsContact CG-CD1 3.43Å; Y179-F408 HydrophobicContact CG-CD2 4.35Å; Y179-F408 AromaticContact CG-CE1 3.93Å; Y179-F408 HydrophobicContact CG-CE1 3.93Å; Y179-F408 AromaticContact CG-CG 3.67Å; Y179-F408 HydrophobicContact CG-CG 3.67Å; Y179-F408 AromaticContact CZ-CG 3.97Å; K183-F408 HydrophobicContact CG-CD1 4.39Å; K183-F408 HydrophobicContact CG-CE1 4.14Å; L404-F408 HydrophobicContact CD1-CD2 3.58Å; L404-F408 HydrophobicContact CD1-CE2 3.69Å; L404-F408 HydrophobicContact CG-CD2 3.89Å; L404-F408 HydrophobicContact CG-CE2 4.49Å; L404-F408 WeakPolarHBondContact O-CA 3.36Å; L404-F408 WeakPolarHBondContact O-CB 3.49Å; L404-F408 PolarHBondContact O-N 3.08Å; F408-G410 PolarHBondContact O-N 2.93Å
409	W	97.2	Very high	96.9	Very high	75 Å²	75	54 Å²	54	28%	0.284	29%	0.293	S	S	.	.			trans	73.7	-14.5	163.2	-43.7	-15.3	0	0	0	115.4	L182 Q405 D411 A412 L413 A416	L182-W409 HydrophobicContact CB-CE3 4.48Å; L182-W409 HydrophobicContact CB-CH2 3.85Å; L182-W409 HydrophobicContact CB-CZ2 3.98Å; L182-W409 HydrophobicContact CB-CZ3 4.15Å; L182-W409 HydrophobicContact CD1-CD2 3.86Å; L182-W409 HydrophobicContact CD1-CE3 3.79Å; L182-W409 HydrophobicContact CD1-CG 4.29Å; L182-W409 HydrophobicContact CD1-CZ3 4.23Å; L182-W409 HydrophobicContact CD2-CE3 3.85Å; L182-W409 HydrophobicContact CD2-CH2 4.08Å; L182-W409 HydrophobicContact CD2-CZ3 3.55Å; L182-W409 HydrophobicContact CG-CE3 4.22Å; L182-W409 HydrophobicContact CG-CH2 4.36Å; L182-W409 HydrophobicContact CG-CZ3 4.15Å; Q405-W409 CarbonylContact O-C 3.49Å; Q405-W409 WeakPolarHBondContact O-CA 3.33Å; Q405-W409 PolarHBondContact O-N 3.5Å; W409-D411 PolarHBondContact O-N 2.98Å; W409-D411 VanDerWaalsContact O-N 3.13Å; W409-A412 HydrophobicContact CB-CB 4.49Å; W409-A412 WeakPolarHBondContact O-CB 3.28Å; W409-A412 PolarHBondContact O-N 3.35Å; W409-L413 HydrophobicContact CB-CD2 4.33Å; W409-L413 HydrophobicContact CE3-CD2 4.31Å; W409-A416 HydrophobicContact CZ3-CB 4.1Å
410	G	95.6	Very high	97	Very high	2 Å²	2	53.1 Å²	53.1	2%	0.021	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	-116	-178.8	0	0	0	0	0	111.3	F408 L413	F408-G410 PolarHBondContact O-N 2.93Å; G410-L413 WeakPolarHBondContact O-CG 3.42Å
411	D	95.1	Very high	97	Very high	106 Å²	106	45.4 Å²	45.4	57%	0.567	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-8.5	177.7	62.5	-15.8	0	0	0	114.4	L199 L204 W409 L413	L199-D411 HydrophobicContact CD2-CB 3.99Å; L204-D411 HydrophobicContact CD1-CB 4.09Å; W409-D411 PolarHBondContact O-N 2.98Å; W409-D411 VanDerWaalsContact O-N 3.13Å; D411-L413 PolarHBondContact O-N 2.93Å
412	A	96.9	Very high	97.2	Very high	60 Å²	60	42.3 Å²	42.3	50%	0.496	24%	0.238	S	C	.	.			trans	-79.7	48.9	-177.8	0	0	0	0	0	113.5	W409 S414	W409-A412 HydrophobicContact CB-CB 4.49Å; W409-A412 WeakPolarHBondContact O-CB 3.28Å; W409-A412 PolarHBondContact O-N 3.35Å; A412-S414 VanDerWaalsContact C-N 3.35Å; A412-S414 PolarHBondContact O-N 3.04Å
413	L	96.7	Very high	97.3	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	23%	0.228	C	C	.	.			trans	-88.3	9.3	-171.2	-60.4	173.3	0	0	0	114.7	L182 I198 W409 G410 D411 T415 A416 F421 V434 L438 L442	L182-L413 HydrophobicContact CD1-CD2 4.08Å; L182-L413 HydrophobicContact CD2-CD2 4.39Å; I198-L413 HydrophobicContact CD1-CD1 3.74Å; W409-L413 HydrophobicContact CB-CD2 4.33Å; W409-L413 HydrophobicContact CE3-CD2 4.31Å; G410-L413 WeakPolarHBondContact O-CG 3.42Å; D411-L413 PolarHBondContact O-N 2.93Å; L413-T415 PolarHBondContact O-N 3.09Å; L413-A416 HydrophobicContact CB-CB 4.32Å; L413-A416 VanDerWaalsContact O-CB 3.26Å; L413-A416 WeakPolarHBondContact O-CB 3.42Å; L413-A416 PolarHBondContact O-N 2.81Å; L413-F421 HydrophobicContact CD1-CZ 3.97Å; L413-V434 HydrophobicContact CD1-CG2 4.17Å; L413-L438 HydrophobicContact CB-CD1 3.92Å; L413-L438 HydrophobicContact CD1-CD1 4.03Å; L413-L442 HydrophobicContact CB-CD1 4.38Å; L413-L442 WeakPolarHBondContact O-CD1 3.47Å
414	S	93.9	Very high	97.3	Very high	114 Å²	114	37.9 Å²	37.9	80%	0.797	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-25.3	-173.2	64.3	0	0	0	0	115.2	A412	A412-S414 VanDerWaalsContact C-N 3.35Å; A412-S414 PolarHBondContact O-N 3.04Å
415	T	94.3	Very high	97.3	Very high	104 Å²	104	41.2 Å²	41.2	64%	0.638	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-8.9	177.7	55.7	0	0	0	0	113.3	L413	L413-T415 PolarHBondContact O-N 3.09Å
416	A	97.2	Very high	97.4	Very high	9 Å²	9	39.7 Å²	39.7	7%	0.074	23%	0.226	C	C	.	.			trans	-72.7	159.7	175.5	0	0	0	0	0	111	L182 W409 L413 I419 L442	L182-A416 HydrophobicContact CD2-CB 3.47Å; L182-A416 VanDerWaalsContact CD2-CB 3.47Å; W409-A416 HydrophobicContact CZ3-CB 4.1Å; L413-A416 HydrophobicContact CB-CB 4.32Å; L413-A416 VanDerWaalsContact O-CB 3.26Å; L413-A416 WeakPolarHBondContact O-CB 3.42Å; L413-A416 PolarHBondContact O-N 2.81Å; A416-I419 HydrophobicContact CB-CD1 4.32Å; A416-L442 HydrophobicContact CB-CD1 4.08Å; A416-L442 HydrophobicContact CB-CD2 3.91Å; A416-L442 WeakPolarHBondContact O-CD1 3.38Å
417	N	97.6	Very high	97.5	Very high	61 Å²	61	34.1 Å²	34.1	33%	0.326	20%	0.198	S	C	.	.			trans	-158.7	159.2	176.6	60.8	83.4	0	0	0	111.6	R181 S441	R181-N417 WeakPolarHBondContact CG-O 3.4Å; R181-N417 PolarHBondContact NE-O 3.39Å; R181-N417 PolarHBondContact NH2-OD1 2.9Å; N417-S441 WeakPolarHBondContact CB-OG 3.48Å
418	N	98.6	Very high	97.5	Very high	21 Å²	21	32.1 Å²	32.1	11%	0.112	19%	0.189	C	C	.	.	S	Bend	trans	59.4	53.8	-179.5	-57.5	-5.7	0	0	0	113.1	A189 G190 A191 S441 W481	A189-N418 WeakPolarHBondContact O-CB 3.35Å; A189-N418 PolarHBondContact O-ND2 3.14Å; G190-N418 CarbonylContact C-O 3.1Å; G190-N418 WeakPolarHBondContact CA-O 3.11Å; A191-N418 PolarHBondContact N-O 3.25Å; N418-S441 CarbonylContact C-O 3.51Å; N418-S441 VanDerWaalsContact CA-O 3.25Å; N418-S441 WeakPolarHBondContact CA-O 3.48Å; N418-S441 PolarHBondContact N-O 3.48Å; N418-W481 VanDerWaalsContact CA-CZ2 3.44Å; N418-W481 HydrophobicContact CB-CD2 3.83Å; N418-W481 HydrophobicContact CB-CE3 4.28Å; N418-W481 HydrophobicContact CB-CG 4.17Å; N418-W481 HydrophobicContact CB-CH2 4.35Å; N418-W481 HydrophobicContact CB-CZ2 3.97Å; N418-W481 PolarHBondContact OD1-NE1 3.39Å
419	I	98.9	Very high	97.6	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	126.9	175.8	-51.3	178.1	0	0	0	108.3	V178 R181 L182 A191 A193 A416 F421 S441 L442 V443	V178-I419 HydrophobicContact CG1-CD1 4.09Å; V178-I419 HydrophobicContact CG2-CG2 4.13Å; R181-I419 HydrophobicContact CB-CD1 4.15Å; R181-I419 HydrophobicContact CB-CG1 4.13Å; R181-I419 HydrophobicContact CG-CD1 4.04Å; R181-I419 HydrophobicContact CG-CG1 3.74Å; L182-I419 HydrophobicContact CD2-CD1 3.84Å; A191-I419 HydrophobicContact CB-CG1 4.42Å; A191-I419 HydrophobicContact CB-CG2 4.33Å; A191-I419 WeakPolarHBondContact O-CA 3.5Å; A193-I419 HydrophobicContact CB-CG2 4.37Å; A416-I419 HydrophobicContact CB-CD1 4.32Å; I419-F421 HydrophobicContact CB-CE2 3.95Å; I419-F421 HydrophobicContact CB-CZ 4.05Å; I419-F421 HydrophobicContact CD1-CZ 4.41Å; I419-F421 HydrophobicContact CG2-CD1 4.22Å; I419-F421 HydrophobicContact CG2-CD2 4.14Å; I419-F421 HydrophobicContact CG2-CE1 3.78Å; I419-F421 HydrophobicContact CG2-CE2 3.68Å; I419-F421 HydrophobicContact CG2-CG 4.39Å; I419-F421 HydrophobicContact CG2-CZ 3.48Å; I419-F421 VanDerWaalsContact CG2-CZ 3.48Å; I419-S441 PolarHBondContact N-O 2.94Å; I419-L442 HydrophobicContact CB-CD2 3.79Å; I419-L442 HydrophobicContact CD1-CD2 4.09Å; I419-L442 HydrophobicContact CG1-CD2 3.96Å; I419-L442 WeakPolarHBondContact O-CA 3.46Å; I419-V443 PolarHBondContact O-N 2.63Å
420	I	98.9	Very high	97.6	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	129.1	165.3	-67.1	142.4	0	0	0	107.3	A191 L192 A193 V443 L445 E474 L477 I478 W481	A191-I420 PolarHBondContact O-N 2.83Å; L192-I420 HydrophobicContact CD1-CB 3.73Å; L192-I420 HydrophobicContact CD1-CD1 4.43Å; L192-I420 HydrophobicContact CD1-CG2 3.48Å; L192-I420 VanDerWaalsContact CD1-CG2 3.48Å; A193-I420 PolarHBondContact N-O 2.89Å; I420-V443 CarbonylContact C-O 3.52Å; I420-V443 WeakPolarHBondContact CA-O 3.36Å; I420-L445 HydrophobicContact CG2-CD1 3.64Å; I420-L445 HydrophobicContact CG2-CG 4.05Å; I420-E474 HydrophobicContact CD1-CG 4.4Å; I420-E474 HydrophobicContact CG2-CG 4.2Å; I420-L477 HydrophobicContact CD1-CB 3.92Å; I420-L477 HydrophobicContact CD1-CD1 3.94Å; I420-L477 HydrophobicContact CG1-CD1 3.76Å; I420-I478 HydrophobicContact CD1-CG1 4.29Å; I420-W481 HydrophobicContact CB-CH2 4.46Å; I420-W481 HydrophobicContact CD1-CH2 3.55Å; I420-W481 HydrophobicContact CD1-CZ2 4.4Å; I420-W481 HydrophobicContact CD1-CZ3 3.78Å; I420-W481 HydrophobicContact CG1-CH2 3.6Å; I420-W481 HydrophobicContact CG1-CZ2 4.32Å; I420-W481 HydrophobicContact CG1-CZ3 4.3Å
421	F	98.9	Very high	97.7	Very high	1 Å²	1	33.3 Å²	33.3	0%	0.004	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	98.8	169.3	-57.6	-85.6	0	0	0	108	V178 A193 I198 L413 I419 V434 L442 V443 A444 L445	V178-F421 HydrophobicContact CG1-CE1 4.34Å; V178-F421 HydrophobicContact CG2-CD1 4.24Å; V178-F421 HydrophobicContact CG2-CE1 3.56Å; V178-F421 HydrophobicContact CG2-CZ 4.37Å; A193-F421 HydrophobicContact CB-CD1 4.37Å; A193-F421 WeakPolarHBondContact O-CA 3.22Å; I198-F421 HydrophobicContact CD1-CE1 3.76Å; I198-F421 HydrophobicContact CD1-CZ 4.37Å; L413-F421 HydrophobicContact CD1-CZ 3.97Å; I419-F421 HydrophobicContact CB-CE2 3.95Å; I419-F421 HydrophobicContact CB-CZ 4.05Å; I419-F421 HydrophobicContact CD1-CZ 4.41Å; I419-F421 HydrophobicContact CG2-CD1 4.22Å; I419-F421 HydrophobicContact CG2-CD2 4.14Å; I419-F421 HydrophobicContact CG2-CE1 3.78Å; I419-F421 HydrophobicContact CG2-CE2 3.68Å; I419-F421 HydrophobicContact CG2-CG 4.39Å; I419-F421 HydrophobicContact CG2-CZ 3.48Å; I419-F421 VanDerWaalsContact CG2-CZ 3.48Å; F421-V434 HydrophobicContact CB-CB 4.03Å; F421-V434 HydrophobicContact CB-CG1 4.47Å; F421-V434 HydrophobicContact CD1-CB 3.93Å; F421-V434 HydrophobicContact CD1-CG2 4.1Å; F421-V434 HydrophobicContact CD2-CB 4.04Å; F421-V434 HydrophobicContact CD2-CG1 3.98Å; F421-V434 HydrophobicContact CE1-CB 4.36Å; F421-V434 HydrophobicContact CE1-CG2 4.06Å; F421-V434 HydrophobicContact CE2-CB 4.47Å; F421-V434 HydrophobicContact CE2-CG1 4.38Å; F421-V434 HydrophobicContact CG-CB 3.74Å; F421-V434 HydrophobicContact CG-CG1 4.17Å; F421-V434 HydrophobicContact CG-CG2 4.33Å; F421-V434 HydrophobicContact CZ-CG2 4.29Å; F421-L442 HydrophobicContact CE2-CB 4.5Å; F421-L442 HydrophobicContact CE2-CD2 4.26Å; F421-V443 PolarHBondContact N-O 3.19Å; F421-A444 CarbonylContact O-C 3.58Å; F421-A444 VanDerWaalsContact O-CA 3.26Å; F421-A444 WeakPolarHBondContact O-CA 3.2Å; F421-L445 PolarHBondContact O-N 3.24Å
422	S	98.9	Very high	97.9	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	139.6	174.5	51.1	0	0	0	0	109.9	A193 A194 S195 L445 D455 E474	A193-S422 PolarHBondContact O-N 3.12Å; A194-S422 VanDerWaalsContact CA-OG 3.22Å; A194-S422 WeakPolarHBondContact CA-OG 3.31Å; A194-S422 WeakPolarHBondContact CB-OG 3.41Å; S195-S422 WeakPolarHBondContact CA-O 3.44Å; S195-S422 PolarHBondContact N-O 2.77Å; S422-L445 CarbonylContact C-O 3.53Å; S422-L445 WeakPolarHBondContact CA-O 3.23Å; S422-D455 VanDerWaalsContact CB-OD2 3.3Å; S422-D455 WeakPolarHBondContact CB-OD2 3.5Å; S422-D455 PolarHBondContact OG-OD2 3.01Å; S422-E474 WeakPolarHBondContact CB-OE1 3.21Å
423	N	98.9	Very high	97.9	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	136.5	177.4	-72.5	-82.7	0	0	0	110.9	A430 V434 L445 N446 I447	N423-A430 HydrophobicContact CB-CB 3.93Å; N423-V434 PolarHBondContact ND2-O 3.44Å; N423-L445 PolarHBondContact N-O 3.03Å; N423-N446 CarbonylContact O-C 3.54Å; N423-N446 WeakPolarHBondContact O-CA 3.43Å; N423-I447 PolarHBondContact O-N 2.88Å
424	G	98.8	Very high	98	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	147	168.9	0	0	0	0	0	112.2	L426 A430 R435 G450	G424-L426 VanDerWaalsContact C-N 3.34Å; G424-A430 WeakPolarHBondContact O-CB 3.45Å; G424-R435 PolarHBondContact O-NH1 3.47Å; G424-G450 CarbonylContact C-O 3.54Å; G424-G450 VanDerWaalsContact C-O 3.24Å; G424-G450 WeakPolarHBondContact CA-O 3.48Å
425	D	97.5	Very high	98.2	Very high	71 Å²	71	23.5 Å²	23.5	38%	0.38	13%	0.128	S	C	.	.	S	Bend	trans	-78.5	-20.1	171.9	-71.7	-16.2	0	0	0	112.9	R435 I447 S448 G450	D425-R435 IonicContact OD1-CZ 2.78Å; D425-R435 IonicContact OD1-NH1 2.66Å; D425-R435 PolarHBondContact OD1-NH1 3.24Å; D425-R435 IonicContact OD1-NH2 3.44Å; D425-R435 PolarHBondContact OD1-NH2 3.41Å; D425-I447 PolarHBondContact N-O 3.48Å; D425-S448 WeakPolarHBondContact OD2-CA 3.46Å; D425-G450 PolarHBondContact N-O 3.49Å; D425-G450 VanDerWaalsContact N-O 3.09Å
426	L	98.6	Very high	98.3	Very high	40 Å²	40	26.7 Å²	26.7	21%	0.209	13%	0.132	C	C	.	.	S	Bend	trans	-95.5	6.3	175.6	-52.2	177.5	0	0	0	112.2	G424 G450 A451	G424-L426 VanDerWaalsContact C-N 3.34Å; L426-G450 WeakPolarHBondContact CB-O 3.27Å; L426-G450 PolarHBondContact N-O 3.38Å; L426-A451 HydrophobicContact CB-CB 4.37Å
427	D	98.8	Very high	98.4	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.021	15%	0.152	C	C	.	.			trans	-93.6	116.9	-179.1	179.4	13	0	0	0	110.1	S195 W429 A430 H452	S195-D427 WeakPolarHBondContact CB-OD2 3.28Å; S195-D427 PolarHBondContact OG-OD2 2.96Å; D427-W429 PolarHBondContact O-N 2.91Å; D427-W429 VanDerWaalsContact O-N 3.09Å; D427-W429 WeakPolarHBondContact OD1-CB 3.44Å; D427-W429 PolarHBondContact OD1-N 2.86Å; D427-A430 HydrophobicContact CB-CB 4.23Å; D427-A430 WeakPolarHBondContact O-CB 3.34Å; D427-A430 PolarHBondContact O-N 2.9Å; D427-H452 VanDerWaalsContact CG-ND1 3.25Å; D427-H452 IonicContact OD1-CG 2.86Å; D427-H452 IonicContact OD1-ND1 2.82Å; D427-H452 PolarHBondContact OD1-ND1 3.14Å; D427-H452 VanDerWaalsContact OD1-ND1 3.12Å; D427-H452 IonicContact OD2-CE1 3.85Å; D427-H452 IonicContact OD2-CG 3.68Å; D427-H452 IonicContact OD2-ND1 3.75Å; D427-H452 PolarHBondContact OD2-ND1 2.83Å
428	P	98.8	Very high	98.3	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-16	177.8	28.2	-37.1	0	0	0	113.1	Q209 F210 D213 V214 A279 M280	Q209-P428 PolarHBondContact NE2-O 2.65Å; F210-P428 HydrophobicContact CD2-CB 3.92Å; F210-P428 HydrophobicContact CD2-CG 4.48Å; F210-P428 WeakPolarHBondContact CD2-O 3.38Å; F210-P428 HydrophobicContact CE1-CB 4.43Å; F210-P428 HydrophobicContact CE2-CB 3.59Å; F210-P428 HydrophobicContact CE2-CG 3.66Å; F210-P428 HydrophobicContact CG-CB 4.45Å; F210-P428 HydrophobicContact CZ-CB 3.9Å; F210-P428 HydrophobicContact CZ-CG 3.7Å; D213-P428 HydrophobicContact CB-CB 4.37Å; V214-P428 HydrophobicContact CG2-CB 3.53Å; V214-P428 HydrophobicContact CG2-CG 3.85Å; A279-P428 HydrophobicContact CB-CG 4.27Å; M280-P428 HydrophobicContact CG-CG 3.84Å
429	W	98.8	Very high	98.3	Very high	14 Å²	14	32.4 Å²	32.4	5%	0.053	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-17.1	173.2	-68.8	105.2	0	0	0	114.2	P197 F210 M280 T345 L366 F368 D427 N431 G432 H452	P197-W429 HydrophobicContact CB-CB 4.42Å; P197-W429 HydrophobicContact CB-CD2 4.49Å; P197-W429 HydrophobicContact CB-CE3 3.66Å; P197-W429 HydrophobicContact CB-CZ3 4.32Å; P197-W429 HydrophobicContact CG-CD2 4.33Å; P197-W429 HydrophobicContact CG-CE3 3.7Å; P197-W429 HydrophobicContact CG-CZ3 4.18Å; F210-W429 AromaticContact CD2-CD2 3.97Å; F210-W429 HydrophobicContact CD2-CD2 3.97Å; F210-W429 HydrophobicContact CD2-CE3 4.09Å; F210-W429 HydrophobicContact CD2-CG 4.45Å; F210-W429 HydrophobicContact CD2-CZ2 4.4Å; F210-W429 HydrophobicContact CD2-CZ3 4.4Å; F210-W429 AromaticContact CE2-CD1 3.73Å; F210-W429 AromaticContact CE2-CD2 3.46Å; F210-W429 HydrophobicContact CE2-CD2 3.46Å; F210-W429 VanDerWaalsContact CE2-CD2 3.46Å; F210-W429 AromaticContact CE2-CE2 3.29Å; F210-W429 HydrophobicContact CE2-CE3 4.03Å; F210-W429 AromaticContact CE2-CG 3.77Å; F210-W429 HydrophobicContact CE2-CG 3.77Å; F210-W429 HydrophobicContact CE2-CH2 4.31Å; F210-W429 AromaticContact CE2-CZ2 3.76Å; F210-W429 HydrophobicContact CE2-CZ2 3.76Å; F210-W429 HydrophobicContact CE2-CZ3 4.45Å; F210-W429 AromaticContact CE2-NE1 3.45Å; F210-W429 HydrophobicContact CZ-CD2 4.45Å; F210-W429 AromaticContact CZ-CE2 3.87Å; F210-W429 HydrophobicContact CZ-CZ2 4.1Å; F210-W429 AromaticContact CZ-NE1 3.81Å; M280-W429 PolarHBondContact SD-NE1 2.79Å; M280-W429 VanDerWaalsContact SD-NE1 3.4Å; T345-W429 HydrophobicContact CG2-CH2 3.82Å; T345-W429 HydrophobicContact CG2-CZ2 3.68Å; T345-W429 WeakPolarHBondContact OG1-CZ2 3.44Å; L366-W429 HydrophobicContact CD2-CH2 3.77Å; L366-W429 HydrophobicContact CD2-CZ3 3.85Å; F368-W429 HydrophobicContact CE2-CE3 4.41Å; F368-W429 AromaticContact CE2-CH2 3.86Å; F368-W429 HydrophobicContact CE2-CH2 3.86Å; F368-W429 AromaticContact CE2-CZ3 3.51Å; F368-W429 HydrophobicContact CE2-CZ3 3.51Å; F368-W429 HydrophobicContact CZ-CZ3 4.03Å; D427-W429 PolarHBondContact O-N 2.91Å; D427-W429 VanDerWaalsContact O-N 3.09Å; D427-W429 WeakPolarHBondContact OD1-CB 3.44Å; D427-W429 PolarHBondContact OD1-N 2.86Å; W429-N431 VanDerWaalsContact C-N 3.32Å; W429-N431 PolarHBondContact O-N 2.79Å; W429-G432 WeakPolarHBondContact O-CA 3.48Å; W429-G432 PolarHBondContact O-N 2.85Å; W429-H452 AromaticContact CD1-CE1 3.47Å; W429-H452 VanDerWaalsContact CD1-CE1 3.47Å; W429-H452 AromaticContact CD1-ND1 3.61Å; W429-H452 AromaticContact CG-CE1 3.92Å
430	A	98.5	Very high	98.1	Very high	2 Å²	2	38 Å²	38	2%	0.017	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-60.4	-39.5	-167.1	0	0	0	0	0	113.9	N423 G424 D427 G432 G433 R435	N423-A430 HydrophobicContact CB-CB 3.93Å; G424-A430 WeakPolarHBondContact O-CB 3.45Å; D427-A430 HydrophobicContact CB-CB 4.23Å; D427-A430 WeakPolarHBondContact O-CB 3.34Å; D427-A430 PolarHBondContact O-N 2.9Å; A430-G432 PolarHBondContact O-N 3.09Å; A430-G433 PolarHBondContact O-N 3.1Å; A430-G433 VanDerWaalsContact O-N 3.08Å; A430-R435 VanDerWaalsContact O-CD 3.31Å; A430-R435 WeakPolarHBondContact O-CD 3.22Å; A430-R435 WeakPolarHBondContact O-CG 3.24Å
431	N	97.9	Very high	98	Very high	90 Å²	90	39.2 Å²	39.2	48%	0.481	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-79.7	-5.7	179.9	-68.6	-43.4	0	0	0	113.4	Q209 D213 W429 G433	Q209-N431 HydrophobicContact CG-CB 3.8Å; D213-N431 PolarHBondContact OD2-ND2 2.81Å; W429-N431 VanDerWaalsContact C-N 3.32Å; W429-N431 PolarHBondContact O-N 2.79Å; N431-G433 VanDerWaalsContact C-N 3.32Å
432	G	97.9	Very high	97.9	Very high	3 Å²	3	39.2 Å²	39.2	3%	0.031	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-83.3	-6.3	163.2	0	0	0	0	0	113.6	P197 L199 S200 W429 A430	P197-G432 CarbonylContact C-O 3.45Å; P197-G432 WeakPolarHBondContact CA-O 3.48Å; L199-G432 WeakPolarHBondContact CA-O 3.43Å; L199-G432 VanDerWaalsContact CB-O 3.22Å; L199-G432 WeakPolarHBondContact CB-O 3.44Å; L199-G432 PolarHBondContact N-O 3.39Å; S200-G432 PolarHBondContact N-O 3.46Å; S200-G432 VanDerWaalsContact N-O 3.08Å; S200-G432 WeakPolarHBondContact OG-CA 3.22Å; W429-G432 WeakPolarHBondContact O-CA 3.48Å; W429-G432 PolarHBondContact O-N 2.85Å; A430-G432 PolarHBondContact O-N 3.09Å
433	G	97.9	Very high	97.9	Very high	4 Å²	4	40.2 Å²	40.2	4%	0.041	23%	0.225	C	C	.	.	S	Bend	trans	-111	-167	-179.5	0	0	0	0	0	114.5	A196 L199 A430 N431	A196-G433 WeakPolarHBondContact O-CA 3.32Å; L199-G433 WeakPolarHBondContact CD1-O 3.45Å; A430-G433 PolarHBondContact O-N 3.1Å; A430-G433 VanDerWaalsContact O-N 3.08Å; N431-G433 VanDerWaalsContact C-N 3.32Å
434	V	98.3	Very high	97.9	Very high	11 Å²	11	40.8 Å²	40.8	7%	0.067	23%	0.229	C	C	.	.			trans	-91.3	110.4	179.2	179.6	0	0	0	0	110.7	I198 L413 F421 N423 K436 L438	I198-V434 HydrophobicContact CD1-CG2 3.83Å; I198-V434 HydrophobicContact CG1-CG2 4.18Å; L413-V434 HydrophobicContact CD1-CG2 4.17Å; F421-V434 HydrophobicContact CB-CB 4.03Å; F421-V434 HydrophobicContact CB-CG1 4.47Å; F421-V434 HydrophobicContact CD1-CB 3.93Å; F421-V434 HydrophobicContact CD1-CG2 4.1Å; F421-V434 HydrophobicContact CD2-CB 4.04Å; F421-V434 HydrophobicContact CD2-CG1 3.98Å; F421-V434 HydrophobicContact CE1-CB 4.36Å; F421-V434 HydrophobicContact CE1-CG2 4.06Å; F421-V434 HydrophobicContact CE2-CB 4.47Å; F421-V434 HydrophobicContact CE2-CG1 4.38Å; F421-V434 HydrophobicContact CG-CB 3.74Å; F421-V434 HydrophobicContact CG-CG1 4.17Å; F421-V434 HydrophobicContact CG-CG2 4.33Å; F421-V434 HydrophobicContact CZ-CG2 4.29Å; N423-V434 PolarHBondContact ND2-O 3.44Å; V434-K436 WeakPolarHBondContact CG1-O 3.48Å; V434-L438 HydrophobicContact CG1-CD1 4.17Å; V434-L438 HydrophobicContact CG1-CG 4.19Å
435	R	97.4	Very high	97.9	Very high	58 Å²	58	41.9 Å²	41.9	22%	0.219	24%	0.235	C	C	.	.			trans	-100.2	-5.2	-175	-65.7	-71.5	-61.2	-163.7	0.9	115	G424 D425 A430 A444 N446	G424-R435 PolarHBondContact O-NH1 3.47Å; D425-R435 IonicContact OD1-CZ 2.78Å; D425-R435 IonicContact OD1-NH1 2.66Å; D425-R435 PolarHBondContact OD1-NH1 3.24Å; D425-R435 IonicContact OD1-NH2 3.44Å; D425-R435 PolarHBondContact OD1-NH2 3.41Å; A430-R435 VanDerWaalsContact O-CD 3.31Å; A430-R435 WeakPolarHBondContact O-CD 3.22Å; A430-R435 WeakPolarHBondContact O-CG 3.24Å; R435-A444 VanDerWaalsContact C-CB 3.48Å; R435-N446 VanDerWaalsContact CZ-OD1 3.23Å; R435-N446 PolarHBondContact NE-OD1 3.21Å; R435-N446 VanDerWaalsContact NE-OD1 3.14Å; R435-N446 PolarHBondContact O-ND2 3.39Å; R435-N446 VanDerWaalsContact O-ND2 3.1Å
436	K	98	Very high	98	Very high	170 Å²	170	41.5 Å²	41.5	74%	0.739	23%	0.233	S	C	*	.	S	Bend	trans	-134.9	136.8	-177.9	-64.6	-177.9	-176.8	174.9	0	110.3	V434 L438	V434-K436 WeakPolarHBondContact CG1-O 3.48Å; K436-L438 PolarHBondContact O-N 3.28Å
437	S	98.2	Very high	98	Very high	70 Å²	70	39.6 Å²	39.6	49%	0.49	22%	0.223	S	C	.	.			trans	-60.4	131.7	176	-57.5	0	0	0	0	110.5	L442 A444	S437-L442 CarbonylContact C-O 3.53Å; S437-L442 VanDerWaalsContact CA-O 3.26Å; S437-L442 WeakPolarHBondContact CA-O 3.36Å; S437-L442 WeakPolarHBondContact CB-O 3.13Å; S437-A444 PolarHBondContact OG-N 3.42Å
438	L	97.1	Very high	98	Very high	92 Å²	92	42.9 Å²	42.9	48%	0.482	25%	0.246	S	C	.	.			trans	-97.7	-21	-177.9	-55.6	178.7	0	0	0	111.8	L413 V434 K436 L442	L413-L438 HydrophobicContact CB-CD1 3.92Å; L413-L438 HydrophobicContact CD1-CD1 4.03Å; V434-L438 HydrophobicContact CG1-CD1 4.17Å; V434-L438 HydrophobicContact CG1-CG 4.19Å; K436-L438 PolarHBondContact O-N 3.28Å; L438-L442 HydrophobicContact CB-CB 3.95Å; L438-L442 HydrophobicContact CB-CD1 4.01Å; L438-L442 HydrophobicContact CD1-CD1 4.44Å; L438-L442 PolarHBondContact N-O 2.77Å
439	S	97	Very high	97.9	Very high	49 Å²	49	44.3 Å²	44.3	34%	0.343	26%	0.261	S	S	.	.	B	Isolated β-bridge	trans	-160.6	-178	174	72.8	0	0	0	0	110.1	S441 L442	S439-S441 PolarHBondContact O-N 3.49Å; S439-S441 PolarHBondContact OG-N 2.92Å; S439-S441 PolarHBondContact OG-OG 3.06Å; S439-L442 PolarHBondContact N-O 3.3Å; S439-L442 PolarHBondContact O-N 3.04Å; S439-L442 WeakPolarHBondContact OG-CB 3.44Å; S439-L442 PolarHBondContact OG-N 2.85Å; S439-L442 VanDerWaalsContact OG-N 3.1Å
440	S	95.6	Very high	97.9	Very high	119 Å²	119	43.7 Å²	43.7	83%	0.832	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-16	173.3	56.6	0	0	0	0	113.9
441	S	95.8	Very high	97.9	Very high	24 Å²	24	43.6 Å²	43.6	17%	0.168	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.6	-1.7	180	61.4	0	0	0	0	113.7	N417 N418 I419 S439	N417-S441 WeakPolarHBondContact CB-OG 3.48Å; N418-S441 CarbonylContact C-O 3.51Å; N418-S441 VanDerWaalsContact CA-O 3.25Å; N418-S441 WeakPolarHBondContact CA-O 3.48Å; N418-S441 PolarHBondContact N-O 3.48Å; I419-S441 PolarHBondContact N-O 2.94Å; S439-S441 PolarHBondContact O-N 3.49Å; S439-S441 PolarHBondContact OG-N 2.92Å; S439-S441 PolarHBondContact OG-OG 3.06Å
442	L	98	Very high	97.9	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	86.6	171.8	-65.5	176.9	0	0	0	107	L413 A416 I419 F421 S437 L438 S439	L413-L442 HydrophobicContact CB-CD1 4.38Å; L413-L442 WeakPolarHBondContact O-CD1 3.47Å; A416-L442 HydrophobicContact CB-CD1 4.08Å; A416-L442 HydrophobicContact CB-CD2 3.91Å; A416-L442 WeakPolarHBondContact O-CD1 3.38Å; I419-L442 HydrophobicContact CB-CD2 3.79Å; I419-L442 HydrophobicContact CD1-CD2 4.09Å; I419-L442 HydrophobicContact CG1-CD2 3.96Å; I419-L442 WeakPolarHBondContact O-CA 3.46Å; F421-L442 HydrophobicContact CE2-CB 4.5Å; F421-L442 HydrophobicContact CE2-CD2 4.26Å; S437-L442 CarbonylContact C-O 3.53Å; S437-L442 VanDerWaalsContact CA-O 3.26Å; S437-L442 WeakPolarHBondContact CA-O 3.36Å; S437-L442 WeakPolarHBondContact CB-O 3.13Å; L438-L442 HydrophobicContact CB-CB 3.95Å; L438-L442 HydrophobicContact CB-CD1 4.01Å; L438-L442 HydrophobicContact CD1-CD1 4.44Å; L438-L442 PolarHBondContact N-O 2.77Å; S439-L442 PolarHBondContact N-O 3.3Å; S439-L442 PolarHBondContact O-N 3.04Å; S439-L442 WeakPolarHBondContact OG-CB 3.44Å; S439-L442 PolarHBondContact OG-N 2.85Å; S439-L442 VanDerWaalsContact OG-N 3.1Å
443	V	98.6	Very high	97.9	Very high	21 Å²	21	39.6 Å²	39.6	13%	0.127	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	126.2	-165.3	-178.1	0	0	0	0	109.2	I419 I420 F421 L445 L477	I419-V443 PolarHBondContact O-N 2.63Å; I420-V443 CarbonylContact C-O 3.52Å; I420-V443 WeakPolarHBondContact CA-O 3.36Å; F421-V443 PolarHBondContact N-O 3.19Å; V443-L445 HydrophobicContact CG1-CD2 3.73Å; V443-L445 HydrophobicContact CG1-CG 4.1Å; V443-L477 HydrophobicContact CB-CD1 4.3Å; V443-L477 HydrophobicContact CG1-CD1 4.26Å; V443-L477 HydrophobicContact CG2-CD1 4.18Å
444	A	98.7	Very high	98	Very high	13 Å²	13	39.4 Å²	39.4	11%	0.107	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	130.3	170.4	0	0	0	0	0	110.5	F421 R435 S437	F421-A444 CarbonylContact O-C 3.58Å; F421-A444 VanDerWaalsContact O-CA 3.26Å; F421-A444 WeakPolarHBondContact O-CA 3.2Å; R435-A444 VanDerWaalsContact C-CB 3.48Å; S437-A444 PolarHBondContact OG-N 3.42Å
445	L	98.8	Very high	98	Very high	23 Å²	23	38.9 Å²	38.9	12%	0.12	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	107.7	179.8	-59.8	-179.3	0	0	0	109.5	I420 F421 S422 N423 V443 V470 V473 E474	I420-L445 HydrophobicContact CG2-CD1 3.64Å; I420-L445 HydrophobicContact CG2-CG 4.05Å; F421-L445 PolarHBondContact O-N 3.24Å; S422-L445 CarbonylContact C-O 3.53Å; S422-L445 WeakPolarHBondContact CA-O 3.23Å; N423-L445 PolarHBondContact N-O 3.03Å; V443-L445 HydrophobicContact CG1-CD2 3.73Å; V443-L445 HydrophobicContact CG1-CG 4.1Å; L445-V470 HydrophobicContact CB-CG1 3.99Å; L445-V470 HydrophobicContact CB-CG2 4.33Å; L445-V470 HydrophobicContact CD1-CG1 4.01Å; L445-V473 HydrophobicContact CD1-CB 4.38Å; L445-V473 HydrophobicContact CD1-CG1 4.1Å; L445-V473 HydrophobicContact CD2-CG1 4.09Å; L445-E474 HydrophobicContact CD1-CG 3.68Å
446	N	98.6	Very high	98.1	Very high	63 Å²	63	36.1 Å²	36.1	34%	0.337	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	131.5	178.5	-58.4	-42	0	0	0	110.2	N423 R435	N423-N446 CarbonylContact O-C 3.54Å; N423-N446 WeakPolarHBondContact O-CA 3.43Å; R435-N446 VanDerWaalsContact CZ-OD1 3.23Å; R435-N446 PolarHBondContact NE-OD1 3.21Å; R435-N446 VanDerWaalsContact NE-OD1 3.14Å; R435-N446 PolarHBondContact O-ND2 3.39Å; R435-N446 VanDerWaalsContact O-ND2 3.1Å
447	I	98.8	Very high	98.1	Very high	0 Å²	0	29 Å²	29	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	101.4	-174.7	-54.6	159.9	0	0	0	108.5	N423 D425 G449 G450 D455 V467 V470	N423-I447 PolarHBondContact O-N 2.88Å; D425-I447 PolarHBondContact N-O 3.48Å; I447-G449 PolarHBondContact O-N 2.92Å; I447-G450 PolarHBondContact O-N 3.49Å; I447-D455 HydrophobicContact CD1-CB 3.65Å; I447-V467 HydrophobicContact CD1-CG2 4.46Å; I447-V467 HydrophobicContact CG2-CB 3.73Å; I447-V467 HydrophobicContact CG2-CG2 4.16Å; I447-V470 HydrophobicContact CD1-CG1 4.15Å; I447-V470 HydrophobicContact CG1-CB 4.12Å; I447-V470 HydrophobicContact CG1-CG1 3.88Å; I447-V470 HydrophobicContact CG1-CG2 3.94Å
448	S	98.5	Very high	98	Very high	73 Å²	73	26.9 Å²	26.9	51%	0.51	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	127.3	175.4	-170.1	0	0	0	0	110.5	D425 G450 S466	D425-S448 WeakPolarHBondContact OD2-CA 3.46Å; S448-G450 PolarHBondContact O-N 3.44Å; S448-S466 PolarHBondContact N-OG 3.09Å; S448-S466 VanDerWaalsContact N-OG 3.12Å; S448-S466 WeakPolarHBondContact O-CB 3.41Å
449	G	97.5	Very high	98.1	Very high	30 Å²	30	26 Å²	26	31%	0.309	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.8	9.8	-172.6	0	0	0	0	0	114.3	I447	I447-G449 PolarHBondContact O-N 2.92Å
450	G	98.3	Very high	98.1	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	18%	0.179	C	C	.	.			trans	-87.8	133.3	169.1	0	0	0	0	0	110.8	G424 D425 L426 I447 S448	G424-G450 CarbonylContact C-O 3.54Å; G424-G450 VanDerWaalsContact C-O 3.24Å; G424-G450 WeakPolarHBondContact CA-O 3.48Å; D425-G450 PolarHBondContact N-O 3.49Å; D425-G450 VanDerWaalsContact N-O 3.09Å; L426-G450 WeakPolarHBondContact CB-O 3.27Å; L426-G450 PolarHBondContact N-O 3.38Å; I447-G450 PolarHBondContact O-N 3.49Å; S448-G450 PolarHBondContact O-N 3.44Å
451	A	98.3	Very high	98.2	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	18%	0.184	C	C	.	.			trans	-88.6	-152.8	164	0	0	0	0	0	109.9	M280 D282 Y283 L426 H453	M280-A451 WeakPolarHBondContact O-CB 3.44Å; D282-A451 HydrophobicContact CB-CB 4.08Å; Y283-A451 HydrophobicContact CD1-CB 4.21Å; Y283-A451 HydrophobicContact CE1-CB 4.28Å; L426-A451 HydrophobicContact CB-CB 4.37Å; A451-H453 PolarHBondContact O-N 3.09Å; A451-H453 VanDerWaalsContact O-N 3.11Å
452	H	98.6	Very high	98.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	114	-173.3	-160.2	59.7	0	0	0	111.8	S171 M280 Y283 D427 W429 L454	S171-H452 VanDerWaalsContact CB-NE2 3.31Å; S171-H452 WeakPolarHBondContact CB-NE2 3.37Å; S171-H452 PolarHBondContact OG-NE2 3.32Å; M280-H452 HydrophobicContact CB-CB 4.17Å; M280-H452 WeakPolarHBondContact O-CB 3.28Å; M280-H452 PolarHBondContact O-N 2.94Å; Y283-H452 WeakPolarHBondContact CE1-O 3.44Å; Y283-H452 PolarHBondContact OH-O 3.12Å; D427-H452 VanDerWaalsContact CG-ND1 3.25Å; D427-H452 IonicContact OD1-CG 2.86Å; D427-H452 IonicContact OD1-ND1 2.82Å; D427-H452 PolarHBondContact OD1-ND1 3.14Å; D427-H452 VanDerWaalsContact OD1-ND1 3.12Å; D427-H452 IonicContact OD2-CE1 3.85Å; D427-H452 IonicContact OD2-CG 3.68Å; D427-H452 IonicContact OD2-ND1 3.75Å; D427-H452 PolarHBondContact OD2-ND1 2.83Å; W429-H452 AromaticContact CD1-CE1 3.47Å; W429-H452 VanDerWaalsContact CD1-CE1 3.47Å; W429-H452 AromaticContact CD1-ND1 3.61Å; W429-H452 AromaticContact CG-CE1 3.92Å; H452-L454 VanDerWaalsContact C-N 3.29Å; H452-L454 PolarHBondContact O-N 3.36Å; H452-L454 VanDerWaalsContact O-N 3.1Å
453	H	98.3	Very high	98.4	Very high	9 Å²	9	32.3 Å²	32.3	4%	0.042	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	42.7	43.3	178.6	61.9	61.6	0	0	0	115.9	A194 S195 F289 A451 D455 L456	A194-H453 HydrophobicContact CB-CB 3.67Å; S195-H453 WeakPolarHBondContact OG-CA 3.16Å; S195-H453 PolarHBondContact OG-N 3.02Å; F289-H453 AromaticContact CE1-CE1 3.9Å; F289-H453 AromaticContact CE1-NE2 3.92Å; A451-H453 PolarHBondContact O-N 3.09Å; A451-H453 VanDerWaalsContact O-N 3.11Å; H453-D455 VanDerWaalsContact C-OD1 3.23Å; H453-D455 WeakPolarHBondContact CA-OD1 3.19Å; H453-D455 PolarHBondContact O-N 2.79Å; H453-L456 HydrophobicContact CB-CD1 4.35Å; H453-L456 HydrophobicContact CB-CG 4.49Å; H453-L456 PolarHBondContact O-N 3.08Å; H453-L456 VanDerWaalsContact O-N 3.09Å
454	L	98.8	Very high	98.4	Very high	0 Å²	0	33 Å²	33	0%	0	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-56.2	-32	178.2	176.2	59.8	0	0	0	112.6	Y283 Y285 H452 L456 R457 P464 V467 R471	Y283-L454 HydrophobicContact CD1-CB 4.29Å; Y283-L454 HydrophobicContact CD1-CD1 3.73Å; Y283-L454 HydrophobicContact CD1-CG 4.47Å; Y283-L454 HydrophobicContact CE1-CB 4.09Å; Y283-L454 HydrophobicContact CE1-CD1 4.12Å; Y285-L454 HydrophobicContact CE1-CD1 4.34Å; Y285-L454 WeakPolarHBondContact OH-CD1 3.18Å; H452-L454 VanDerWaalsContact C-N 3.29Å; H452-L454 PolarHBondContact O-N 3.36Å; H452-L454 VanDerWaalsContact O-N 3.1Å; L454-L456 VanDerWaalsContact C-N 3.26Å; L454-L456 PolarHBondContact O-N 2.91Å; L454-R457 HydrophobicContact CD1-CB 4.43Å; L454-R457 HydrophobicContact CD1-CG 4.37Å; L454-R457 WeakPolarHBondContact O-CB 3.06Å; L454-R457 PolarHBondContact O-N 2.7Å; L454-R457 VanDerWaalsContact O-N 3.11Å; L454-P464 HydrophobicContact CD2-CG 3.98Å; L454-V467 HydrophobicContact CD2-CB 4.22Å; L454-V467 HydrophobicContact CD2-CG1 4.14Å; L454-V467 HydrophobicContact CD2-CG2 4.45Å; L454-V467 HydrophobicContact CG-CB 4.38Å; L454-V467 HydrophobicContact CG-CG1 4.37Å; L454-V467 HydrophobicContact CG-CG2 4.08Å; L454-R471 PolarHBondContact O-NH2 3.23Å
455	D	98.8	Very high	98.4	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-56.8	-32.9	175.7	54	-50.5	0	0	0	113.8	F99 A194 S422 I447 H453 R457 V467 V470 R471	F99-D455 VanDerWaalsContact CB-O 3.28Å; F99-D455 WeakPolarHBondContact CB-O 3.19Å; F99-D455 WeakPolarHBondContact CG-O 3.32Å; A194-D455 WeakPolarHBondContact CB-OD2 3.38Å; S422-D455 VanDerWaalsContact CB-OD2 3.3Å; S422-D455 WeakPolarHBondContact CB-OD2 3.5Å; S422-D455 PolarHBondContact OG-OD2 3.01Å; I447-D455 HydrophobicContact CD1-CB 3.65Å; H453-D455 VanDerWaalsContact C-OD1 3.23Å; H453-D455 WeakPolarHBondContact CA-OD1 3.19Å; H453-D455 PolarHBondContact O-N 2.79Å; D455-R457 VanDerWaalsContact C-N 3.34Å; D455-R457 PolarHBondContact O-N 2.84Å; D455-V467 HydrophobicContact CB-CG2 4.08Å; D455-V470 HydrophobicContact CB-CG1 4.43Å; D455-R471 HydrophobicContact CB-CG 4.38Å; D455-R471 PolarHBondContact O-NE 3.01Å
456	L	98.8	Very high	98.4	Very high	0 Å²	0	37 Å²	37	0%	0	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-75.5	-21.9	177.3	-66.7	-175.4	0	0	0	113.6	Y83 S97 G98 F99 L192 A194 H453 L454	Y83-L456 HydrophobicContact CE2-CD1 4.33Å; S97-L456 CarbonylContact C-O 3.08Å; S97-L456 WeakPolarHBondContact CA-O 3.38Å; G98-L456 PolarHBondContact N-O 3.28Å; G98-L456 VanDerWaalsContact N-O 3.16Å; F99-L456 VanDerWaalsContact CB-O 3.26Å; F99-L456 WeakPolarHBondContact CB-O 3.4Å; F99-L456 HydrophobicContact CD1-CD2 4.47Å; F99-L456 PolarHBondContact N-O 2.78Å; L192-L456 HydrophobicContact CD2-CD2 3.86Å; L192-L456 HydrophobicContact CG-CD2 4.4Å; A194-L456 HydrophobicContact CB-CD1 3.7Å; A194-L456 HydrophobicContact CB-CD2 4.24Å; A194-L456 HydrophobicContact CB-CG 3.65Å; H453-L456 HydrophobicContact CB-CD1 4.35Å; H453-L456 HydrophobicContact CB-CG 4.49Å; H453-L456 PolarHBondContact O-N 3.08Å; H453-L456 VanDerWaalsContact O-N 3.09Å; L454-L456 VanDerWaalsContact C-N 3.26Å; L454-L456 PolarHBondContact O-N 2.91Å
457	R	98.5	Very high	98.4	Very high	22 Å²	22	34 Å²	34	8%	0.083	23%	0.226	C	C	.	.	S	Bend	trans	-63.9	154.5	-180	-57.4	-161.6	68.2	82.6	6.8	111	N96 F99 Y285 L454 D455 R471	N96-R457 WeakPolarHBondContact O-CA 3.37Å; N96-R457 VanDerWaalsContact OD1-CZ 3.28Å; N96-R457 PolarHBondContact OD1-NH1 3.44Å; N96-R457 PolarHBondContact OD1-NH2 3.48Å; F99-R457 PolarHBondContact N-O 2.71Å; Y285-R457 WeakPolarHBondContact OH-CB 3.13Å; L454-R457 HydrophobicContact CD1-CB 4.43Å; L454-R457 HydrophobicContact CD1-CG 4.37Å; L454-R457 WeakPolarHBondContact O-CB 3.06Å; L454-R457 PolarHBondContact O-N 2.7Å; L454-R457 VanDerWaalsContact O-N 3.11Å; D455-R457 VanDerWaalsContact C-N 3.34Å; D455-R457 PolarHBondContact O-N 2.84Å; R457-R471 VanDerWaalsContact O-CZ 3.22Å; R457-R471 PolarHBondContact O-NE 2.65Å; R457-R471 PolarHBondContact O-NH2 2.71Å
458	G	97	Very high	98.4	Very high	24 Å²	24	37.9 Å²	37.9	25%	0.247	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-59.9	153.7	171.1	0	0	0	0	0	111.3	E102	E102-G458 WeakPolarHBondContact OE1-CA 3.32Å
459	S	98.1	Very high	98.4	Very high	75 Å²	75	41.8 Å²	41.8	52%	0.524	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-59.4	137.8	177.7	-67.3	0	0	0	0	111.2	E102 D463	E102-S459 PolarHBondContact OE1-N 2.99Å; E102-S459 WeakPolarHBondContact OE2-CB 3.35Å; E102-S459 PolarHBondContact OE2-N 3.16Å; E102-S459 PolarHBondContact OE2-OG 3.23Å; S459-D463 WeakPolarHBondContact CA-OD2 3.39Å
460	N	98.2	Very high	98.4	Very high	63 Å²	63	40.9 Å²	40.9	34%	0.337	25%	0.246	S	C	.	.			trans	-138	145.6	-179.8	-167.8	-76.5	0	0	0	110.6	Y285 S462 D463	Y285-N460 HydrophobicContact CD1-CB 3.73Å; Y285-N460 WeakPolarHBondContact CD1-OD1 3.35Å; Y285-N460 HydrophobicContact CE1-CB 3.45Å; Y285-N460 VanDerWaalsContact CE1-CB 3.45Å; Y285-N460 HydrophobicContact CG-CB 4.47Å; N460-S462 PolarHBondContact O-N 3.27Å; N460-S462 VanDerWaalsContact O-N 3.11Å; N460-S462 WeakPolarHBondContact OD1-CB 3.49Å; N460-S462 PolarHBondContact OD1-N 3.12Å; N460-D463 PolarHBondContact N-OD2 2.69Å; N460-D463 VanDerWaalsContact O-CB 3.23Å; N460-D463 WeakPolarHBondContact O-CB 3.02Å; N460-D463 VanDerWaalsContact O-CG 3.3Å; N460-D463 PolarHBondContact O-N 2.79Å
461	D	97.9	Very high	98.5	Very high	176 Å²	176	41.4 Å²	41.4	94%	0.941	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-22	178.4	-67.9	-21	0	0	0	113.3
462	S	98.3	Very high	98.5	Very high	66 Å²	66	47.8 Å²	47.8	46%	0.462	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	6.1	177	-52.7	0	0	0	0	113.4	P284 N460	P284-S462 WeakPolarHBondContact CB-O 3.46Å; P284-S462 VanDerWaalsContact CG-O 3.3Å; P284-S462 WeakPolarHBondContact CG-O 3.38Å; N460-S462 PolarHBondContact O-N 3.27Å; N460-S462 VanDerWaalsContact O-N 3.11Å; N460-S462 WeakPolarHBondContact OD1-CB 3.49Å; N460-S462 PolarHBondContact OD1-N 3.12Å
463	D	98.6	Very high	98.5	Very high	21 Å²	21	49.9 Å²	49.9	11%	0.112	29%	0.288	C	S	.	.			trans	-61.1	133.4	177	-81.1	-28.4	0	0	0	111.3	Y285 S459 N460 V467 V468 R471	Y285-D463 WeakPolarHBondContact CE1-OD1 3.26Å; S459-D463 WeakPolarHBondContact CA-OD2 3.39Å; N460-D463 PolarHBondContact N-OD2 2.69Å; N460-D463 VanDerWaalsContact O-CB 3.23Å; N460-D463 WeakPolarHBondContact O-CB 3.02Å; N460-D463 VanDerWaalsContact O-CG 3.3Å; N460-D463 PolarHBondContact O-N 2.79Å; D463-V467 HydrophobicContact CB-CG1 3.66Å; D463-V468 HydrophobicContact CB-CG2 3.97Å; D463-R471 IonicContact OD1-NH2 3.77Å; D463-R471 IonicContact OD2-CZ 2.78Å; D463-R471 IonicContact OD2-NH1 3.26Å; D463-R471 PolarHBondContact OD2-NH1 3.38Å; D463-R471 IonicContact OD2-NH2 2.7Å
464	P	98.4	Very high	98.5	Very high	34 Å²	34	49.5 Å²	49.5	22%	0.221	29%	0.286	C	S	.	.			trans	-63.8	145	172.6	26.4	-34.5	0	0	0	109.9	L454 S466 V467 V468	L454-P464 HydrophobicContact CD2-CG 3.98Å; P464-S466 PolarHBondContact O-N 3.03Å; P464-V467 HydrophobicContact CG-CB 4.3Å; P464-V467 HydrophobicContact CG-CG1 3.92Å; P464-V467 WeakPolarHBondContact O-CG1 3.36Å; P464-V467 PolarHBondContact O-N 3.36Å; P464-V468 PolarHBondContact O-N 3.25Å
465	A	98.6	Very high	98.5	Very high	86 Å²	86	50 Å²	50	71%	0.711	29%	0.291	S	S	*	.	H	α-helix	trans	-53.7	-27.4	178.4	0	0	0	0	0	113.1	K469	A465-K469 WeakPolarHBondContact O-CB 3.27Å; A465-K469 PolarHBondContact O-N 2.85Å; A465-K469 VanDerWaalsContact O-N 3.1Å
466	S	98.7	Very high	98.5	Very high	35 Å²	35	54.7 Å²	54.7	25%	0.245	31%	0.313	C	S	.	.	H	α-helix	trans	-62	-47.2	175.4	-163.3	0	0	0	0	112.6	S448 P464 K469 V470	S448-S466 PolarHBondContact N-OG 3.09Å; S448-S466 VanDerWaalsContact N-OG 3.12Å; S448-S466 WeakPolarHBondContact O-CB 3.41Å; P464-S466 PolarHBondContact O-N 3.03Å; S466-K469 PolarHBondContact O-N 2.85Å; S466-V470 WeakPolarHBondContact O-CG2 3.22Å; S466-V470 PolarHBondContact O-N 2.58Å
467	V	98.8	Very high	98.5	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-70	-37.6	-178.4	74.3	0	0	0	0	111.3	I447 L454 D455 D463 P464 K469 V470 R471	I447-V467 HydrophobicContact CD1-CG2 4.46Å; I447-V467 HydrophobicContact CG2-CB 3.73Å; I447-V467 HydrophobicContact CG2-CG2 4.16Å; L454-V467 HydrophobicContact CD2-CB 4.22Å; L454-V467 HydrophobicContact CD2-CG1 4.14Å; L454-V467 HydrophobicContact CD2-CG2 4.45Å; L454-V467 HydrophobicContact CG-CB 4.38Å; L454-V467 HydrophobicContact CG-CG1 4.37Å; L454-V467 HydrophobicContact CG-CG2 4.08Å; D455-V467 HydrophobicContact CB-CG2 4.08Å; D463-V467 HydrophobicContact CB-CG1 3.66Å; P464-V467 HydrophobicContact CG-CB 4.3Å; P464-V467 HydrophobicContact CG-CG1 3.92Å; P464-V467 WeakPolarHBondContact O-CG1 3.36Å; P464-V467 PolarHBondContact O-N 3.36Å; V467-K469 VanDerWaalsContact C-N 3.28Å; V467-K469 PolarHBondContact O-N 3Å; V467-V470 PolarHBondContact O-N 3.06Å; V467-V470 VanDerWaalsContact O-N 3.16Å; V467-R471 HydrophobicContact CG2-CG 4.29Å; V467-R471 WeakPolarHBondContact O-CB 3.45Å; V467-R471 WeakPolarHBondContact O-CG 3.36Å; V467-R471 PolarHBondContact O-N 3.17Å
468	V	98.8	Very high	98.6	Very high	82 Å²	82	54.8 Å²	54.8	50%	0.497	32%	0.315	S	S	.	.	H	α-helix	trans	-58.4	-42.8	174.7	179.6	0	0	0	0	110.9	D463 P464 K472	D463-V468 HydrophobicContact CB-CG2 3.97Å; P464-V468 PolarHBondContact O-N 3.25Å; V468-K472 PolarHBondContact O-N 3.24Å
469	K	98.8	Very high	98.6	Very high	154 Å²	154	55.8 Å²	55.8	67%	0.67	32%	0.32	S	S	*	.	H	α-helix	trans	-66.8	-43.4	175.8	-177.4	-179.1	176.2	-173.6	0	112.1	A465 S466 V467 K472 V473	A465-K469 WeakPolarHBondContact O-CB 3.27Å; A465-K469 PolarHBondContact O-N 2.85Å; A465-K469 VanDerWaalsContact O-N 3.1Å; S466-K469 PolarHBondContact O-N 2.85Å; V467-K469 VanDerWaalsContact C-N 3.28Å; V467-K469 PolarHBondContact O-N 3Å; K469-K472 WeakPolarHBondContact O-CB 3.35Å; K469-K472 PolarHBondContact O-N 2.82Å; K469-V473 WeakPolarHBondContact O-CG2 3.46Å; K469-V473 PolarHBondContact O-N 2.9Å
470	V	98.8	Very high	98.7	Very high	11 Å²	11	57.3 Å²	57.3	7%	0.067	32%	0.319	C	S	.	.	H	α-helix	trans	-63.1	-49.1	-179.5	163.5	0	0	0	0	111.1	L445 I447 D455 S466 V467 K472 V473 E474	L445-V470 HydrophobicContact CB-CG1 3.99Å; L445-V470 HydrophobicContact CB-CG2 4.33Å; L445-V470 HydrophobicContact CD1-CG1 4.01Å; I447-V470 HydrophobicContact CD1-CG1 4.15Å; I447-V470 HydrophobicContact CG1-CB 4.12Å; I447-V470 HydrophobicContact CG1-CG1 3.88Å; I447-V470 HydrophobicContact CG1-CG2 3.94Å; D455-V470 HydrophobicContact CB-CG1 4.43Å; S466-V470 WeakPolarHBondContact O-CG2 3.22Å; S466-V470 PolarHBondContact O-N 2.58Å; V467-V470 PolarHBondContact O-N 3.06Å; V467-V470 VanDerWaalsContact O-N 3.16Å; V470-K472 PolarHBondContact O-N 2.99Å; V470-V473 WeakPolarHBondContact O-CA 3.31Å; V470-V473 WeakPolarHBondContact O-CB 3.45Å; V470-V473 PolarHBondContact O-N 2.93Å; V470-E474 HydrophobicContact CG1-CG 4.34Å; V470-E474 WeakPolarHBondContact CG1-OE1 3.38Å; V470-E474 WeakPolarHBondContact O-CG 3.45Å; V470-E474 PolarHBondContact O-N 3.32Å
471	R	98.9	Very high	98.7	Very high	12 Å²	12	54.8 Å²	54.8	5%	0.045	31%	0.305	C	S	.	.	H	α-helix	trans	-55.1	-37	175.2	-74.8	179.6	-174.2	145.4	10	113.1	F99 L454 D455 R457 D463 V467 E474 A475	F99-R471 HydrophobicContact CD2-CB 4.13Å; F99-R471 HydrophobicContact CD2-CG 3.87Å; F99-R471 HydrophobicContact CE2-CB 3.65Å; F99-R471 HydrophobicContact CE2-CG 3.86Å; F99-R471 HydrophobicContact CG-CG 4.28Å; F99-R471 HydrophobicContact CZ-CB 4.07Å; F99-R471 HydrophobicContact CZ-CG 4.25Å; L454-R471 PolarHBondContact O-NH2 3.23Å; D455-R471 HydrophobicContact CB-CG 4.38Å; D455-R471 PolarHBondContact O-NE 3.01Å; R457-R471 VanDerWaalsContact O-CZ 3.22Å; R457-R471 PolarHBondContact O-NE 2.65Å; R457-R471 PolarHBondContact O-NH2 2.71Å; D463-R471 IonicContact OD1-NH2 3.77Å; D463-R471 IonicContact OD2-CZ 2.78Å; D463-R471 IonicContact OD2-NH1 3.26Å; D463-R471 PolarHBondContact OD2-NH1 3.38Å; D463-R471 IonicContact OD2-NH2 2.7Å; V467-R471 HydrophobicContact CG2-CG 4.29Å; V467-R471 WeakPolarHBondContact O-CB 3.45Å; V467-R471 WeakPolarHBondContact O-CG 3.36Å; V467-R471 PolarHBondContact O-N 3.17Å; R471-E474 WeakPolarHBondContact CA-OE2 3.46Å; R471-A475 WeakPolarHBondContact O-CB 3.29Å; R471-A475 PolarHBondContact O-N 3.1Å
472	K	98.8	Very high	98.7	Very high	133 Å²	133	46.7 Å²	46.7	58%	0.578	26%	0.262	S	S	*	.	H	α-helix	trans	-64.8	-44.4	174.6	-176.2	178.6	175.5	-179.3	0	112.1	V468 K469 V470 A475 E476	V468-K472 PolarHBondContact O-N 3.24Å; K469-K472 WeakPolarHBondContact O-CB 3.35Å; K469-K472 PolarHBondContact O-N 2.82Å; V470-K472 PolarHBondContact O-N 2.99Å; K472-A475 PolarHBondContact O-N 3.22Å; K472-E476 WeakPolarHBondContact CE-OE1 3.46Å; K472-E476 WeakPolarHBondContact O-CG 3.27Å; K472-E476 PolarHBondContact O-N 3Å
473	V	98.8	Very high	98.7	Very high	45 Å²	45	50 Å²	50	27%	0.273	27%	0.268	S	S	.	.	H	α-helix	trans	-65.3	-41.7	177.8	175.6	0	0	0	0	110.7	L445 K469 V470 E476 L477	L445-V473 HydrophobicContact CD1-CB 4.38Å; L445-V473 HydrophobicContact CD1-CG1 4.1Å; L445-V473 HydrophobicContact CD2-CG1 4.09Å; K469-V473 WeakPolarHBondContact O-CG2 3.46Å; K469-V473 PolarHBondContact O-N 2.9Å; V470-V473 WeakPolarHBondContact O-CA 3.31Å; V470-V473 WeakPolarHBondContact O-CB 3.45Å; V470-V473 PolarHBondContact O-N 2.93Å; V473-E476 PolarHBondContact O-N 2.83Å; V473-L477 HydrophobicContact CG1-CD1 3.92Å; V473-L477 HydrophobicContact CG1-CG 4.36Å; V473-L477 WeakPolarHBondContact O-CG 3.35Å; V473-L477 PolarHBondContact O-N 3.44Å
474	E	98.9	Very high	98.5	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-57.4	-50.3	174.1	-71.3	164.6	176.8	0	0	111.2	F99 L192 I420 S422 L445 V470 R471 E476 L477 I478	F99-E474 HydrophobicContact CE1-CB 4.25Å; F99-E474 WeakPolarHBondContact CE1-OE2 3.18Å; F99-E474 HydrophobicContact CZ-CB 4.1Å; L192-E474 HydrophobicContact CD1-CG 4Å; L192-E474 HydrophobicContact CD2-CG 4.39Å; I420-E474 HydrophobicContact CD1-CG 4.4Å; I420-E474 HydrophobicContact CG2-CG 4.2Å; S422-E474 WeakPolarHBondContact CB-OE1 3.21Å; L445-E474 HydrophobicContact CD1-CG 3.68Å; V470-E474 HydrophobicContact CG1-CG 4.34Å; V470-E474 WeakPolarHBondContact CG1-OE1 3.38Å; V470-E474 WeakPolarHBondContact O-CG 3.45Å; V470-E474 PolarHBondContact O-N 3.32Å; R471-E474 WeakPolarHBondContact CA-OE2 3.46Å; E474-E476 VanDerWaalsContact C-N 3.31Å; E474-E476 PolarHBondContact O-N 3.03Å; E474-L477 PolarHBondContact O-N 2.98Å; E474-I478 VanDerWaalsContact O-CB 3.32Å; E474-I478 WeakPolarHBondContact O-CB 3.42Å; E474-I478 WeakPolarHBondContact O-CD1 3.13Å; E474-I478 WeakPolarHBondContact O-CG1 3.48Å; E474-I478 PolarHBondContact O-N 3.43Å
475	A	98.9	Very high	98.5	Very high	12 Å²	12	54 Å²	54	10%	0.099	29%	0.285	C	S	.	.	H	α-helix	trans	-56.9	-44.3	177.8	0	0	0	0	0	112.4	L103 Q107 R471 K472 A479	L103-A475 HydrophobicContact CD1-CB 3.39Å; Q107-A475 PolarHBondContact NE2-O 2.95Å; R471-A475 WeakPolarHBondContact O-CB 3.29Å; R471-A475 PolarHBondContact O-N 3.1Å; K472-A475 PolarHBondContact O-N 3.22Å; A475-A479 WeakPolarHBondContact O-CB 3.28Å; A475-A479 PolarHBondContact O-N 3.35Å
476	E	98.8	Very high	98.3	Very high	97 Å²	97	52.1 Å²	52.1	45%	0.453	26%	0.259	S	S	.	.	H	α-helix	trans	-65	-45.9	179	-74.3	173.1	-173	0	0	112.2	K472 V473 E474 A479 Q480	K472-E476 WeakPolarHBondContact CE-OE1 3.46Å; K472-E476 WeakPolarHBondContact O-CG 3.27Å; K472-E476 PolarHBondContact O-N 3Å; V473-E476 PolarHBondContact O-N 2.83Å; E474-E476 VanDerWaalsContact C-N 3.31Å; E474-E476 PolarHBondContact O-N 3.03Å; E476-A479 PolarHBondContact O-N 3.39Å; E476-Q480 VanDerWaalsContact O-CG 3.27Å; E476-Q480 WeakPolarHBondContact O-CG 3.47Å; E476-Q480 PolarHBondContact O-N 2.76Å
477	L	98.8	Very high	98	Very high	25 Å²	25	55.2 Å²	55.2	13%	0.131	27%	0.273	C	S	.	.	H	α-helix	trans	-64.8	-44.4	177.9	-72.3	172.6	0	0	0	111.7	I420 V443 V473 E474 A479 Q480 W481	I420-L477 HydrophobicContact CD1-CB 3.92Å; I420-L477 HydrophobicContact CD1-CD1 3.94Å; I420-L477 HydrophobicContact CG1-CD1 3.76Å; V443-L477 HydrophobicContact CB-CD1 4.3Å; V443-L477 HydrophobicContact CG1-CD1 4.26Å; V443-L477 HydrophobicContact CG2-CD1 4.18Å; V473-L477 HydrophobicContact CG1-CD1 3.92Å; V473-L477 HydrophobicContact CG1-CG 4.36Å; V473-L477 WeakPolarHBondContact O-CG 3.35Å; V473-L477 PolarHBondContact O-N 3.44Å; E474-L477 PolarHBondContact O-N 2.98Å; L477-A479 VanDerWaalsContact C-N 3.35Å; L477-A479 PolarHBondContact O-N 2.86Å; L477-Q480 WeakPolarHBondContact O-CB 3.35Å; L477-Q480 PolarHBondContact O-N 3.12Å; L477-Q480 VanDerWaalsContact O-N 3.16Å; L477-W481 HydrophobicContact CB-CZ2 4.43Å; L477-W481 PolarHBondContact O-N 3.43Å
478	I	98.9	Very high	97.7	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-60.2	-46	177	-71.7	166.6	0	0	0	110.4	F81 L103 I166 F168 L192 I420 E474 Q480 W481 V482	F81-I478 HydrophobicContact CE1-CG2 4.02Å; F81-I478 HydrophobicContact CZ-CG2 4.11Å; L103-I478 HydrophobicContact CD2-CD1 3.74Å; L103-I478 HydrophobicContact CD2-CG2 4.29Å; I166-I478 HydrophobicContact CG1-CG2 4.03Å; I166-I478 HydrophobicContact CG2-CG1 4.28Å; I166-I478 HydrophobicContact CG2-CG2 4.15Å; F168-I478 HydrophobicContact CE1-CD1 3.71Å; F168-I478 HydrophobicContact CZ-CD1 3.89Å; L192-I478 HydrophobicContact CB-CD1 4.49Å; I420-I478 HydrophobicContact CD1-CG1 4.29Å; E474-I478 VanDerWaalsContact O-CB 3.32Å; E474-I478 WeakPolarHBondContact O-CB 3.42Å; E474-I478 WeakPolarHBondContact O-CD1 3.13Å; E474-I478 WeakPolarHBondContact O-CG1 3.48Å; E474-I478 PolarHBondContact O-N 3.43Å; I478-Q480 VanDerWaalsContact C-N 3.28Å; I478-Q480 PolarHBondContact O-N 3.05Å; I478-W481 HydrophobicContact CG1-CE3 4.4Å; I478-W481 HydrophobicContact CG1-CZ3 4.43Å; I478-W481 PolarHBondContact O-N 3.18Å; I478-V482 HydrophobicContact CG2-CG2 4.46Å; I478-V482 WeakPolarHBondContact O-CG2 3.47Å; I478-V482 PolarHBondContact O-N 3.28Å
479	A	98.7	Very high	97.1	Very high	44 Å²	44	58.6 Å²	58.6	36%	0.364	28%	0.279	S	S	.	.	H	α-helix	trans	-61.1	-37.5	177.2	0	0	0	0	0	112.1	A475 E476 L477 K483	A475-A479 WeakPolarHBondContact O-CB 3.28Å; A475-A479 PolarHBondContact O-N 3.35Å; E476-A479 PolarHBondContact O-N 3.39Å; L477-A479 VanDerWaalsContact C-N 3.35Å; L477-A479 PolarHBondContact O-N 2.86Å; A479-K483 WeakPolarHBondContact O-CB 3.02Å; A479-K483 PolarHBondContact O-N 3.45Å
480	Q	98.4	Very high	96.4	Very high	108 Å²	108	55.3 Å²	55.3	51%	0.505	27%	0.272	S	S	.	.	H	α-helix	trans	-63.8	-46.7	175	-71.6	171	37	0	0	111.6	E476 L477 I478 V482 K483 M484	E476-Q480 VanDerWaalsContact O-CG 3.27Å; E476-Q480 WeakPolarHBondContact O-CG 3.47Å; E476-Q480 PolarHBondContact O-N 2.76Å; L477-Q480 WeakPolarHBondContact O-CB 3.35Å; L477-Q480 PolarHBondContact O-N 3.12Å; L477-Q480 VanDerWaalsContact O-N 3.16Å; I478-Q480 VanDerWaalsContact C-N 3.28Å; I478-Q480 PolarHBondContact O-N 3.05Å; Q480-V482 PolarHBondContact O-N 3.41Å; Q480-K483 WeakPolarHBondContact O-CB 3.21Å; Q480-K483 PolarHBondContact O-N 2.9Å; Q480-M484 WeakPolarHBondContact O-CG 3.22Å; Q480-M484 PolarHBondContact O-N 2.78Å
481	W	98.6	Very high	95.6	Very high	9 Å²	9	57.1 Å²	57.1	3%	0.034	29%	0.288	C	S	.	.	H	α-helix	trans	-64.3	-41.1	178.4	-60	-24.9	0	0	0	112.5	I166 N418 I420 L477 I478 K483 M484 E485	I166-W481 HydrophobicContact CD1-CB 4.24Å; I166-W481 HydrophobicContact CD1-CE3 4.39Å; N418-W481 VanDerWaalsContact CA-CZ2 3.44Å; N418-W481 HydrophobicContact CB-CD2 3.83Å; N418-W481 HydrophobicContact CB-CE3 4.28Å; N418-W481 HydrophobicContact CB-CG 4.17Å; N418-W481 HydrophobicContact CB-CH2 4.35Å; N418-W481 HydrophobicContact CB-CZ2 3.97Å; N418-W481 PolarHBondContact OD1-NE1 3.39Å; I420-W481 HydrophobicContact CB-CH2 4.46Å; I420-W481 HydrophobicContact CD1-CH2 3.55Å; I420-W481 HydrophobicContact CD1-CZ2 4.4Å; I420-W481 HydrophobicContact CD1-CZ3 3.78Å; I420-W481 HydrophobicContact CG1-CH2 3.6Å; I420-W481 HydrophobicContact CG1-CZ2 4.32Å; I420-W481 HydrophobicContact CG1-CZ3 4.3Å; L477-W481 HydrophobicContact CB-CZ2 4.43Å; L477-W481 PolarHBondContact O-N 3.43Å; I478-W481 HydrophobicContact CG1-CE3 4.4Å; I478-W481 HydrophobicContact CG1-CZ3 4.43Å; I478-W481 PolarHBondContact O-N 3.18Å; W481-K483 VanDerWaalsContact C-N 3.29Å; W481-K483 PolarHBondContact O-N 2.87Å; W481-M484 PolarHBondContact O-N 2.84Å; W481-E485 WeakPolarHBondContact O-CB 3.46Å; W481-E485 PolarHBondContact O-N 2.8Å
482	V	98.5	Very high	94.4	Very high	6 Å²	6	58.7 Å²	58.7	4%	0.036	30%	0.303	C	S	.	.	H	α-helix	trans	-57.9	-43.3	173.2	168.9	0	0	0	0	110.8	P79 P164 I166 I478 Q480 R486	P79-V482 HydrophobicContact CB-CG1 3.94Å; P79-V482 HydrophobicContact CB-CG2 3.75Å; P79-V482 HydrophobicContact CG-CG1 4.05Å; P79-V482 HydrophobicContact CG-CG2 4.03Å; P164-V482 HydrophobicContact CB-CG1 4.35Å; P164-V482 HydrophobicContact CB-CG2 4.49Å; P164-V482 HydrophobicContact CG-CG1 4.14Å; P164-V482 WeakPolarHBondContact CG-O 3.14Å; I166-V482 HydrophobicContact CD1-CG2 4.07Å; I166-V482 HydrophobicContact CG1-CG2 3.75Å; I478-V482 HydrophobicContact CG2-CG2 4.46Å; I478-V482 WeakPolarHBondContact O-CG2 3.47Å; I478-V482 PolarHBondContact O-N 3.28Å; Q480-V482 PolarHBondContact O-N 3.41Å; V482-R486 WeakPolarHBondContact O-CB 3.48Å; V482-R486 PolarHBondContact O-N 3.14Å
483	K	97.7	Very high	92.7	Very high	137 Å²	137	60.2 Å²	60.2	60%	0.596	31%	0.307	S	S	*	.	H	α-helix	trans	-66	-45.1	177.1	-177.9	179.4	178.4	-177.6	0	112.2	A479 Q480 W481 R486 N487	A479-K483 WeakPolarHBondContact O-CB 3.02Å; A479-K483 PolarHBondContact O-N 3.45Å; Q480-K483 WeakPolarHBondContact O-CB 3.21Å; Q480-K483 PolarHBondContact O-N 2.9Å; W481-K483 VanDerWaalsContact C-N 3.29Å; W481-K483 PolarHBondContact O-N 2.87Å; K483-R486 PolarHBondContact O-N 3.41Å; K483-N487 PolarHBondContact O-N 3.05Å; K483-N487 VanDerWaalsContact O-N 3.1Å
484	M	96	Very high	91.1	Very high	113 Å²	113	63.2 Å²	63.2	56%	0.557	33%	0.325	S	S	*	.	H	α-helix	trans	-60.6	-47.3	178.6	-73.2	173.2	62.8	0	0	111.4	Q480 W481 R486 N487 R488	Q480-M484 WeakPolarHBondContact O-CG 3.22Å; Q480-M484 PolarHBondContact O-N 2.78Å; W481-M484 PolarHBondContact O-N 2.84Å; M484-R486 PolarHBondContact O-N 3.14Å; M484-N487 PolarHBondContact O-N 3.08Å; M484-R488 PolarHBondContact O-N 2.86Å
485	E	96.6	Very high	88.9	Confident	25 Å²	25	71.4 Å²	71.4	12%	0.117	36%	0.363	C	S	.	.	H	α-helix	trans	-66.1	-39.9	-179.9	178.6	61	-172.1	0	0	111.8	P164 A189 W481 N487 R488 L489	P164-E485 HydrophobicContact CB-CB 4.02Å; P164-E485 HydrophobicContact CB-CG 3.85Å; P164-E485 HydrophobicContact CG-CB 4.14Å; P164-E485 HydrophobicContact CG-CG 4.05Å; A189-E485 HydrophobicContact CB-CB 3.72Å; A189-E485 HydrophobicContact CB-CG 3.82Å; W481-E485 WeakPolarHBondContact O-CB 3.46Å; W481-E485 PolarHBondContact O-N 2.8Å; E485-N487 VanDerWaalsContact C-N 3.31Å; E485-N487 PolarHBondContact O-N 2.66Å; E485-R488 WeakPolarHBondContact O-CB 3.48Å; E485-R488 PolarHBondContact O-N 3.09Å; E485-R488 VanDerWaalsContact O-N 3.15Å; E485-R488 IonicContact OE1-CZ 3.36Å; E485-R488 IonicContact OE1-NE 3.83Å; E485-R488 PolarHBondContact OE1-NE 2.94Å; E485-R488 IonicContact OE1-NH2 2.66Å; E485-R488 PolarHBondContact OE1-NH2 3.12Å; E485-R488 IonicContact OE2-CZ 3.66Å; E485-R488 IonicContact OE2-NE 3.12Å; E485-R488 PolarHBondContact OE2-NE 2.9Å; E485-R488 IonicContact OE2-NH2 3.69Å; E485-L489 HydrophobicContact CG-CD1 4.08Å; E485-L489 HydrophobicContact CG-CG 4.37Å; E485-L489 WeakPolarHBondContact O-CG 3.26Å; E485-L489 PolarHBondContact O-N 3.14Å
486	R	94.5	Very high	86.6	Confident	47 Å²	47	80.7 Å²	80.7	18%	0.177	41%	0.411	C	S	.	.	H	α-helix	trans	-57.5	-45.7	174.6	-171.9	174.7	-69.4	121.7	-2.2	111.4	Y77 P164 V482 K483 M484 R488 L489 T490	Y77-R486 PolarHBondContact O-NH2 3.19Å; P164-R486 HydrophobicContact CG-CB 4.26Å; V482-R486 WeakPolarHBondContact O-CB 3.48Å; V482-R486 PolarHBondContact O-N 3.14Å; K483-R486 PolarHBondContact O-N 3.41Å; M484-R486 PolarHBondContact O-N 3.14Å; R486-R488 VanDerWaalsContact C-N 3.32Å; R486-R488 PolarHBondContact O-N 3.39Å; R486-L489 PolarHBondContact O-N 3.25Å; R486-T490 PolarHBondContact O-N 3.19Å; R486-T490 PolarHBondContact O-OG1 2.99Å; R486-T490 VanDerWaalsContact O-OG1 3.08Å
487	N	93.1	Very high	85.9	Confident	100 Å²	100	79.9 Å²	79.9	54%	0.535	41%	0.408	S	S	.	.	H	α-helix	trans	-61.4	-40.9	176.8	-69	-14.7	0	0	0	112.1	K483 M484 E485 T490 A491	K483-N487 PolarHBondContact O-N 3.05Å; K483-N487 VanDerWaalsContact O-N 3.1Å; M484-N487 PolarHBondContact O-N 3.08Å; E485-N487 VanDerWaalsContact C-N 3.31Å; E485-N487 PolarHBondContact O-N 2.66Å; N487-T490 PolarHBondContact O-N 3.31Å; N487-A491 WeakPolarHBondContact O-CB 3.4Å; N487-A491 PolarHBondContact O-N 3.48Å
488	R	92.6	Very high	85.3	Confident	122 Å²	122	82.8 Å²	82.8	46%	0.46	42%	0.423	S	S	.	.	H	α-helix	trans	-60.8	-46.7	176.3	-169.2	-168.4	71.9	81.3	-3.1	111.6	M484 E485 R486 A491 A492	M484-R488 PolarHBondContact O-N 2.86Å; E485-R488 WeakPolarHBondContact O-CB 3.48Å; E485-R488 PolarHBondContact O-N 3.09Å; E485-R488 VanDerWaalsContact O-N 3.15Å; E485-R488 IonicContact OE1-CZ 3.36Å; E485-R488 IonicContact OE1-NE 3.83Å; E485-R488 PolarHBondContact OE1-NE 2.94Å; E485-R488 IonicContact OE1-NH2 2.66Å; E485-R488 PolarHBondContact OE1-NH2 3.12Å; E485-R488 IonicContact OE2-CZ 3.66Å; E485-R488 IonicContact OE2-NE 3.12Å; E485-R488 PolarHBondContact OE2-NE 2.9Å; E485-R488 IonicContact OE2-NH2 3.69Å; R486-R488 VanDerWaalsContact C-N 3.32Å; R486-R488 PolarHBondContact O-N 3.39Å; R488-A491 PolarHBondContact O-N 3.38Å; R488-A492 PolarHBondContact O-N 3.23Å; R488-A492 VanDerWaalsContact O-N 3.08Å
489	L	87.2	Confident	84.5	Confident	31 Å²	31	87.4 Å²	87.4	16%	0.162	45%	0.447	C	S	.	.	H	α-helix	trans	-65	-40	179.5	-68.3	172.6	0	0	0	112.2	H162 E485 R486 Y493	H162-L489 WeakPolarHBondContact O-CD1 3.34Å; E485-L489 HydrophobicContact CG-CD1 4.08Å; E485-L489 HydrophobicContact CG-CG 4.37Å; E485-L489 WeakPolarHBondContact O-CG 3.26Å; E485-L489 PolarHBondContact O-N 3.14Å; R486-L489 PolarHBondContact O-N 3.25Å; L489-Y493 PolarHBondContact O-N 3.43Å
490	T	83.7	Confident	83.7	Confident	84 Å²	84	89.9 Å²	89.9	52%	0.515	45%	0.451	S	S	.	.	H	α-helix	trans	-69.1	-40	176.4	-54.5	0	0	0	0	112.4	R486 N487 A492 Y493 T494	R486-T490 PolarHBondContact O-N 3.19Å; R486-T490 PolarHBondContact O-OG1 2.99Å; R486-T490 VanDerWaalsContact O-OG1 3.08Å; N487-T490 PolarHBondContact O-N 3.31Å; T490-A492 PolarHBondContact O-N 2.95Å; T490-Y493 PolarHBondContact O-N 3.34Å; T490-T494 PolarHBondContact O-N 3.14Å; T490-T494 PolarHBondContact O-OG1 3.46Å
491	A	81.9	Confident	82.8	Confident	50 Å²	50	88.8 Å²	88.8	41%	0.413	45%	0.448	S	S	.	.	H	α-helix	trans	-63.1	-41.4	177.1	0	0	0	0	0	111.9	N487 R488 Y493 T494 Q495	N487-A491 WeakPolarHBondContact O-CB 3.4Å; N487-A491 PolarHBondContact O-N 3.48Å; R488-A491 PolarHBondContact O-N 3.38Å; A491-Y493 VanDerWaalsContact C-N 3.31Å; A491-Y493 PolarHBondContact O-N 3.4Å; A491-T494 PolarHBondContact O-N 3.4Å; A491-Q495 PolarHBondContact O-N 3.46Å
492	A	74.2	Confident	81.7	Confident	44 Å²	44	94.1 Å²	94.1	36%	0.364	48%	0.476	S	S	.	.	H	α-helix	trans	-62	-36.8	176.1	0	0	0	0	0	112.7	R488 T490 T494 Q495	R488-A492 PolarHBondContact O-N 3.23Å; R488-A492 VanDerWaalsContact O-N 3.08Å; T490-A492 PolarHBondContact O-N 2.95Å; A492-T494 VanDerWaalsContact C-N 3.32Å; A492-T494 PolarHBondContact O-N 3.2Å; A492-Q495 PolarHBondContact O-N 3.46Å
493	Y	62.8	Low	80.5	Confident	165 Å²	165	100.4 Å²	100.4	65%	0.647	51%	0.507	S	S	*	.	H	α-helix	trans	-70.4	-26.1	177.3	-171.9	-98.2	0	0	0	113.4	L489 T490 A491 Q495	L489-Y493 PolarHBondContact O-N 3.43Å; T490-Y493 PolarHBondContact O-N 3.34Å; A491-Y493 VanDerWaalsContact C-N 3.31Å; A491-Y493 PolarHBondContact O-N 3.4Å; Y493-Q495 VanDerWaalsContact C-N 3.32Å
494	T	63.9	Low	79.2	Confident	109 Å²	109	97.6 Å²	97.6	67%	0.669	50%	0.5	S	S	*	.	H	α-helix	trans	-84.2	-10.6	-179.2	-44.7	0	0	0	0	112.3	T490 A491 A492	T490-T494 PolarHBondContact O-N 3.14Å; T490-T494 PolarHBondContact O-OG1 3.46Å; A491-T494 PolarHBondContact O-N 3.4Å; A492-T494 VanDerWaalsContact C-N 3.32Å; A492-T494 PolarHBondContact O-N 3.2Å
495	Q	54	Low	77.8	Confident	171 Å²	171	96.3 Å²	96.3	80%	0.799	50%	0.496	S	S	*	.			trans	-102	-6.3	-178.7	-69.9	-178.6	-6.7	0	0	113.8	A491 A492 Y493	A491-Q495 PolarHBondContact O-N 3.46Å; A492-Q495 PolarHBondContact O-N 3.46Å; Y493-Q495 VanDerWaalsContact C-N 3.32Å
496	L	49.1	Very low	76.1	Confident	208 Å²	208	102.8 Å²	102.8	100%	1.089	53%	0.53	S	S	*	.			trans	-104.7	0	172.4	-69.1	168.3	0	0	0	109.1

Retrieved 496 of 496 residues in 190.1 ms (Link to these results)

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