A0A096NAR8_PAPAN Loading...

DNA-directed DNA/RNA polymerase mu

Gap-filling polymerase involved in repair of DNA double-strand breaks by non-homologous end joining (NHEJ). Participates in immunoglobulin (Ig) light chain gene rearrangement in V(D)J recombination.

AlphaFold DB (A0A2K5L0C4), UniProt , Accession A0A096NAR8, Species PAPAN (Papio anubis, Olive baboon), Gene POLM, Length 494 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	35.2	Very low	31.5	Very low	240 Å²	240	193.3 Å²	193.3	100%	1.182	88%	0.878	S	S	*	*				0	97.3	0	-76.9	-103.1	-177.2	0	0	108.5
2	L	27.5	Very low	32	Very low	166 Å²	166	186.8 Å²	186.8	87%	0.869	87%	0.872	S	S	*	*			trans	27.9	145.6	156	-70.9	164.8	0	0	0	122.9
3	P	38.4	Very low	32.2	Very low	95 Å²	95	181.5 Å²	181.5	62%	0.617	86%	0.863	S	S	*	*				-140.4	172.9	-110.2	42.8	-25.6	0	0	0	117.3
4	K	30.8	Very low	31.7	Very low	192 Å²	192	175.6 Å²	175.6	84%	0.835	85%	0.852	S	S	*	*			trans	61.7	139.1	142.9	-71.5	165.9	-178.2	-179.2	0	118.2
5	R	31.7	Very low	32.1	Very low	245 Å²	245	171.5 Å²	171.5	93%	0.925	85%	0.848	S	S	*	*				-160.1	149	56.7	-91.1	-174.7	155.5	168.4	-7.2	113.6
6	R	30.1	Very low	31.7	Very low	243 Å²	243	169.6 Å²	169.6	92%	0.917	84%	0.842	S	S	*	*			trans	-67.7	154.9	173.6	-102.2	171.3	161.1	-178.5	-5.4	114
7	R	35.3	Very low	32.1	Very low	252 Å²	252	166.2 Å²	166.2	95%	0.951	85%	0.847	S	S	*	*			trans	-48.1	147.8	158.8	-78.8	173.9	166.9	170.8	-4.5	113.5
8	A	28.6	Very low	32	Very low	107 Å²	107	163.1 Å²	163.1	88%	0.884	84%	0.837	S	S	*	*			trans	-125.4	141.1	154.8	0	0	0	0	0	109.9
9	R	30.2	Very low	32.4	Very low	235 Å²	235	160.8 Å²	160.8	89%	0.887	84%	0.838	S	S	*	*			trans	-98.1	145.2	-176.5	-114.2	-170.9	167	179.2	-3.2	110.1
10	V	34.8	Very low	32.4	Very low	115 Å²	115	158.1 Å²	158.1	70%	0.697	83%	0.832	S	S	*	*			trans	65.9	123	135.1	-179.7	0	0	0	0	119.3
11	R	24.4	Very low	32.4	Very low	236 Å²	236	156.5 Å²	156.5	89%	0.891	83%	0.829	S	S	*	*				-168.8	130.5	116.5	-109.4	177.8	174.1	178.1	-2.6	111.8
12	S	36.9	Very low	32.8	Very low	115 Å²	115	150.3 Å²	150.3	80%	0.804	81%	0.807	S	S	*	*			trans	-77.4	139.6	158	-23.5	0	0	0	0	108.5
13	P	34.8	Very low	33.9	Very low	118 Å²	118	147.7 Å²	147.7	77%	0.766	80%	0.8	S	S	*	*				-144.6	172.2	112.5	35.5	-18.1	0	0	0	109.5
14	S	25.5	Very low	34.7	Very low	100 Å²	100	148.3 Å²	148.3	70%	0.699	81%	0.807	S	S	*	*			cis	-165.1	159.6	10.1	26.6	0	0	0	0	105.3	D16	S14-D16 PolarHBondContact O-N 3.03Å
15	S	37.3	Very low	36.2	Very low	113 Å²	113	142.3 Å²	142.3	79%	0.79	79%	0.786	S	S	*	*			trans	-58.7	119.5	167.4	49.4	0	0	0	0	111.6
16	D	26.3	Very low	38.4	Very low	141 Å²	141	139.5 Å²	139.5	75%	0.754	78%	0.775	S	S	*	*			trans	-125.3	113.6	152.7	-91.2	-29.7	0	0	0	108.3	S14 T18	S14-D16 PolarHBondContact O-N 3.03Å; D16-T18 VanDerWaalsContact C-N 3.29Å; D16-T18 PolarHBondContact O-N 3.1Å
17	A	38.1	Very low	41	Very low	112 Å²	112	129.9 Å²	129.9	93%	0.926	74%	0.741	S	S	*	*			trans	-73.9	86.5	168.3	0	0	0	0	0	107.8
18	T	29.5	Very low	42.9	Very low	111 Å²	111	122.8 Å²	122.8	68%	0.681	73%	0.727	S	S	*	*			trans	-100.9	115	164.6	47.8	0	0	0	0	108.8	D16 S20	D16-T18 VanDerWaalsContact C-N 3.29Å; D16-T18 PolarHBondContact O-N 3.1Å; T18-S20 VanDerWaalsContact C-N 3.31Å; T18-S20 PolarHBondContact O-N 3.28Å
19	S	39.5	Very low	45.4	Very low	120 Å²	120	120.6 Å²	120.6	84%	0.839	72%	0.715	S	S	*	*			trans	-50.1	90.6	164.4	54.9	0	0	0	0	110.5	T21	S19-T21 PolarHBondContact O-N 3.38Å
20	S	33.1	Very low	48.1	Very low	105 Å²	105	110.3 Å²	110.3	73%	0.734	68%	0.678	S	S	*	*			trans	-85.5	96.5	169.1	63.8	0	0	0	0	107.5	T18	T18-S20 VanDerWaalsContact C-N 3.31Å; T18-S20 PolarHBondContact O-N 3.28Å
21	T	32.9	Very low	50.8	Low	125 Å²	125	105 Å²	105	77%	0.767	65%	0.646	S	S	*	*			trans	-35	128.3	155.2	1.3	0	0	0	0	109	S19	S19-T21 PolarHBondContact O-N 3.38Å
22	P	43.7	Very low	54.1	Low	110 Å²	110	93.8 Å²	93.8	71%	0.714	60%	0.604	S	S	*	*			trans	-54.6	136.5	179.3	21.1	-30.6	0	0	0	108.5	S24	P22-S24 PolarHBondContact O-N 3.28Å
23	P	49.7	Very low	56.8	Low	112 Å²	112	89.2 Å²	89.2	73%	0.727	57%	0.569	S	S	*	*			trans	-52.8	121.1	-177.4	20.2	-30.7	0	0	0	108.1	T25	P23-T25 PolarHBondContact O-N 3.43Å
24	S	56.1	Low	59.5	Low	107 Å²	107	83.6 Å²	83.6	75%	0.748	53%	0.533	S	S	*	.			trans	-50.8	111.2	-179.7	55.3	0	0	0	0	108.4	P22 R26	P22-S24 PolarHBondContact O-N 3.28Å; S24-R26 PolarHBondContact O-N 3.02Å; S24-R26 VanDerWaalsContact O-N 3.08Å
25	T	62.2	Low	62.6	Low	66 Å²	66	79.3 Å²	79.3	41%	0.405	50%	0.502	S	S	.	.			trans	-59.5	115.5	178.8	39.5	0	0	0	0	108.5	P23 F27 R57	P23-T25 PolarHBondContact O-N 3.43Å; T25-F27 PolarHBondContact O-N 3.26Å; T25-R57 HydrophobicContact CG2-CB 3.74Å; T25-R57 HydrophobicContact CG2-CG 4.1Å
26	R	78.1	Confident	64.8	Low	186 Å²	186	76.3 Å²	76.3	70%	0.702	48%	0.476	S	S	*	.	S	Bend	trans	-67.1	-21.4	-176.4	-77.7	-177.8	170.3	178.9	-3.9	112.6	S24 G55	S24-R26 PolarHBondContact O-N 3.02Å; S24-R26 VanDerWaalsContact O-N 3.08Å; R26-G55 PolarHBondContact N-O 3.46Å; R26-G55 VanDerWaalsContact N-O 3.1Å
27	F	84.1	Confident	67.2	Low	42 Å²	42	75 Å²	75	18%	0.184	48%	0.475	C	S	.	.			trans	-128.1	77.1	-173.8	-48	-66.9	0	0	0	111	T25 G29 V30 F56 Q113 P114	T25-F27 PolarHBondContact O-N 3.26Å; F27-G29 PolarHBondContact O-N 3.46Å; F27-V30 HydrophobicContact CB-CB 4.45Å; F27-V30 PolarHBondContact O-N 3.19Å; F27-F56 HydrophobicContact CD2-CD1 4.22Å; F27-F56 HydrophobicContact CD2-CE1 4.42Å; F27-F56 HydrophobicContact CD2-CG 4.31Å; F27-F56 HydrophobicContact CE2-CD2 4.4Å; F27-F56 HydrophobicContact CE2-CE2 4.27Å; F27-F56 HydrophobicContact CE2-CZ 4.36Å; F27-Q113 HydrophobicContact CE1-CB 3.92Å; F27-Q113 HydrophobicContact CZ-CB 3.79Å; F27-P114 HydrophobicContact CB-CG 3.99Å; F27-P114 VanDerWaalsContact CD1-CD 3.5Å; F27-P114 HydrophobicContact CD1-CG 4Å; F27-P114 HydrophobicContact CD2-CG 4.12Å; F27-P114 HydrophobicContact CG-CG 3.75Å
28	P	75.4	Confident	69.3	Low	103 Å²	103	75.8 Å²	75.8	67%	0.669	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-23.8	-174.5	25	-33.6	0	0	0	113.8	V30	P28-V30 VanDerWaalsContact C-N 3.3Å; P28-V30 PolarHBondContact O-N 2.72Å
29	G	80.9	Confident	72	Confident	61 Å²	61	71 Å²	71	63%	0.629	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-4.3	176.9	0	0	0	0	0	115.4	F27 T67	F27-G29 PolarHBondContact O-N 3.46Å; G29-T67 PolarHBondContact O-OG1 2.88Å
30	V	87.8	Confident	74.1	Confident	19 Å²	19	66.7 Å²	66.7	12%	0.115	40%	0.399	C	S	.	.			trans	-126.5	107.2	-175.6	-179	0	0	0	0	110	F27 P28 I32 T67 W104 P114	F27-V30 HydrophobicContact CB-CB 4.45Å; F27-V30 PolarHBondContact O-N 3.19Å; P28-V30 VanDerWaalsContact C-N 3.3Å; P28-V30 PolarHBondContact O-N 2.72Å; V30-I32 HydrophobicContact CG1-CD1 4.26Å; V30-I32 HydrophobicContact CG1-CG1 3.92Å; V30-T67 WeakPolarHBondContact CA-OG1 3.49Å; V30-W104 HydrophobicContact CG1-CH2 3.86Å; V30-W104 HydrophobicContact CG1-CZ2 4.48Å; V30-P114 HydrophobicContact CB-CG 4.24Å; V30-P114 HydrophobicContact CG1-CG 4.38Å; V30-P114 HydrophobicContact CG2-CB 4.02Å; V30-P114 HydrophobicContact CG2-CG 3.88Å
31	A	90.9	Very high	76.6	Confident	3 Å²	3	70.8 Å²	70.8	3%	0.025	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	115.3	175.3	0	0	0	0	0	109.3	L59 E65 T67 H68	A31-L59 HydrophobicContact CB-CD1 4.27Å; A31-L59 HydrophobicContact CB-CG 4.43Å; A31-E65 WeakPolarHBondContact CB-O 3.36Å; A31-T67 PolarHBondContact N-OG1 3.1Å; A31-T67 PolarHBondContact O-N 3.44Å; A31-H68 PolarHBondContact O-N 2.8Å
32	I	93.1	Very high	79.3	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	131	-170.3	-57.3	172.4	0	0	0	109.8	V30 L34 F56 R57 V58 L59 H68 V70 W104 L105	V30-I32 HydrophobicContact CG1-CD1 4.26Å; V30-I32 HydrophobicContact CG1-CG1 3.92Å; I32-L34 HydrophobicContact CG2-CD2 3.69Å; I32-L34 HydrophobicContact CG2-CG 4.46Å; I32-F56 HydrophobicContact CD1-CB 4.18Å; I32-F56 HydrophobicContact CD1-CD1 3.68Å; I32-F56 HydrophobicContact CD1-CE1 4.47Å; I32-F56 HydrophobicContact CD1-CG 4.27Å; I32-R57 PolarHBondContact N-O 3.11Å; I32-V58 HydrophobicContact CB-CG2 4.44Å; I32-V58 CarbonylContact O-C 3.48Å; I32-V58 WeakPolarHBondContact O-CA 3.11Å; I32-L59 PolarHBondContact O-N 3.03Å; I32-H68 CarbonylContact C-O 3.6Å; I32-H68 WeakPolarHBondContact CA-O 3.48Å; I32-H68 HydrophobicContact CG1-CB 4.35Å; I32-V70 HydrophobicContact CG2-CG2 3.94Å; I32-W104 HydrophobicContact CD1-CH2 4Å; I32-W104 HydrophobicContact CD1-CZ3 3.81Å; I32-W104 HydrophobicContact CG1-CH2 4.28Å; I32-W104 HydrophobicContact CG1-CZ3 4.13Å; I32-L105 HydrophobicContact CD1-CD1 3.97Å
33	Y	93.5	Very high	81.6	Confident	19 Å²	19	69.6 Å²	69.6	8%	0.075	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	129.8	165.8	178.6	-102.4	0	0	0	110.4	V35 L59 A61 C62 H68 V69 V70 W82	Y33-V35 HydrophobicContact CD1-CG2 4.11Å; Y33-V35 HydrophobicContact CE1-CG2 3.94Å; Y33-L59 HydrophobicContact CD2-CB 4.49Å; Y33-A61 VanDerWaalsContact CD2-C 3.46Å; Y33-C62 HydrophobicContact CD1-CB 3.88Å; Y33-C62 HydrophobicContact CD2-CB 4.06Å; Y33-C62 HydrophobicContact CE1-CB 3.71Å; Y33-C62 HydrophobicContact CE2-CB 3.89Å; Y33-C62 HydrophobicContact CG-CB 4.04Å; Y33-H68 PolarHBondContact N-O 3.24Å; Y33-V69 HydrophobicContact CD1-CG1 4.35Å; Y33-V69 WeakPolarHBondContact O-CA 3.34Å; Y33-V70 PolarHBondContact O-N 3.34Å; Y33-W82 HydrophobicContact CD1-CH2 4.17Å; Y33-W82 HydrophobicContact CD1-CZ2 4.27Å; Y33-W82 HydrophobicContact CE1-CH2 4.14Å; Y33-W82 AromaticContact CE1-CZ2 3.79Å; Y33-W82 HydrophobicContact CE1-CZ2 3.79Å
34	L	91.9	Very high	83.7	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	124.9	179.7	-56	-174.6	0	0	0	110.9	I32 M39 R44 L47 V58 V70 L105	I32-L34 HydrophobicContact CG2-CD2 3.69Å; I32-L34 HydrophobicContact CG2-CG 4.46Å; L34-M39 HydrophobicContact CB-CE 4.12Å; L34-M39 HydrophobicContact CB-SD 4.05Å; L34-M39 HydrophobicContact CD1-SD 4.32Å; L34-M39 HydrophobicContact CD2-CE 4.5Å; L34-R44 HydrophobicContact CB-CG 4.11Å; L34-R44 HydrophobicContact CD1-CG 4.44Å; L34-L47 HydrophobicContact CD1-CB 3.73Å; L34-V58 HydrophobicContact CD1-CG1 4.49Å; L34-V58 HydrophobicContact CG-CG1 4.28Å; L34-V70 HydrophobicContact CD2-CB 3.8Å; L34-V70 HydrophobicContact CD2-CG1 4.31Å; L34-V70 HydrophobicContact CD2-CG2 4.38Å; L34-L105 HydrophobicContact CD1-CD2 4.46Å; L34-L105 HydrophobicContact CD2-CD2 3.59Å
35	V	89.6	Confident	85.3	Confident	9 Å²	9	63 Å²	63	6%	0.055	34%	0.335	C	S	.	.			trans	-85.2	117.4	-177.6	178.8	0	0	0	0	110.9	Y33 M39 V69 V70 M71 W82	Y33-V35 HydrophobicContact CD1-CG2 4.11Å; Y33-V35 HydrophobicContact CE1-CG2 3.94Å; V35-M39 VanDerWaalsContact O-CB 3.32Å; V35-M39 WeakPolarHBondContact O-CB 3.26Å; V35-V69 HydrophobicContact CG2-CG1 3.51Å; V35-V70 PolarHBondContact N-O 3.32Å; V35-M71 HydrophobicContact CB-CB 4.42Å; V35-M71 HydrophobicContact CB-CG 3.93Å; V35-M71 HydrophobicContact CG1-CG 4.44Å; V35-M71 HydrophobicContact CG2-CE 4.03Å; V35-M71 HydrophobicContact CG2-CG 3.75Å; V35-M71 HydrophobicContact CG2-SD 4.39Å; V35-W82 HydrophobicContact CG2-CH2 4.27Å; V35-W82 HydrophobicContact CG2-CZ2 3.87Å
36	E	84.2	Confident	86.8	Confident	51 Å²	51	65 Å²	65	24%	0.238	34%	0.338	C	S	.	.	H	α-helix	trans	-74	-42.2	-169.7	-171.6	174.3	130.9	0	0	117.1	R38 M39 G40 R41 R44	E36-R38 PolarHBondContact O-N 2.8Å; E36-R38 VanDerWaalsContact O-N 3.13Å; E36-M39 PolarHBondContact O-N 2.77Å; E36-M39 VanDerWaalsContact O-N 3.09Å; E36-G40 PolarHBondContact O-N 2.9Å; E36-R41 VanDerWaalsContact CD-CG 3.46Å; E36-R41 HydrophobicContact CG-CG 4.16Å; E36-R41 WeakPolarHBondContact OE1-CG 3.43Å; E36-R41 IonicContact OE1-CZ 2.7Å; E36-R41 IonicContact OE1-NE 3.96Å; E36-R41 PolarHBondContact OE1-NE 3.26Å; E36-R44 IonicContact OE2-CZ 2.59Å; E36-R44 IonicContact OE2-NH1 3.55Å; E36-R44 PolarHBondContact OE2-NH1 3.49Å
37	P	77.1	Confident	87.6	Confident	114 Å²	114	56.4 Å²	56.4	74%	0.74	31%	0.306	S	S	*	.	H	α-helix	trans	-51.5	-44	-162.6	-32.7	36.1	0	0	0	116.5
38	R	81.6	Confident	88	Confident	127 Å²	127	55.1 Å²	55.1	48%	0.479	30%	0.301	S	S	.	.	H	α-helix	trans	-94.1	-23.5	177.7	-67	-167.4	177.9	-111.1	-2	113.8	E36 E72 Q73 E78	E36-R38 PolarHBondContact O-N 2.8Å; E36-R38 VanDerWaalsContact O-N 3.13Å; R38-E72 VanDerWaalsContact CB-O 3.27Å; R38-E72 WeakPolarHBondContact CB-O 3.4Å; R38-Q73 WeakPolarHBondContact CD-O 3.41Å; R38-Q73 PolarHBondContact NH1-O 3.38Å; R38-E78 IonicContact CZ-OE1 3.12Å; R38-E78 IonicContact CZ-OE2 3.16Å; R38-E78 IonicContact NE-OE1 2.87Å; R38-E78 IonicContact NE-OE2 3.51Å; R38-E78 PolarHBondContact NE-OE2 3.1Å; R38-E78 VanDerWaalsContact NH2-CD 3.27Å; R38-E78 IonicContact NH2-OE1 3.25Å; R38-E78 PolarHBondContact NH2-OE1 3.07Å; R38-E78 IonicContact NH2-OE2 2.66Å; R38-E78 PolarHBondContact NH2-OE2 3.23Å
39	M	86.9	Confident	88.9	Confident	10 Å²	10	57.8 Å²	57.8	5%	0.049	30%	0.298	C	S	.	.	H	α-helix	trans	-74.5	-35.7	177.6	-175.6	-179.9	-63.7	0	0	112.3	L34 V35 E36 R43 R44 L47 E72 I102	L34-M39 HydrophobicContact CB-CE 4.12Å; L34-M39 HydrophobicContact CB-SD 4.05Å; L34-M39 HydrophobicContact CD1-SD 4.32Å; L34-M39 HydrophobicContact CD2-CE 4.5Å; V35-M39 VanDerWaalsContact O-CB 3.32Å; V35-M39 WeakPolarHBondContact O-CB 3.26Å; E36-M39 PolarHBondContact O-N 2.77Å; E36-M39 VanDerWaalsContact O-N 3.09Å; M39-R43 HydrophobicContact CG-CB 4.15Å; M39-R43 HydrophobicContact CG-CG 3.99Å; M39-R43 VanDerWaalsContact O-CB 3.27Å; M39-R43 WeakPolarHBondContact O-CB 3.41Å; M39-R44 HydrophobicContact CG-CB 4.39Å; M39-R44 HydrophobicContact SD-CB 3.83Å; M39-R44 HydrophobicContact SD-CG 4.33Å; M39-L47 HydrophobicContact CE-CD1 4.29Å; M39-L47 HydrophobicContact CG-CD1 4.47Å; M39-L47 HydrophobicContact SD-CD1 3.82Å; M39-E72 HydrophobicContact CB-CB 4.27Å; M39-E72 HydrophobicContact CE-CB 4.21Å; M39-E72 WeakPolarHBondContact CG-OE2 3.37Å; M39-I102 HydrophobicContact CE-CD1 4.17Å
40	G	83.7	Confident	89.5	Confident	31 Å²	31	57.4 Å²	57.4	32%	0.32	28%	0.281	S	S	.	.			trans	80.1	147.3	-175.2	0	0	0	0	0	114	E36 S42 R43 R44	E36-G40 PolarHBondContact O-N 2.9Å; G40-S42 PolarHBondContact O-N 3.27Å; G40-R43 PolarHBondContact O-N 3.22Å; G40-R44 WeakPolarHBondContact O-CB 3.47Å; G40-R44 PolarHBondContact O-N 3.48Å
41	R	86	Confident	89.7	Confident	191 Å²	191	56.6 Å²	56.6	72%	0.721	28%	0.276	S	S	*	.	H	α-helix	trans	-54.8	-47.1	-175.6	-76.2	-178.3	-176.7	178.6	5.2	114	E36 R43 R44 A45	E36-R41 VanDerWaalsContact CD-CG 3.46Å; E36-R41 HydrophobicContact CG-CG 4.16Å; E36-R41 WeakPolarHBondContact OE1-CG 3.43Å; E36-R41 IonicContact OE1-CZ 2.7Å; E36-R41 IonicContact OE1-NE 3.96Å; E36-R41 PolarHBondContact OE1-NE 3.26Å; R41-R43 VanDerWaalsContact C-N 3.35Å; R41-R43 PolarHBondContact O-N 3.34Å; R41-R44 PolarHBondContact O-N 3.37Å; R41-A45 WeakPolarHBondContact O-CB 3.38Å; R41-A45 PolarHBondContact O-N 2.98Å
42	S	89.8	Confident	89.8	Confident	106 Å²	106	61.2 Å²	61.2	74%	0.741	29%	0.293	S	S	*	.	H	α-helix	trans	-62.5	-43.1	-177	-56.5	0	0	0	0	111.8	G40 F46	G40-S42 PolarHBondContact O-N 3.27Å; S42-F46 PolarHBondContact O-N 3.38Å
43	R	91.7	Very high	89.7	Confident	103 Å²	103	65.6 Å²	65.6	39%	0.389	32%	0.324	S	S	.	.	H	α-helix	trans	-72.8	-42.4	-179.8	-175.3	158.8	173.5	83.3	-2.7	111.9	M39 G40 R41 A45 F46 L47 E72	M39-R43 HydrophobicContact CG-CB 4.15Å; M39-R43 HydrophobicContact CG-CG 3.99Å; M39-R43 VanDerWaalsContact O-CB 3.27Å; M39-R43 WeakPolarHBondContact O-CB 3.41Å; G40-R43 PolarHBondContact O-N 3.22Å; R41-R43 VanDerWaalsContact C-N 3.35Å; R41-R43 PolarHBondContact O-N 3.34Å; R43-A45 VanDerWaalsContact C-N 3.32Å; R43-A45 PolarHBondContact O-N 2.62Å; R43-F46 PolarHBondContact O-N 3.33Å; R43-L47 HydrophobicContact CG-CD1 3.98Å; R43-L47 HydrophobicContact CG-CG 4.41Å; R43-L47 WeakPolarHBondContact O-CG 3.04Å; R43-L47 PolarHBondContact O-N 3.47Å; R43-E72 WeakPolarHBondContact CD-OE2 3.49Å; R43-E72 IonicContact CZ-OE1 3.61Å; R43-E72 IonicContact CZ-OE2 2.93Å; R43-E72 IonicContact NE-OE1 2.95Å; R43-E72 PolarHBondContact NE-OE1 3.33Å; R43-E72 IonicContact NE-OE2 2.59Å; R43-E72 PolarHBondContact NE-OE2 3.23Å; R43-E72 IonicContact NH2-OE1 3.37Å; R43-E72 PolarHBondContact NH2-OE1 2.88Å; R43-E72 IonicContact NH2-OE2 2.69Å
44	R	92.4	Very high	89.5	Confident	42 Å²	42	68.2 Å²	68.2	16%	0.158	34%	0.336	C	S	.	.	H	α-helix	trans	-55	-47.4	171.8	-179.9	179.8	171.5	-166.4	0.4	111.6	L34 E36 M39 G40 R41 F46 L47 T48 D60	L34-R44 HydrophobicContact CB-CG 4.11Å; L34-R44 HydrophobicContact CD1-CG 4.44Å; E36-R44 IonicContact OE2-CZ 2.59Å; E36-R44 IonicContact OE2-NH1 3.55Å; E36-R44 PolarHBondContact OE2-NH1 3.49Å; M39-R44 HydrophobicContact CG-CB 4.39Å; M39-R44 HydrophobicContact SD-CB 3.83Å; M39-R44 HydrophobicContact SD-CG 4.33Å; G40-R44 WeakPolarHBondContact O-CB 3.47Å; G40-R44 PolarHBondContact O-N 3.48Å; R41-R44 PolarHBondContact O-N 3.37Å; R44-F46 PolarHBondContact O-N 2.75Å; R44-L47 PolarHBondContact O-N 3.2Å; R44-T48 VanDerWaalsContact O-CB 3.3Å; R44-T48 WeakPolarHBondContact O-CB 3.23Å; R44-T48 PolarHBondContact O-N 2.82Å; R44-T48 PolarHBondContact O-OG1 3.48Å; R44-D60 PolarHBondContact NH2-O 2.86Å
45	A	90.1	Very high	89.3	Confident	40 Å²	40	68.9 Å²	68.9	33%	0.331	34%	0.343	S	S	.	.	H	α-helix	trans	-65.1	-39.3	179.6	0	0	0	0	0	112.5	R41 R43 R49	R41-A45 WeakPolarHBondContact O-CB 3.38Å; R41-A45 PolarHBondContact O-N 2.98Å; R43-A45 VanDerWaalsContact C-N 3.32Å; R43-A45 PolarHBondContact O-N 2.62Å; A45-R49 WeakPolarHBondContact O-CG 3.28Å; A45-R49 PolarHBondContact O-N 3.33Å; A45-R49 VanDerWaalsContact O-N 3.13Å
46	F	94.1	Very high	89.3	Confident	108 Å²	108	68.7 Å²	68.7	47%	0.474	34%	0.341	S	S	.	.	H	α-helix	trans	-61.6	-52.9	174.1	171.6	-99.1	0	0	0	111.8	S42 R43 R44 T48 R49 L50	S42-F46 PolarHBondContact O-N 3.38Å; R43-F46 PolarHBondContact O-N 3.33Å; R44-F46 PolarHBondContact O-N 2.75Å; F46-T48 VanDerWaalsContact C-N 3.31Å; F46-T48 PolarHBondContact O-N 2.81Å; F46-R49 PolarHBondContact O-N 2.89Å; F46-L50 HydrophobicContact CE1-CD2 4Å; F46-L50 HydrophobicContact CZ-CD2 4.09Å; F46-L50 WeakPolarHBondContact O-CB 3.43Å; F46-L50 PolarHBondContact O-N 2.97Å
47	L	94.3	Very high	89.7	Confident	5 Å²	5	70.1 Å²	70.1	3%	0.026	34%	0.344	C	S	.	.	H	α-helix	trans	-62.5	-38.6	-179.6	-70.2	170.8	0	0	0	112	L34 M39 R43 R44 L50 A51 I102 L105 L109	L34-L47 HydrophobicContact CD1-CB 3.73Å; M39-L47 HydrophobicContact CE-CD1 4.29Å; M39-L47 HydrophobicContact CG-CD1 4.47Å; M39-L47 HydrophobicContact SD-CD1 3.82Å; R43-L47 HydrophobicContact CG-CD1 3.98Å; R43-L47 HydrophobicContact CG-CG 4.41Å; R43-L47 WeakPolarHBondContact O-CG 3.04Å; R43-L47 PolarHBondContact O-N 3.47Å; R44-L47 PolarHBondContact O-N 3.2Å; L47-L50 PolarHBondContact O-N 2.89Å; L47-A51 VanDerWaalsContact O-CB 3.23Å; L47-A51 WeakPolarHBondContact O-CB 3.37Å; L47-A51 PolarHBondContact O-N 3.03Å; L47-I102 HydrophobicContact CD1-CD1 3.74Å; L47-L105 HydrophobicContact CB-CD2 4.47Å; L47-L105 HydrophobicContact CD1-CD2 4.47Å; L47-L109 HydrophobicContact CD2-CD1 4.36Å
48	T	93.4	Very high	90.3	Very high	14 Å²	14	65.1 Å²	65.1	9%	0.086	31%	0.312	C	S	.	.	H	α-helix	trans	-60.7	-48.7	175.9	-59.5	0	0	0	0	111.4	R44 F46 R52 V58	R44-T48 VanDerWaalsContact O-CB 3.3Å; R44-T48 WeakPolarHBondContact O-CB 3.23Å; R44-T48 PolarHBondContact O-N 2.82Å; R44-T48 PolarHBondContact O-OG1 3.48Å; F46-T48 VanDerWaalsContact C-N 3.31Å; F46-T48 PolarHBondContact O-N 2.81Å; T48-R52 WeakPolarHBondContact O-CB 3.37Å; T48-R52 VanDerWaalsContact O-CG 3.3Å; T48-R52 WeakPolarHBondContact O-CG 3.39Å; T48-R52 PolarHBondContact O-N 3.05Å; T48-V58 HydrophobicContact CG2-CB 4.27Å; T48-V58 HydrophobicContact CG2-CG1 3.99Å
49	R	93.1	Very high	90.8	Very high	159 Å²	159	60 Å²	60	60%	0.6	29%	0.293	S	S	*	.	H	α-helix	trans	-63.4	-43.4	177	-73.3	-170.6	-61.3	-90.6	-0.1	111.7	A45 F46 R52 S53	A45-R49 WeakPolarHBondContact O-CG 3.28Å; A45-R49 PolarHBondContact O-N 3.33Å; A45-R49 VanDerWaalsContact O-N 3.13Å; F46-R49 PolarHBondContact O-N 2.89Å; R49-R52 PolarHBondContact O-N 3.11Å; R49-S53 WeakPolarHBondContact O-CB 3.43Å; R49-S53 PolarHBondContact O-N 3.08Å
50	L	94.1	Very high	90.7	Very high	54 Å²	54	65 Å²	65	28%	0.283	32%	0.32	S	S	.	.	H	α-helix	trans	-62.2	-49.1	179.7	-179	57.5	0	0	0	111.5	F46 L47 S53 K54 L109	F46-L50 HydrophobicContact CE1-CD2 4Å; F46-L50 HydrophobicContact CZ-CD2 4.09Å; F46-L50 WeakPolarHBondContact O-CB 3.43Å; F46-L50 PolarHBondContact O-N 2.97Å; L47-L50 PolarHBondContact O-N 2.89Å; L50-S53 PolarHBondContact O-N 3.1Å; L50-S53 PolarHBondContact O-OG 3.35Å; L50-K54 PolarHBondContact O-N 3.11Å; L50-K54 VanDerWaalsContact O-N 3.16Å; L50-L109 HydrophobicContact CD2-CD1 3.94Å; L50-L109 HydrophobicContact CG-CD1 4.19Å; L50-L109 HydrophobicContact CG-CD2 4.43Å
51	A	92.5	Very high	90.8	Very high	1 Å²	1	66.6 Å²	66.6	1%	0.008	33%	0.331	C	S	.	.	H	α-helix	trans	-63.3	-44.5	178.5	0	0	0	0	0	112.6	L47 S53 K54 G55 F56 V58 L109	L47-A51 VanDerWaalsContact O-CB 3.23Å; L47-A51 WeakPolarHBondContact O-CB 3.37Å; L47-A51 PolarHBondContact O-N 3.03Å; A51-S53 VanDerWaalsContact C-N 3.32Å; A51-S53 PolarHBondContact O-N 3.19Å; A51-K54 CarbonylContact O-C 3.57Å; A51-K54 PolarHBondContact O-N 3.13Å; A51-K54 VanDerWaalsContact O-N 3.08Å; A51-G55 PolarHBondContact O-N 2.98Å; A51-F56 HydrophobicContact CB-CB 4.1Å; A51-F56 WeakPolarHBondContact O-CB 3.43Å; A51-F56 WeakPolarHBondContact O-CD2 3.43Å; A51-F56 PolarHBondContact O-N 2.93Å; A51-V58 HydrophobicContact CB-CG2 3.58Å; A51-L109 HydrophobicContact CB-CD2 3.87Å
52	R	93.4	Very high	90.6	Very high	100 Å²	100	59.6 Å²	59.6	38%	0.377	31%	0.311	S	S	.	.	H	α-helix	trans	-61	-40.4	174.9	-73.7	177.5	177.4	164.2	2.5	112	T48 R49 K54 G55 V58 D60	T48-R52 WeakPolarHBondContact O-CB 3.37Å; T48-R52 VanDerWaalsContact O-CG 3.3Å; T48-R52 WeakPolarHBondContact O-CG 3.39Å; T48-R52 PolarHBondContact O-N 3.05Å; R49-R52 PolarHBondContact O-N 3.11Å; R52-K54 PolarHBondContact O-N 3.28Å; R52-G55 PolarHBondContact O-N 2.83Å; R52-V58 HydrophobicContact CG-CB 4.37Å; R52-V58 HydrophobicContact CG-CG2 4.37Å; R52-V58 PolarHBondContact NH2-O 3.39Å; R52-D60 IonicContact CZ-OD1 2.73Å; R52-D60 IonicContact NH1-OD1 3.56Å; R52-D60 PolarHBondContact NH1-OD1 2.93Å; R52-D60 IonicContact NH2-OD1 3.81Å; R52-D60 PolarHBondContact NH2-OD1 3.08Å; R52-D60 IonicContact NH2-OD2 3.84Å; R52-D60 PolarHBondContact NH2-OD2 3.26Å
53	S	90.5	Very high	90.2	Very high	92 Å²	92	56.9 Å²	56.9	64%	0.643	29%	0.292	S	S	*	.	H	α-helix	trans	-63.3	-26.2	176	77.6	0	0	0	0	113.3	R49 L50 A51	R49-S53 WeakPolarHBondContact O-CB 3.43Å; R49-S53 PolarHBondContact O-N 3.08Å; L50-S53 PolarHBondContact O-N 3.1Å; L50-S53 PolarHBondContact O-OG 3.35Å; A51-S53 VanDerWaalsContact C-N 3.32Å; A51-S53 PolarHBondContact O-N 3.19Å
54	K	89.2	Confident	89.6	Confident	75 Å²	75	57.3 Å²	57.3	33%	0.326	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	5.7	174.6	-64.9	-159.3	175.8	-157.9	0	113.6	L50 A51 R52 F56 L109	L50-K54 PolarHBondContact O-N 3.11Å; L50-K54 VanDerWaalsContact O-N 3.16Å; A51-K54 CarbonylContact O-C 3.57Å; A51-K54 PolarHBondContact O-N 3.13Å; A51-K54 VanDerWaalsContact O-N 3.08Å; R52-K54 PolarHBondContact O-N 3.28Å; K54-F56 HydrophobicContact CB-CD2 3.91Å; K54-F56 HydrophobicContact CB-CE2 3.97Å; K54-L109 HydrophobicContact CD-CD2 4.19Å; K54-L109 WeakPolarHBondContact CD-O 3.21Å; K54-L109 WeakPolarHBondContact CE-O 3.38Å; K54-L109 PolarHBondContact NZ-O 3.04Å
55	G	86.7	Confident	89.1	Confident	15 Å²	15	60 Å²	60	16%	0.155	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	9.4	174.4	0	0	0	0	0	115.6	R26 A51 R52	R26-G55 PolarHBondContact N-O 3.46Å; R26-G55 VanDerWaalsContact N-O 3.1Å; A51-G55 PolarHBondContact O-N 2.98Å; R52-G55 PolarHBondContact O-N 2.83Å
56	F	89.9	Confident	89	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.018	31%	0.312	C	S	.	.			trans	-77.2	141.9	174	-67.5	-98.9	0	0	0	111.5	F27 I32 A51 K54 V58 L109 P114	F27-F56 HydrophobicContact CD2-CD1 4.22Å; F27-F56 HydrophobicContact CD2-CE1 4.42Å; F27-F56 HydrophobicContact CD2-CG 4.31Å; F27-F56 HydrophobicContact CE2-CD2 4.4Å; F27-F56 HydrophobicContact CE2-CE2 4.27Å; F27-F56 HydrophobicContact CE2-CZ 4.36Å; I32-F56 HydrophobicContact CD1-CB 4.18Å; I32-F56 HydrophobicContact CD1-CD1 3.68Å; I32-F56 HydrophobicContact CD1-CE1 4.47Å; I32-F56 HydrophobicContact CD1-CG 4.27Å; A51-F56 HydrophobicContact CB-CB 4.1Å; A51-F56 WeakPolarHBondContact O-CB 3.43Å; A51-F56 WeakPolarHBondContact O-CD2 3.43Å; A51-F56 PolarHBondContact O-N 2.93Å; K54-F56 HydrophobicContact CB-CD2 3.91Å; K54-F56 HydrophobicContact CB-CE2 3.97Å; F56-V58 PolarHBondContact O-N 2.59Å; F56-L109 HydrophobicContact CD2-CD2 4.12Å; F56-L109 HydrophobicContact CE2-CD2 3.99Å; F56-P114 HydrophobicContact CD1-CG 4.27Å; F56-P114 HydrophobicContact CE1-CB 4.23Å; F56-P114 HydrophobicContact CE1-CG 3.69Å; F56-P114 HydrophobicContact CZ-CG 4.48Å
57	R	92.6	Very high	88.7	Confident	82 Å²	82	56 Å²	56	31%	0.309	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	108.2	171.2	-174.4	178.6	175.8	179.8	0.1	109.3	T25 I32 E65	T25-R57 HydrophobicContact CG2-CB 3.74Å; T25-R57 HydrophobicContact CG2-CG 4.1Å; I32-R57 PolarHBondContact N-O 3.11Å; R57-E65 IonicContact CZ-OE2 3.9Å; R57-E65 IonicContact NH2-OE1 2.86Å; R57-E65 PolarHBondContact NH2-OE1 3.27Å; R57-E65 IonicContact NH2-OE2 3.19Å; R57-E65 PolarHBondContact NH2-OE2 3.09Å
58	V	91.3	Very high	88.6	Confident	8 Å²	8	57 Å²	57	5%	0.048	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	123.2	174.9	-172.8	0	0	0	0	109.9	I32 L34 T48 A51 R52 F56	I32-V58 HydrophobicContact CB-CG2 4.44Å; I32-V58 CarbonylContact O-C 3.48Å; I32-V58 WeakPolarHBondContact O-CA 3.11Å; L34-V58 HydrophobicContact CD1-CG1 4.49Å; L34-V58 HydrophobicContact CG-CG1 4.28Å; T48-V58 HydrophobicContact CG2-CB 4.27Å; T48-V58 HydrophobicContact CG2-CG1 3.99Å; A51-V58 HydrophobicContact CB-CG2 3.58Å; R52-V58 HydrophobicContact CG-CB 4.37Å; R52-V58 HydrophobicContact CG-CG2 4.37Å; R52-V58 PolarHBondContact NH2-O 3.39Å; F56-V58 PolarHBondContact O-N 2.59Å
59	L	90.4	Very high	88.6	Confident	19 Å²	19	56.3 Å²	56.3	10%	0.099	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	136.7	-179	-55.7	175.5	0	0	0	111	A31 I32 Y33 A61 E65 A66	A31-L59 HydrophobicContact CB-CD1 4.27Å; A31-L59 HydrophobicContact CB-CG 4.43Å; I32-L59 PolarHBondContact O-N 3.03Å; Y33-L59 HydrophobicContact CD2-CB 4.49Å; L59-A61 WeakPolarHBondContact CB-O 3.44Å; L59-E65 HydrophobicContact CD1-CB 4.32Å; L59-A66 HydrophobicContact CD1-CB 3.79Å
60	D	86	Confident	88.6	Confident	115 Å²	115	48.7 Å²	48.7	62%	0.615	28%	0.278	S	S	*	.	S	Bend	trans	-76.2	-27	177.4	-65.5	-51.3	0	0	0	112.3	R44 R52	R44-D60 PolarHBondContact NH2-O 2.86Å; R52-D60 IonicContact CZ-OD1 2.73Å; R52-D60 IonicContact NH1-OD1 3.56Å; R52-D60 PolarHBondContact NH1-OD1 2.93Å; R52-D60 IonicContact NH2-OD1 3.81Å; R52-D60 PolarHBondContact NH2-OD1 3.08Å; R52-D60 IonicContact NH2-OD2 3.84Å; R52-D60 PolarHBondContact NH2-OD2 3.26Å
61	A	84.8	Confident	88.5	Confident	65 Å²	65	46.2 Å²	46.2	54%	0.537	26%	0.264	S	S	.	.	S	Bend	trans	-129.7	153.6	175.4	0	0	0	0	0	110.4	Y33 L59 S63	Y33-A61 VanDerWaalsContact CD2-C 3.46Å; L59-A61 WeakPolarHBondContact CB-O 3.44Å; A61-S63 PolarHBondContact O-N 2.9Å
62	C	81.4	Confident	88.4	Confident	45 Å²	45	47.1 Å²	47.1	30%	0.304	27%	0.269	S	S	.	.			trans	-73.2	120	174.4	-172.2	0	0	0	0	108.4	Y33	Y33-C62 HydrophobicContact CD1-CB 3.88Å; Y33-C62 HydrophobicContact CD2-CB 4.06Å; Y33-C62 HydrophobicContact CE1-CB 3.71Å; Y33-C62 HydrophobicContact CE2-CB 3.89Å; Y33-C62 HydrophobicContact CG-CB 4.04Å
63	S	82.6	Confident	88	Confident	49 Å²	49	49.3 Å²	49.3	34%	0.343	28%	0.283	S	S	.	.			trans	-132.1	171.9	177.9	66.5	0	0	0	0	110.1	A61 E65 A66	A61-S63 PolarHBondContact O-N 2.9Å; S63-E65 PolarHBondContact O-N 3.31Å; S63-E65 VanDerWaalsContact O-N 3.13Å; S63-E65 WeakPolarHBondContact OG-CB 3.26Å; S63-E65 PolarHBondContact OG-N 3.4Å; S63-A66 WeakPolarHBondContact O-CB 3.16Å; S63-A66 PolarHBondContact O-N 3.16Å; S63-A66 VanDerWaalsContact O-N 3.11Å
64	S	79.6	Confident	87.8	Confident	111 Å²	111	45.9 Å²	45.9	78%	0.776	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-11.4	172	50.4	0	0	0	0	113.6	A66	S64-A66 VanDerWaalsContact C-N 3.31Å
65	E	81.7	Confident	87.5	Confident	100 Å²	100	44.5 Å²	44.5	47%	0.467	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-15.4	174.7	-54.6	-172	136.4	0	0	113	A31 R57 L59 S63 T67	A31-E65 WeakPolarHBondContact CB-O 3.36Å; R57-E65 IonicContact CZ-OE2 3.9Å; R57-E65 IonicContact NH2-OE1 2.86Å; R57-E65 PolarHBondContact NH2-OE1 3.27Å; R57-E65 IonicContact NH2-OE2 3.19Å; R57-E65 PolarHBondContact NH2-OE2 3.09Å; L59-E65 HydrophobicContact CD1-CB 4.32Å; S63-E65 PolarHBondContact O-N 3.31Å; S63-E65 VanDerWaalsContact O-N 3.13Å; S63-E65 WeakPolarHBondContact OG-CB 3.26Å; S63-E65 PolarHBondContact OG-N 3.4Å; E65-T67 PolarHBondContact O-N 3.26Å
66	A	86.6	Confident	87.3	Confident	8 Å²	8	44.8 Å²	44.8	7%	0.066	26%	0.259	C	S	.	.			trans	-65	124.5	-179.7	0	0	0	0	0	109.6	L59 S63 S64 V69 P97	L59-A66 HydrophobicContact CD1-CB 3.79Å; S63-A66 WeakPolarHBondContact O-CB 3.16Å; S63-A66 PolarHBondContact O-N 3.16Å; S63-A66 VanDerWaalsContact O-N 3.11Å; S64-A66 VanDerWaalsContact C-N 3.31Å; A66-V69 HydrophobicContact CB-CG2 4.43Å; A66-P97 WeakPolarHBondContact O-CB 3.33Å
67	T	88.6	Confident	86.8	Confident	54 Å²	54	50 Å²	50	33%	0.331	28%	0.284	S	S	.	.	S	Bend	trans	-100.5	-26.6	171	61.8	0	0	0	0	111.5	G29 V30 A31 E65 P97 A98	G29-T67 PolarHBondContact O-OG1 2.88Å; V30-T67 WeakPolarHBondContact CA-OG1 3.49Å; A31-T67 PolarHBondContact N-OG1 3.1Å; A31-T67 PolarHBondContact O-N 3.44Å; E65-T67 PolarHBondContact O-N 3.26Å; T67-P97 WeakPolarHBondContact O-CA 3.46Å; T67-A98 PolarHBondContact O-N 3.29Å
68	H	92.2	Very high	86.3	Confident	26 Å²	26	49.7 Å²	49.7	12%	0.12	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	120.8	-179	-63.9	59.4	0	0	0	109.2	A31 I32 Y33 L100 W104	A31-H68 PolarHBondContact O-N 2.8Å; I32-H68 CarbonylContact C-O 3.6Å; I32-H68 WeakPolarHBondContact CA-O 3.48Å; I32-H68 HydrophobicContact CG1-CB 4.35Å; Y33-H68 PolarHBondContact N-O 3.24Å; H68-L100 HydrophobicContact CB-CD1 4.12Å; H68-L100 WeakPolarHBondContact CD2-CD1 3.44Å; H68-W104 HydrophobicContact CB-CH2 4.32Å; H68-W104 HydrophobicContact CB-CZ3 4.27Å; H68-W104 AromaticContact CD2-CE2 3.85Å; H68-W104 AromaticContact CD2-CH2 3.37Å; H68-W104 WeakPolarHBondContact CD2-CH2 3Å; H68-W104 AromaticContact CD2-CZ2 3.34Å; H68-W104 WeakPolarHBondContact CD2-CZ2 3.18Å; H68-W104 AromaticContact CD2-CZ3 3.9Å; H68-W104 AromaticContact CG-CH2 3.94Å; H68-W104 AromaticContact NE2-CZ2 3.65Å
69	V	92.9	Very high	86	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	115.5	172.5	173.9	0	0	0	0	107.8	Y33 V35 A66 M71 W82 P97 A98 L99 L100	Y33-V69 HydrophobicContact CD1-CG1 4.35Å; Y33-V69 WeakPolarHBondContact O-CA 3.34Å; V35-V69 HydrophobicContact CG2-CG1 3.51Å; A66-V69 HydrophobicContact CB-CG2 4.43Å; V69-M71 HydrophobicContact CG1-CE 3.71Å; V69-M71 HydrophobicContact CG1-CG 4.35Å; V69-W82 HydrophobicContact CB-CZ3 4.45Å; V69-W82 HydrophobicContact CG1-CE3 4.39Å; V69-W82 HydrophobicContact CG1-CH2 3.76Å; V69-W82 HydrophobicContact CG1-CZ3 3.68Å; V69-W82 HydrophobicContact CG2-CH2 4.22Å; V69-W82 HydrophobicContact CG2-CZ3 4.18Å; V69-P97 HydrophobicContact CG2-CB 3.86Å; V69-P97 HydrophobicContact CG2-CG 3.8Å; V69-A98 PolarHBondContact N-O 3.23Å; V69-L99 HydrophobicContact CB-CD2 3.97Å; V69-L99 HydrophobicContact CG1-CD2 4.17Å; V69-L100 PolarHBondContact O-N 3.48Å
70	V	92.6	Very high	85.6	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	126.3	-176.7	-178.5	0	0	0	0	109.9	I32 Y33 L34 V35 L100 I102 W104 L105	I32-V70 HydrophobicContact CG2-CG2 3.94Å; Y33-V70 PolarHBondContact O-N 3.34Å; L34-V70 HydrophobicContact CD2-CB 3.8Å; L34-V70 HydrophobicContact CD2-CG1 4.31Å; L34-V70 HydrophobicContact CD2-CG2 4.38Å; V35-V70 PolarHBondContact N-O 3.32Å; V70-L100 CarbonylContact C-O 3.51Å; V70-L100 WeakPolarHBondContact CA-O 3.15Å; V70-L100 HydrophobicContact CG2-CB 4.4Å; V70-I102 HydrophobicContact CG1-CB 4.45Å; V70-I102 HydrophobicContact CG1-CD1 3.85Å; V70-W104 HydrophobicContact CG2-CE3 3.96Å; V70-W104 HydrophobicContact CG2-CZ3 4.17Å; V70-L105 HydrophobicContact CG1-CB 4.02Å; V70-L105 HydrophobicContact CG1-CD2 4.34Å; V70-L105 HydrophobicContact CG2-CB 4.33Å
71	M	93.3	Very high	85.4	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	156.1	178.1	-46	-169.2	-178.9	0	0	109.9	V35 V69 T74 A79 W82 L99 L100 D101 I102 L123	V35-M71 HydrophobicContact CB-CB 4.42Å; V35-M71 HydrophobicContact CB-CG 3.93Å; V35-M71 HydrophobicContact CG1-CG 4.44Å; V35-M71 HydrophobicContact CG2-CE 4.03Å; V35-M71 HydrophobicContact CG2-CG 3.75Å; V35-M71 HydrophobicContact CG2-SD 4.39Å; V69-M71 HydrophobicContact CG1-CE 3.71Å; V69-M71 HydrophobicContact CG1-CG 4.35Å; M71-T74 HydrophobicContact CB-CG2 4.35Å; M71-T74 HydrophobicContact SD-CG2 3.75Å; M71-A79 HydrophobicContact CE-CB 3.98Å; M71-A79 HydrophobicContact SD-CB 3.56Å; M71-A79 VanDerWaalsContact SD-CB 3.56Å; M71-W82 HydrophobicContact CE-CB 4.2Å; M71-W82 HydrophobicContact CE-CD2 3.64Å; M71-W82 HydrophobicContact CE-CE3 3.37Å; M71-W82 HydrophobicContact CE-CG 4.01Å; M71-W82 HydrophobicContact CE-CZ3 4Å; M71-L99 HydrophobicContact CE-CD2 3.9Å; M71-L100 PolarHBondContact N-O 3Å; M71-D101 CarbonylContact O-C 3.25Å; M71-I102 PolarHBondContact O-N 3.46Å; M71-L123 HydrophobicContact CB-CD1 3.74Å; M71-L123 HydrophobicContact CG-CD1 4.07Å; M71-L123 HydrophobicContact SD-CD1 4.28Å
72	E	90.5	Very high	85.4	Confident	21 Å²	21	46.1 Å²	46.1	10%	0.098	26%	0.258	C	S	.	.	S	Bend	trans	-125.8	138.1	177.8	179.3	164.7	-132.4	0	0	108.9	R38 M39 R43 T74 I102	R38-E72 VanDerWaalsContact CB-O 3.27Å; R38-E72 WeakPolarHBondContact CB-O 3.4Å; M39-E72 HydrophobicContact CB-CB 4.27Å; M39-E72 HydrophobicContact CE-CB 4.21Å; M39-E72 WeakPolarHBondContact CG-OE2 3.37Å; R43-E72 WeakPolarHBondContact CD-OE2 3.49Å; R43-E72 IonicContact CZ-OE1 3.61Å; R43-E72 IonicContact CZ-OE2 2.93Å; R43-E72 IonicContact NE-OE1 2.95Å; R43-E72 PolarHBondContact NE-OE1 3.33Å; R43-E72 IonicContact NE-OE2 2.59Å; R43-E72 PolarHBondContact NE-OE2 3.23Å; R43-E72 IonicContact NH2-OE1 3.37Å; R43-E72 PolarHBondContact NH2-OE1 2.88Å; R43-E72 IonicContact NH2-OE2 2.69Å; E72-T74 PolarHBondContact O-N 2.97Å; E72-T74 PolarHBondContact O-OG1 3.28Å; E72-I102 HydrophobicContact CB-CB 4.03Å; E72-I102 HydrophobicContact CB-CG1 4.42Å; E72-I102 HydrophobicContact CB-CG2 4.28Å; E72-I102 HydrophobicContact CG-CB 4.23Å; E72-I102 HydrophobicContact CG-CG1 4.48Å; E72-I102 HydrophobicContact CG-CG2 3.99Å
73	Q	84.5	Confident	85.5	Confident	145 Å²	145	45.6 Å²	45.6	68%	0.678	25%	0.251	S	S	*	.	S	Bend	trans	52.8	30.3	179.8	-62.8	175.4	-5	0	0	113.7	R38	R38-Q73 WeakPolarHBondContact CD-O 3.41Å; R38-Q73 PolarHBondContact NH1-O 3.38Å
74	T	85.4	Confident	85.3	Confident	20 Å²	20	49.1 Å²	49.1	12%	0.123	26%	0.262	C	S	.	.			trans	-112.2	131.4	-176	-53.7	0	0	0	0	108.5	M71 E72 E78 A79	M71-T74 HydrophobicContact CB-CG2 4.35Å; M71-T74 HydrophobicContact SD-CG2 3.75Å; E72-T74 PolarHBondContact O-N 2.97Å; E72-T74 PolarHBondContact O-OG1 3.28Å; T74-E78 HydrophobicContact CG2-CB 3.61Å; T74-A79 HydrophobicContact CG2-CB 4.37Å
75	S	83.7	Confident	85.2	Confident	47 Å²	47	53.3 Å²	53.3	33%	0.329	26%	0.261	S	S	.	.			trans	-73.4	163.7	176.6	87.6	0	0	0	0	111.2	E77 E78 A79	S75-E77 VanDerWaalsContact C-N 3.29Å; S75-E77 VanDerWaalsContact CB-OE2 3.26Å; S75-E77 WeakPolarHBondContact CB-OE2 3.49Å; S75-E77 PolarHBondContact O-N 2.99Å; S75-E77 PolarHBondContact OG-N 3.34Å; S75-E77 PolarHBondContact OG-OE2 2.97Å; S75-E78 PolarHBondContact O-N 3.02Å; S75-E78 PolarHBondContact OG-N 3.05Å; S75-A79 WeakPolarHBondContact O-CB 3.36Å; S75-A79 PolarHBondContact O-N 2.95Å
76	A	81.6	Confident	84.7	Confident	21 Å²	21	54.3 Å²	54.3	17%	0.174	26%	0.261	C	S	.	.	H	α-helix	trans	-61	-38.9	176.6	0	0	0	0	0	112	A79 V80 V125	A76-A79 PolarHBondContact O-N 2.7Å; A76-V80 WeakPolarHBondContact O-CG2 3.43Å; A76-V80 PolarHBondContact O-N 3.09Å; A76-V125 HydrophobicContact CB-CG2 3.99Å
77	E	80	Confident	83.5	Confident	114 Å²	114	57.3 Å²	57.3	53%	0.533	27%	0.274	S	S	.	.	H	α-helix	trans	-65.6	-40.6	178.3	-55.6	75.7	-162.6	0	0	111.7	S75 S81 V125	S75-E77 VanDerWaalsContact C-N 3.29Å; S75-E77 VanDerWaalsContact CB-OE2 3.26Å; S75-E77 WeakPolarHBondContact CB-OE2 3.49Å; S75-E77 PolarHBondContact O-N 2.99Å; S75-E77 PolarHBondContact OG-N 3.34Å; S75-E77 PolarHBondContact OG-OE2 2.97Å; E77-S81 VanDerWaalsContact O-CB 3.32Å; E77-S81 WeakPolarHBondContact O-CB 3.27Å; E77-S81 PolarHBondContact O-N 2.99Å; E77-S81 PolarHBondContact O-OG 3.33Å; E77-V125 HydrophobicContact CB-CG2 4.46Å; E77-V125 HydrophobicContact CG-CG2 4.16Å
78	E	82.6	Confident	82	Confident	75 Å²	75	60.7 Å²	60.7	35%	0.35	30%	0.295	S	S	.	.	H	α-helix	trans	-66.8	-38.6	175	-70.1	-174.9	161.7	0	0	111.7	R38 T74 S75 S81 W82	R38-E78 IonicContact CZ-OE1 3.12Å; R38-E78 IonicContact CZ-OE2 3.16Å; R38-E78 IonicContact NE-OE1 2.87Å; R38-E78 IonicContact NE-OE2 3.51Å; R38-E78 PolarHBondContact NE-OE2 3.1Å; R38-E78 VanDerWaalsContact NH2-CD 3.27Å; R38-E78 IonicContact NH2-OE1 3.25Å; R38-E78 PolarHBondContact NH2-OE1 3.07Å; R38-E78 IonicContact NH2-OE2 2.66Å; R38-E78 PolarHBondContact NH2-OE2 3.23Å; T74-E78 HydrophobicContact CG2-CB 3.61Å; S75-E78 PolarHBondContact O-N 3.02Å; S75-E78 PolarHBondContact OG-N 3.05Å; E78-S81 PolarHBondContact O-N 2.9Å; E78-W82 VanDerWaalsContact O-CB 3.31Å; E78-W82 WeakPolarHBondContact O-CB 3.32Å; E78-W82 PolarHBondContact O-N 3.28Å
79	A	84.7	Confident	80.1	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-66.4	-43.5	178.3	0	0	0	0	0	112	M71 T74 S75 A76 W82 Q83 L99 L123	M71-A79 HydrophobicContact CE-CB 3.98Å; M71-A79 HydrophobicContact SD-CB 3.56Å; M71-A79 VanDerWaalsContact SD-CB 3.56Å; T74-A79 HydrophobicContact CG2-CB 4.37Å; S75-A79 WeakPolarHBondContact O-CB 3.36Å; S75-A79 PolarHBondContact O-N 2.95Å; A76-A79 PolarHBondContact O-N 2.7Å; A79-W82 WeakPolarHBondContact O-CB 3.35Å; A79-W82 PolarHBondContact O-N 2.98Å; A79-Q83 PolarHBondContact O-N 3.41Å; A79-L99 HydrophobicContact CB-CD1 4.03Å; A79-L99 WeakPolarHBondContact O-CD1 3.42Å; A79-L123 HydrophobicContact CB-CB 3.77Å; A79-L123 HydrophobicContact CB-CD1 4.07Å
80	V	82.2	Confident	78.3	Confident	37 Å²	37	66.2 Å²	66.2	22%	0.224	35%	0.345	C	S	.	.	H	α-helix	trans	-65.1	-46.3	174.5	171.5	0	0	0	0	110.8	A76 W82 Q83 E84 L99 V125	A76-V80 WeakPolarHBondContact O-CG2 3.43Å; A76-V80 PolarHBondContact O-N 3.09Å; V80-W82 PolarHBondContact O-N 3.22Å; V80-Q83 WeakPolarHBondContact O-CA 3.42Å; V80-Q83 WeakPolarHBondContact O-CB 3.39Å; V80-Q83 PolarHBondContact O-N 2.83Å; V80-E84 HydrophobicContact CG1-CG 4.26Å; V80-E84 WeakPolarHBondContact O-CG 3.48Å; V80-E84 PolarHBondContact O-N 3.17Å; V80-L99 HydrophobicContact CG2-CD1 4.42Å; V80-V125 HydrophobicContact CB-CG2 4.19Å; V80-V125 HydrophobicContact CG2-CB 4.21Å; V80-V125 HydrophobicContact CG2-CG2 3.67Å
81	S	81.7	Confident	76.5	Confident	45 Å²	45	70.8 Å²	70.8	32%	0.315	38%	0.375	S	S	.	.	H	α-helix	trans	-57.7	-37.9	175.3	-63.1	0	0	0	0	112.1	E77 E78 R85	E77-S81 VanDerWaalsContact O-CB 3.32Å; E77-S81 WeakPolarHBondContact O-CB 3.27Å; E77-S81 PolarHBondContact O-N 2.99Å; E77-S81 PolarHBondContact O-OG 3.33Å; E78-S81 PolarHBondContact O-N 2.9Å; S81-R85 WeakPolarHBondContact O-CB 3.24Å; S81-R85 VanDerWaalsContact O-CG 3.24Å; S81-R85 WeakPolarHBondContact O-CG 3.36Å; S81-R85 PolarHBondContact O-N 3.32Å
82	W	84.9	Confident	74.4	Confident	49 Å²	49	77.5 Å²	77.5	19%	0.186	42%	0.418	C	S	.	.	H	α-helix	trans	-65.2	-40.5	174.9	178.5	96.1	0	0	0	111.9	Y33 V35 V69 M71 E78 A79 V80 R86 L99	Y33-W82 HydrophobicContact CD1-CH2 4.17Å; Y33-W82 HydrophobicContact CD1-CZ2 4.27Å; Y33-W82 HydrophobicContact CE1-CH2 4.14Å; Y33-W82 AromaticContact CE1-CZ2 3.79Å; Y33-W82 HydrophobicContact CE1-CZ2 3.79Å; V35-W82 HydrophobicContact CG2-CH2 4.27Å; V35-W82 HydrophobicContact CG2-CZ2 3.87Å; V69-W82 HydrophobicContact CB-CZ3 4.45Å; V69-W82 HydrophobicContact CG1-CE3 4.39Å; V69-W82 HydrophobicContact CG1-CH2 3.76Å; V69-W82 HydrophobicContact CG1-CZ3 3.68Å; V69-W82 HydrophobicContact CG2-CH2 4.22Å; V69-W82 HydrophobicContact CG2-CZ3 4.18Å; M71-W82 HydrophobicContact CE-CB 4.2Å; M71-W82 HydrophobicContact CE-CD2 3.64Å; M71-W82 HydrophobicContact CE-CE3 3.37Å; M71-W82 HydrophobicContact CE-CG 4.01Å; M71-W82 HydrophobicContact CE-CZ3 4Å; E78-W82 VanDerWaalsContact O-CB 3.31Å; E78-W82 WeakPolarHBondContact O-CB 3.32Å; E78-W82 PolarHBondContact O-N 3.28Å; A79-W82 WeakPolarHBondContact O-CB 3.35Å; A79-W82 PolarHBondContact O-N 2.98Å; V80-W82 PolarHBondContact O-N 3.22Å; W82-R86 PolarHBondContact O-N 2.97Å; W82-L99 HydrophobicContact CE3-CD2 4.49Å; W82-L99 HydrophobicContact CZ3-CD2 4.43Å
83	Q	83.7	Confident	72.9	Confident	34 Å²	34	80.3 Å²	80.3	16%	0.159	45%	0.453	C	S	.	.	H	α-helix	trans	-68.1	-46.3	177.9	-174.6	170.5	49.1	0	0	111.5	A79 V80 R85 R86 M87 P97 L99	A79-Q83 PolarHBondContact O-N 3.41Å; V80-Q83 WeakPolarHBondContact O-CA 3.42Å; V80-Q83 WeakPolarHBondContact O-CB 3.39Å; V80-Q83 PolarHBondContact O-N 2.83Å; Q83-R85 PolarHBondContact O-N 3.26Å; Q83-R86 CarbonylContact O-C 3.14Å; Q83-R86 PolarHBondContact O-N 3.33Å; Q83-M87 HydrophobicContact CG-CG 3.94Å; Q83-M87 HydrophobicContact CG-SD 3.88Å; Q83-M87 WeakPolarHBondContact O-CG 3.15Å; Q83-M87 PolarHBondContact O-N 2.98Å; Q83-P97 PolarHBondContact NE2-O 3.08Å; Q83-L99 HydrophobicContact CB-CD1 4.04Å; Q83-L99 HydrophobicContact CB-CD2 4.35Å
84	E	78.2	Confident	71.6	Confident	123 Å²	123	76.6 Å²	76.6	58%	0.575	44%	0.442	S	S	*	.	H	α-helix	trans	-60.2	-43.4	179	-71.4	177.4	168.2	0	0	112.7	V80 R86 M87 T88	V80-E84 HydrophobicContact CG1-CG 4.26Å; V80-E84 WeakPolarHBondContact O-CG 3.48Å; V80-E84 PolarHBondContact O-N 3.17Å; E84-R86 PolarHBondContact O-N 2.83Å; E84-R86 VanDerWaalsContact O-N 3.14Å; E84-M87 PolarHBondContact O-N 2.93Å; E84-T88 PolarHBondContact O-N 3.49Å; E84-T88 PolarHBondContact O-OG1 3.41Å
85	R	77.2	Confident	70.7	Confident	200 Å²	200	82 Å²	82	76%	0.755	48%	0.475	S	S	*	.	H	α-helix	trans	-62.8	-18.1	175.1	-72.2	178.1	-158.2	177.6	7.6	113.5	S81 Q83 T88	S81-R85 WeakPolarHBondContact O-CB 3.24Å; S81-R85 VanDerWaalsContact O-CG 3.24Å; S81-R85 WeakPolarHBondContact O-CG 3.36Å; S81-R85 PolarHBondContact O-N 3.32Å; Q83-R85 PolarHBondContact O-N 3.26Å; R85-T88 PolarHBondContact O-OG1 3.35Å
86	R	71.7	Confident	70.4	Confident	121 Å²	121	83.3 Å²	83.3	46%	0.457	48%	0.483	S	S	.	.	H	α-helix	trans	-105.1	-29.5	178.9	-74.1	-152.6	156.9	173.4	-4.5	113.9	W82 Q83 E84 T88 A89	W82-R86 PolarHBondContact O-N 2.97Å; Q83-R86 CarbonylContact O-C 3.14Å; Q83-R86 PolarHBondContact O-N 3.33Å; E84-R86 PolarHBondContact O-N 2.83Å; E84-R86 VanDerWaalsContact O-N 3.14Å; R86-T88 VanDerWaalsContact C-N 3.32Å; R86-A89 PolarHBondContact O-N 3.16Å
87	M	62	Low	70.5	Confident	71 Å²	71	83.7 Å²	83.7	35%	0.35	48%	0.484	S	S	.	.	H	α-helix	trans	-77.9	-16.3	177.1	-65.7	-155.2	99.7	0	0	113.2	Q83 E84 A89 A90 P96	Q83-M87 HydrophobicContact CG-CG 3.94Å; Q83-M87 HydrophobicContact CG-SD 3.88Å; Q83-M87 WeakPolarHBondContact O-CG 3.15Å; Q83-M87 PolarHBondContact O-N 2.98Å; E84-M87 PolarHBondContact O-N 2.93Å; M87-A89 PolarHBondContact O-N 3.44Å; M87-A89 VanDerWaalsContact O-N 3.09Å; M87-A90 PolarHBondContact O-N 3.24Å; M87-A90 VanDerWaalsContact O-N 3.11Å; M87-P96 HydrophobicContact CE-CB 4.07Å; M87-P96 HydrophobicContact SD-CB 4.01Å
88	T	55.4	Low	70.9	Confident	124 Å²	124	79.1 Å²	79.1	76%	0.761	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-12.2	167.6	30.6	0	0	0	0	113.9	E84 R85 R86	E84-T88 PolarHBondContact O-N 3.49Å; E84-T88 PolarHBondContact O-OG1 3.41Å; R85-T88 PolarHBondContact O-OG1 3.35Å; R86-T88 VanDerWaalsContact C-N 3.32Å
89	A	52.9	Low	71.4	Confident	93 Å²	93	75.9 Å²	75.9	77%	0.769	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	7	176.3	0	0	0	0	0	114.3	R86 M87	R86-A89 PolarHBondContact O-N 3.16Å; M87-A89 PolarHBondContact O-N 3.44Å; M87-A89 VanDerWaalsContact O-N 3.09Å
90	A	55.9	Low	71.8	Confident	49 Å²	49	75.9 Å²	75.9	41%	0.405	45%	0.451	S	S	.	.	S	Bend	trans	-104.9	142.4	-174.4	0	0	0	0	0	112.8	M87	M87-A90 PolarHBondContact O-N 3.24Å; M87-A90 VanDerWaalsContact O-N 3.11Å
91	P	55.1	Low	72.3	Confident	97 Å²	97	76.1 Å²	76.1	63%	0.63	45%	0.45	S	S	*	.			trans	-66.6	148.8	177.2	24.5	-31.1	0	0	0	112.4	G93	P91-G93 PolarHBondContact O-N 3.44Å
92	P	49.3	Very low	72.9	Confident	141 Å²	141	74.9 Å²	74.9	92%	0.916	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	122.9	-177.4	24.3	-30.8	0	0	0	111.4
93	G	57.7	Low	73.3	Confident	81 Å²	81	73.8 Å²	73.8	84%	0.835	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	131.2	-4.8	174.6	0	0	0	0	0	116.6	P91	P91-G93 PolarHBondContact O-N 3.44Å
94	C	58.3	Low	73.9	Confident	66 Å²	66	72.1 Å²	72.1	45%	0.446	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-85	130.6	176.9	-70.6	0	0	0	0	112.5
95	T	66.3	Low	74.7	Confident	133 Å²	133	66.3 Å²	66.3	82%	0.816	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-63.7	128.9	169.4	-23.8	0	0	0	0	109.5
96	P	76.9	Confident	75.5	Confident	75 Å²	75	59.8 Å²	59.8	49%	0.487	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-65.6	141.9	179.6	23.9	-31.5	0	0	0	111.1	M87	M87-P96 HydrophobicContact CE-CB 4.07Å; M87-P96 HydrophobicContact SD-CB 4.01Å
97	P	84.4	Confident	76.5	Confident	30 Å²	30	57 Å²	57	20%	0.195	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-62.2	151.7	172.7	23.8	-32.1	0	0	0	111.4	A66 T67 V69 Q83 L99	A66-P97 WeakPolarHBondContact O-CB 3.33Å; T67-P97 WeakPolarHBondContact O-CA 3.46Å; V69-P97 HydrophobicContact CG2-CB 3.86Å; V69-P97 HydrophobicContact CG2-CG 3.8Å; Q83-P97 PolarHBondContact NE2-O 3.08Å; P97-L99 PolarHBondContact O-N 3.36Å
98	A	88.7	Confident	78	Confident	18 Å²	18	53.6 Å²	53.6	15%	0.149	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	123.9	169.8	0	0	0	0	0	109.9	T67 V69 L100	T67-A98 PolarHBondContact O-N 3.29Å; V69-A98 PolarHBondContact N-O 3.23Å; A98-L100 HydrophobicContact CB-CD1 4.41Å; A98-L100 HydrophobicContact CB-CD2 4.13Å; A98-L100 HydrophobicContact CB-CG 4.17Å
99	L	91.7	Very high	79.8	Confident	7 Å²	7	48.1 Å²	48.1	4%	0.037	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	118.5	172.6	-59.6	-177.3	0	0	0	109.1	V69 M71 A79 V80 W82 Q83 P97 R122 L123	V69-L99 HydrophobicContact CB-CD2 3.97Å; V69-L99 HydrophobicContact CG1-CD2 4.17Å; M71-L99 HydrophobicContact CE-CD2 3.9Å; A79-L99 HydrophobicContact CB-CD1 4.03Å; A79-L99 WeakPolarHBondContact O-CD1 3.42Å; V80-L99 HydrophobicContact CG2-CD1 4.42Å; W82-L99 HydrophobicContact CE3-CD2 4.49Å; W82-L99 HydrophobicContact CZ3-CD2 4.43Å; Q83-L99 HydrophobicContact CB-CD1 4.04Å; Q83-L99 HydrophobicContact CB-CD2 4.35Å; P97-L99 PolarHBondContact O-N 3.36Å; L99-R122 WeakPolarHBondContact O-CA 3.49Å; L99-L123 HydrophobicContact CB-CB 4.21Å; L99-L123 PolarHBondContact O-N 3.48Å
100	L	93.1	Very high	81.7	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	146.1	-169.2	-56.9	178.4	0	0	0	112.5	H68 V69 V70 M71 A98 W104 V117 H121 R122 L123	H68-L100 HydrophobicContact CB-CD1 4.12Å; H68-L100 WeakPolarHBondContact CD2-CD1 3.44Å; V69-L100 PolarHBondContact O-N 3.48Å; V70-L100 CarbonylContact C-O 3.51Å; V70-L100 WeakPolarHBondContact CA-O 3.15Å; V70-L100 HydrophobicContact CG2-CB 4.4Å; M71-L100 PolarHBondContact N-O 3Å; A98-L100 HydrophobicContact CB-CD1 4.41Å; A98-L100 HydrophobicContact CB-CD2 4.13Å; A98-L100 HydrophobicContact CB-CG 4.17Å; L100-W104 HydrophobicContact CB-CB 4.41Å; L100-W104 HydrophobicContact CD1-CB 4.3Å; L100-W104 HydrophobicContact CD1-CD2 3.58Å; L100-W104 HydrophobicContact CD1-CE3 3.76Å; L100-W104 HydrophobicContact CD1-CG 3.81Å; L100-W104 HydrophobicContact CD1-CZ3 4.37Å; L100-V117 HydrophobicContact CD1-CG2 4.19Å; L100-V117 HydrophobicContact CD2-CG1 3.49Å; L100-V117 VanDerWaalsContact CD2-CG1 3.49Å; L100-V117 HydrophobicContact CD2-CG2 4.42Å; L100-H121 CarbonylContact C-O 3.46Å; L100-H121 WeakPolarHBondContact CA-O 3.35Å; L100-H121 HydrophobicContact CD2-CB 4.27Å; L100-H121 WeakPolarHBondContact CD2-O 3.34Å; L100-R122 HydrophobicContact CD2-CG 3.98Å; L100-L123 WeakPolarHBondContact O-CD1 3.37Å
101	D	93.8	Very high	83.3	Confident	41 Å²	41	48.2 Å²	48.2	22%	0.219	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	157.2	167.5	178.4	-102.5	0	0	0	110.8	M71 S103 W104 H121 L123	M71-D101 CarbonylContact O-C 3.25Å; D101-S103 PolarHBondContact O-N 3.16Å; D101-S103 VanDerWaalsContact O-N 3.13Å; D101-S103 WeakPolarHBondContact OD1-CB 3.4Å; D101-S103 PolarHBondContact OD1-N 3.08Å; D101-S103 PolarHBondContact OD1-OG 3.28Å; D101-W104 PolarHBondContact O-N 3.42Å; D101-H121 PolarHBondContact N-O 3.49Å; D101-L123 HydrophobicContact CB-CD2 4Å; D101-L123 HydrophobicContact CB-CG 4.19Å
102	I	94.1	Very high	85	Confident	19 Å²	19	45 Å²	45	10%	0.097	31%	0.314	C	S	.	.	H	α-helix	trans	-57.4	-27.3	-180	-168.8	59.6	0	0	0	112.9	M39 L47 V70 M71 E72 W104 L105 T106	M39-I102 HydrophobicContact CE-CD1 4.17Å; L47-I102 HydrophobicContact CD1-CD1 3.74Å; V70-I102 HydrophobicContact CG1-CB 4.45Å; V70-I102 HydrophobicContact CG1-CD1 3.85Å; M71-I102 PolarHBondContact O-N 3.46Å; E72-I102 HydrophobicContact CB-CB 4.03Å; E72-I102 HydrophobicContact CB-CG1 4.42Å; E72-I102 HydrophobicContact CB-CG2 4.28Å; E72-I102 HydrophobicContact CG-CB 4.23Å; E72-I102 HydrophobicContact CG-CG1 4.48Å; E72-I102 HydrophobicContact CG-CG2 3.99Å; I102-W104 VanDerWaalsContact C-N 3.29Å; I102-W104 PolarHBondContact O-N 2.92Å; I102-L105 HydrophobicContact CD1-CB 4.24Å; I102-L105 HydrophobicContact CD1-CD2 3.93Å; I102-L105 PolarHBondContact O-N 3.01Å; I102-L105 VanDerWaalsContact O-N 3.07Å; I102-T106 HydrophobicContact CG1-CG2 4.29Å; I102-T106 PolarHBondContact O-N 3.4Å; I102-T106 PolarHBondContact O-OG1 3.27Å
103	S	93.1	Very high	87	Confident	26 Å²	26	43.9 Å²	43.9	18%	0.182	30%	0.297	C	S	.	.	H	α-helix	trans	-48	-47.8	174.4	48.8	0	0	0	0	112.5	D101 L105 T106 E107	D101-S103 PolarHBondContact O-N 3.16Å; D101-S103 VanDerWaalsContact O-N 3.13Å; D101-S103 WeakPolarHBondContact OD1-CB 3.4Å; D101-S103 PolarHBondContact OD1-N 3.08Å; D101-S103 PolarHBondContact OD1-OG 3.28Å; S103-L105 VanDerWaalsContact C-N 3.32Å; S103-L105 PolarHBondContact O-N 3.2Å; S103-T106 WeakPolarHBondContact CA-OG1 3.38Å; S103-T106 PolarHBondContact O-N 3Å; S103-T106 VanDerWaalsContact O-N 3.12Å; S103-T106 PolarHBondContact O-OG1 3.04Å; S103-E107 WeakPolarHBondContact O-CG 3.09Å; S103-E107 PolarHBondContact O-N 3.22Å
104	W	96.1	Very high	88.6	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-59.6	-42.3	179.5	177.9	80.7	0	0	0	112.8	V30 I32 H68 V70 L100 D101 I102 S108 P114 V115 H121	V30-W104 HydrophobicContact CG1-CH2 3.86Å; V30-W104 HydrophobicContact CG1-CZ2 4.48Å; I32-W104 HydrophobicContact CD1-CH2 4Å; I32-W104 HydrophobicContact CD1-CZ3 3.81Å; I32-W104 HydrophobicContact CG1-CH2 4.28Å; I32-W104 HydrophobicContact CG1-CZ3 4.13Å; H68-W104 HydrophobicContact CB-CH2 4.32Å; H68-W104 HydrophobicContact CB-CZ3 4.27Å; H68-W104 AromaticContact CD2-CE2 3.85Å; H68-W104 AromaticContact CD2-CH2 3.37Å; H68-W104 WeakPolarHBondContact CD2-CH2 3Å; H68-W104 AromaticContact CD2-CZ2 3.34Å; H68-W104 WeakPolarHBondContact CD2-CZ2 3.18Å; H68-W104 AromaticContact CD2-CZ3 3.9Å; H68-W104 AromaticContact CG-CH2 3.94Å; H68-W104 AromaticContact NE2-CZ2 3.65Å; V70-W104 HydrophobicContact CG2-CE3 3.96Å; V70-W104 HydrophobicContact CG2-CZ3 4.17Å; L100-W104 HydrophobicContact CB-CB 4.41Å; L100-W104 HydrophobicContact CD1-CB 4.3Å; L100-W104 HydrophobicContact CD1-CD2 3.58Å; L100-W104 HydrophobicContact CD1-CE3 3.76Å; L100-W104 HydrophobicContact CD1-CG 3.81Å; L100-W104 HydrophobicContact CD1-CZ3 4.37Å; D101-W104 PolarHBondContact O-N 3.42Å; I102-W104 VanDerWaalsContact C-N 3.29Å; I102-W104 PolarHBondContact O-N 2.92Å; W104-S108 VanDerWaalsContact O-CB 3.27Å; W104-S108 WeakPolarHBondContact O-CB 3.24Å; W104-S108 PolarHBondContact O-N 3.23Å; W104-S108 PolarHBondContact O-OG 3.26Å; W104-P114 HydrophobicContact CZ2-CB 4.15Å; W104-V115 PolarHBondContact NE1-O 3.14Å; W104-H121 HydrophobicContact CB-CB 3.87Å; W104-H121 AromaticContact CD1-CG 3.87Å; W104-H121 AromaticContact CD1-ND1 3.64Å; W104-H121 HydrophobicContact CG-CB 4.36Å
105	L	94.4	Very high	90.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-68	-41.8	178.3	-179.5	63.8	0	0	0	110.1	I32 L34 L47 V70 I102 S103 S108 L109	I32-L105 HydrophobicContact CD1-CD1 3.97Å; L34-L105 HydrophobicContact CD1-CD2 4.46Å; L34-L105 HydrophobicContact CD2-CD2 3.59Å; L47-L105 HydrophobicContact CB-CD2 4.47Å; L47-L105 HydrophobicContact CD1-CD2 4.47Å; V70-L105 HydrophobicContact CG1-CB 4.02Å; V70-L105 HydrophobicContact CG1-CD2 4.34Å; V70-L105 HydrophobicContact CG2-CB 4.33Å; I102-L105 HydrophobicContact CD1-CB 4.24Å; I102-L105 HydrophobicContact CD1-CD2 3.93Å; I102-L105 PolarHBondContact O-N 3.01Å; I102-L105 VanDerWaalsContact O-N 3.07Å; S103-L105 VanDerWaalsContact C-N 3.32Å; S103-L105 PolarHBondContact O-N 3.2Å; L105-S108 PolarHBondContact O-N 2.74Å; L105-L109 HydrophobicContact CD1-CD1 4.18Å; L105-L109 HydrophobicContact CD1-CG 4.1Å; L105-L109 HydrophobicContact CG-CD1 3.9Å; L105-L109 HydrophobicContact CG-CG 4.24Å; L105-L109 WeakPolarHBondContact O-CB 3.49Å; L105-L109 WeakPolarHBondContact O-CG 3.42Å; L105-L109 PolarHBondContact O-N 2.82Å
106	T	93.8	Very high	91.5	Very high	63 Å²	63	38.4 Å²	38.4	39%	0.387	25%	0.247	S	C	.	.	H	α-helix	trans	-64.4	-40.9	178.5	53.6	0	0	0	0	112.5	I102 S103 L109 A110	I102-T106 HydrophobicContact CG1-CG2 4.29Å; I102-T106 PolarHBondContact O-N 3.4Å; I102-T106 PolarHBondContact O-OG1 3.27Å; S103-T106 WeakPolarHBondContact CA-OG1 3.38Å; S103-T106 PolarHBondContact O-N 3Å; S103-T106 VanDerWaalsContact O-N 3.12Å; S103-T106 PolarHBondContact O-OG1 3.04Å; T106-L109 PolarHBondContact O-N 2.88Å; T106-A110 WeakPolarHBondContact O-CB 3.49Å; T106-A110 PolarHBondContact O-N 3.45Å
107	E	93.8	Very high	92.1	Very high	63 Å²	63	36.7 Å²	36.7	29%	0.294	24%	0.236	S	C	.	.	H	α-helix	trans	-65.6	-45	175.1	-72.2	-178	-150.2	0	0	111.2	S103 L109 A110 A111 V115 R120 H121	S103-E107 WeakPolarHBondContact O-CG 3.09Å; S103-E107 PolarHBondContact O-N 3.22Å; E107-L109 VanDerWaalsContact C-N 3.34Å; E107-L109 PolarHBondContact O-N 2.84Å; E107-A110 PolarHBondContact O-N 3.22Å; E107-A111 WeakPolarHBondContact O-CB 3.45Å; E107-A111 PolarHBondContact O-N 3.38Å; E107-V115 HydrophobicContact CB-CG2 4.14Å; E107-R120 IonicContact OE1-NE 2.64Å; E107-R120 IonicContact OE1-NH2 2.64Å; E107-R120 IonicContact OE2-CZ 2.96Å; E107-R120 IonicContact OE2-NE 3.99Å; E107-R120 IonicContact OE2-NH2 2.84Å; E107-R120 PolarHBondContact OE2-NH2 2.81Å; E107-H121 IonicContact OE1-NE2 2.67Å; E107-H121 PolarHBondContact OE1-NE2 3.34Å; E107-H121 IonicContact OE2-CE1 3.42Å; E107-H121 IonicContact OE2-NE2 3.94Å; E107-H121 PolarHBondContact OE2-NE2 2.86Å; E107-H121 VanDerWaalsContact OE2-NE2 3.13Å
108	S	93.4	Very high	92.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.8	-40.6	176	-62.5	0	0	0	0	112.3	W104 L105 G112 Q113 V115	W104-S108 VanDerWaalsContact O-CB 3.27Å; W104-S108 WeakPolarHBondContact O-CB 3.24Å; W104-S108 PolarHBondContact O-N 3.23Å; W104-S108 PolarHBondContact O-OG 3.26Å; L105-S108 PolarHBondContact O-N 2.74Å; S108-G112 PolarHBondContact O-N 2.93Å; S108-Q113 CarbonylContact C-O 3.56Å; S108-Q113 VanDerWaalsContact CA-O 3.31Å; S108-Q113 WeakPolarHBondContact CA-O 3.25Å; S108-Q113 PolarHBondContact O-N 2.99Å; S108-Q113 VanDerWaalsContact O-O 3.08Å; S108-V115 PolarHBondContact OG-N 3.25Å
109	L	93.4	Very high	91.8	Very high	9 Å²	9	44.3 Å²	44.3	5%	0.047	28%	0.277	C	S	.	.	H	α-helix	trans	-67.5	-38.6	175.2	-69.7	174.6	0	0	0	111.3	L47 L50 A51 K54 F56 L105 T106 E107 G112	L47-L109 HydrophobicContact CD2-CD1 4.36Å; L50-L109 HydrophobicContact CD2-CD1 3.94Å; L50-L109 HydrophobicContact CG-CD1 4.19Å; L50-L109 HydrophobicContact CG-CD2 4.43Å; A51-L109 HydrophobicContact CB-CD2 3.87Å; K54-L109 HydrophobicContact CD-CD2 4.19Å; K54-L109 WeakPolarHBondContact CD-O 3.21Å; K54-L109 WeakPolarHBondContact CE-O 3.38Å; K54-L109 PolarHBondContact NZ-O 3.04Å; F56-L109 HydrophobicContact CD2-CD2 4.12Å; F56-L109 HydrophobicContact CE2-CD2 3.99Å; L105-L109 HydrophobicContact CD1-CD1 4.18Å; L105-L109 HydrophobicContact CD1-CG 4.1Å; L105-L109 HydrophobicContact CG-CD1 3.9Å; L105-L109 HydrophobicContact CG-CG 4.24Å; L105-L109 WeakPolarHBondContact O-CB 3.49Å; L105-L109 WeakPolarHBondContact O-CG 3.42Å; L105-L109 PolarHBondContact O-N 2.82Å; T106-L109 PolarHBondContact O-N 2.88Å; E107-L109 VanDerWaalsContact C-N 3.34Å; E107-L109 PolarHBondContact O-N 2.84Å; L109-G112 PolarHBondContact O-N 2.95Å
110	A	91.7	Very high	91.5	Very high	84 Å²	84	50.9 Å²	50.9	69%	0.694	30%	0.302	S	S	*	.	H	α-helix	trans	-64.9	-45	176.4	0	0	0	0	0	111.6	T106 E107 G112	T106-A110 WeakPolarHBondContact O-CB 3.49Å; T106-A110 PolarHBondContact O-N 3.45Å; E107-A110 PolarHBondContact O-N 3.22Å; A110-G112 VanDerWaalsContact C-N 3.28Å; A110-G112 PolarHBondContact O-N 3.06Å
111	A	89.7	Confident	91.3	Very high	59 Å²	59	50.9 Å²	50.9	49%	0.488	30%	0.302	S	S	.	.	H	α-helix	trans	-71.9	-18.4	177.8	0	0	0	0	0	113.8	E107 Q113 V115	E107-A111 WeakPolarHBondContact O-CB 3.45Å; E107-A111 PolarHBondContact O-N 3.38Å; A111-Q113 HydrophobicContact CB-CG 4.49Å; A111-Q113 PolarHBondContact O-N 3.4Å; A111-V115 HydrophobicContact CB-CG1 3.93Å
112	G	90.3	Very high	91.1	Very high	30 Å²	30	53.9 Å²	53.9	31%	0.309	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	7.1	-177.4	0	0	0	0	0	114.6	S108 L109 A110	S108-G112 PolarHBondContact O-N 2.93Å; L109-G112 PolarHBondContact O-N 2.95Å; A110-G112 VanDerWaalsContact C-N 3.28Å; A110-G112 PolarHBondContact O-N 3.06Å
113	Q	92.1	Very high	90.6	Very high	117 Å²	117	53.8 Å²	53.8	55%	0.547	31%	0.309	S	S	.	.	S	Bend	trans	-150.9	158.5	177	65.2	178.7	13.6	0	0	110.2	F27 S108 A111 V115	F27-Q113 HydrophobicContact CE1-CB 3.92Å; F27-Q113 HydrophobicContact CZ-CB 3.79Å; S108-Q113 CarbonylContact C-O 3.56Å; S108-Q113 VanDerWaalsContact CA-O 3.31Å; S108-Q113 WeakPolarHBondContact CA-O 3.25Å; S108-Q113 PolarHBondContact O-N 2.99Å; S108-Q113 VanDerWaalsContact O-O 3.08Å; A111-Q113 HydrophobicContact CB-CG 4.49Å; A111-Q113 PolarHBondContact O-N 3.4Å; Q113-V115 PolarHBondContact O-N 3.29Å
114	P	91.9	Very high	89.7	Confident	32 Å²	32	57.5 Å²	57.5	21%	0.208	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-59.9	121.3	175	-17.9	28.7	0	0	0	111	F27 V30 F56 W104	F27-P114 HydrophobicContact CB-CG 3.99Å; F27-P114 VanDerWaalsContact CD1-CD 3.5Å; F27-P114 HydrophobicContact CD1-CG 4Å; F27-P114 HydrophobicContact CD2-CG 4.12Å; F27-P114 HydrophobicContact CG-CG 3.75Å; V30-P114 HydrophobicContact CB-CG 4.24Å; V30-P114 HydrophobicContact CG1-CG 4.38Å; V30-P114 HydrophobicContact CG2-CB 4.02Å; V30-P114 HydrophobicContact CG2-CG 3.88Å; F56-P114 HydrophobicContact CD1-CG 4.27Å; F56-P114 HydrophobicContact CE1-CB 4.23Å; F56-P114 HydrophobicContact CE1-CG 3.69Å; F56-P114 HydrophobicContact CZ-CG 4.48Å; W104-P114 HydrophobicContact CZ2-CB 4.15Å
115	V	93	Very high	87.8	Confident	28 Å²	28	60.5 Å²	60.5	17%	0.17	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-80.5	153.9	173	-61	0	0	0	0	110.6	W104 E107 S108 A111 Q113 V117	W104-V115 PolarHBondContact NE1-O 3.14Å; E107-V115 HydrophobicContact CB-CG2 4.14Å; S108-V115 PolarHBondContact OG-N 3.25Å; A111-V115 HydrophobicContact CB-CG1 3.93Å; Q113-V115 PolarHBondContact O-N 3.29Å; V115-V117 PolarHBondContact O-N 3.43Å
116	P	92.2	Very high	85.3	Confident	105 Å²	105	64 Å²	64	68%	0.682	36%	0.364	S	S	*	.	P	Polyproline II helix	trans	-53.2	138	172.5	-26	35.3	0	0	0	112.1	E118	P116-E118 PolarHBondContact O-N 2.81Å
117	V	89.4	Confident	82.8	Confident	40 Å²	40	64.1 Å²	64.1	24%	0.242	38%	0.377	C	S	.	.			trans	-76.5	97.7	177.3	179.9	0	0	0	0	109.6	L100 V115 H121 R122	L100-V117 HydrophobicContact CD1-CG2 4.19Å; L100-V117 HydrophobicContact CD2-CG1 3.49Å; L100-V117 VanDerWaalsContact CD2-CG1 3.49Å; L100-V117 HydrophobicContact CD2-CG2 4.42Å; V115-V117 PolarHBondContact O-N 3.43Å; V117-H121 HydrophobicContact CG1-CB 4.39Å; V117-R122 HydrophobicContact CG1-CG 3.64Å
118	E	87.1	Confident	80.1	Confident	87 Å²	87	67 Å²	67	41%	0.407	40%	0.401	S	S	.	.			trans	-81	165.7	171.3	-59.8	-179.2	-148.7	0	0	113.3	P116 R120 H121	P116-E118 PolarHBondContact O-N 2.81Å; E118-R120 HydrophobicContact CB-CG 4.19Å; E118-R120 PolarHBondContact O-N 3.43Å; E118-R120 IonicContact OE1-CZ 2.95Å; E118-R120 IonicContact OE1-NH1 3.8Å; E118-R120 IonicContact OE1-NH2 3.63Å; E118-R120 PolarHBondContact OE1-NH2 3.33Å; E118-R120 VanDerWaalsContact OE1-NH2 3.17Å; E118-R120 IonicContact OE2-CZ 3.26Å; E118-R120 IonicContact OE2-NE 2.84Å; E118-R120 IonicContact OE2-NH1 3.34Å; E118-R120 PolarHBondContact OE2-NH1 3.01Å; E118-R120 IonicContact OE2-NH2 2.83Å; E118-H121 PolarHBondContact N-ND1 2.84Å; E118-H121 WeakPolarHBondContact O-CB 3.42Å; E118-H121 PolarHBondContact O-N 2.7Å
119	C	79.3	Confident	77.2	Confident	120 Å²	120	76.8 Å²	76.8	81%	0.811	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-57.6	-34.9	178.5	-60.5	0	0	0	0	113.2	H121 R122	C119-H121 PolarHBondContact O-N 2.79Å; C119-R122 PolarHBondContact O-N 2.97Å
120	R	85.5	Confident	74.5	Confident	146 Å²	146	82.6 Å²	82.6	55%	0.551	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-64.6	-20.8	178	66.2	169.7	-174.1	-106.8	-6.7	113.8	E107 E118	E107-R120 IonicContact OE1-NE 2.64Å; E107-R120 IonicContact OE1-NH2 2.64Å; E107-R120 IonicContact OE2-CZ 2.96Å; E107-R120 IonicContact OE2-NE 3.99Å; E107-R120 IonicContact OE2-NH2 2.84Å; E107-R120 PolarHBondContact OE2-NH2 2.81Å; E118-R120 HydrophobicContact CB-CG 4.19Å; E118-R120 PolarHBondContact O-N 3.43Å; E118-R120 IonicContact OE1-CZ 2.95Å; E118-R120 IonicContact OE1-NH1 3.8Å; E118-R120 IonicContact OE1-NH2 3.63Å; E118-R120 PolarHBondContact OE1-NH2 3.33Å; E118-R120 VanDerWaalsContact OE1-NH2 3.17Å; E118-R120 IonicContact OE2-CZ 3.26Å; E118-R120 IonicContact OE2-NE 2.84Å; E118-R120 IonicContact OE2-NH1 3.34Å; E118-R120 PolarHBondContact OE2-NH1 3.01Å; E118-R120 IonicContact OE2-NH2 2.83Å
121	H	88.8	Confident	71.7	Confident	0 Å²	0	81 Å²	81	0%	0	45%	0.454	C	S	.	.	G	3₁₀ helix	trans	-87.7	-20.8	-178.9	-62.6	143	0	0	0	113	L100 D101 W104 E107 V117 E118 C119	L100-H121 CarbonylContact C-O 3.46Å; L100-H121 WeakPolarHBondContact CA-O 3.35Å; L100-H121 HydrophobicContact CD2-CB 4.27Å; L100-H121 WeakPolarHBondContact CD2-O 3.34Å; D101-H121 PolarHBondContact N-O 3.49Å; W104-H121 HydrophobicContact CB-CB 3.87Å; W104-H121 AromaticContact CD1-CG 3.87Å; W104-H121 AromaticContact CD1-ND1 3.64Å; W104-H121 HydrophobicContact CG-CB 4.36Å; E107-H121 IonicContact OE1-NE2 2.67Å; E107-H121 PolarHBondContact OE1-NE2 3.34Å; E107-H121 IonicContact OE2-CE1 3.42Å; E107-H121 IonicContact OE2-NE2 3.94Å; E107-H121 PolarHBondContact OE2-NE2 2.86Å; E107-H121 VanDerWaalsContact OE2-NE2 3.13Å; V117-H121 HydrophobicContact CG1-CB 4.39Å; E118-H121 PolarHBondContact N-ND1 2.84Å; E118-H121 WeakPolarHBondContact O-CB 3.42Å; E118-H121 PolarHBondContact O-N 2.7Å; C119-H121 PolarHBondContact O-N 2.79Å
122	R	89.9	Confident	69.2	Low	103 Å²	103	83.4 Å²	83.4	39%	0.389	47%	0.465	S	S	.	.	B	Isolated β-bridge	trans	-87.9	131.1	-169.5	-69.7	-179.3	176.8	-113.4	0	111.9	L99 L100 V117 C119 E124	L99-R122 WeakPolarHBondContact O-CA 3.49Å; L100-R122 HydrophobicContact CD2-CG 3.98Å; V117-R122 HydrophobicContact CG1-CG 3.64Å; C119-R122 PolarHBondContact O-N 2.97Å; R122-E124 HydrophobicContact CB-CG 4.17Å; R122-E124 WeakPolarHBondContact CD-OE1 3.3Å; R122-E124 IonicContact CZ-OE1 3.02Å; R122-E124 IonicContact NE-OE1 3.09Å; R122-E124 IonicContact NH1-OE1 2.68Å; R122-E124 PolarHBondContact NH1-OE1 2.93Å; R122-E124 PolarHBondContact O-N 3.12Å
123	L	84.7	Confident	66.7	Low	17 Å²	17	84.6 Å²	84.6	9%	0.089	46%	0.464	C	S	.	.			trans	-91.3	55.1	169	-63.5	174.8	0	0	0	109.7	M71 A79 L99 L100 D101	M71-L123 HydrophobicContact CB-CD1 3.74Å; M71-L123 HydrophobicContact CG-CD1 4.07Å; M71-L123 HydrophobicContact SD-CD1 4.28Å; A79-L123 HydrophobicContact CB-CB 3.77Å; A79-L123 HydrophobicContact CB-CD1 4.07Å; L99-L123 HydrophobicContact CB-CB 4.21Å; L99-L123 PolarHBondContact O-N 3.48Å; L100-L123 WeakPolarHBondContact O-CD1 3.37Å; D101-L123 HydrophobicContact CB-CD2 4Å; D101-L123 HydrophobicContact CB-CG 4.19Å
124	E	72.6	Confident	64.2	Low	105 Å²	105	82.8 Å²	82.8	49%	0.491	46%	0.464	S	S	.	.			trans	-95.6	130.9	177.2	-75.2	175	-172	0	0	109.8	R122 T126	R122-E124 HydrophobicContact CB-CG 4.17Å; R122-E124 WeakPolarHBondContact CD-OE1 3.3Å; R122-E124 IonicContact CZ-OE1 3.02Å; R122-E124 IonicContact NE-OE1 3.09Å; R122-E124 IonicContact NH1-OE1 2.68Å; R122-E124 PolarHBondContact NH1-OE1 2.93Å; R122-E124 PolarHBondContact O-N 3.12Å; E124-T126 PolarHBondContact O-N 3.49Å; E124-T126 VanDerWaalsContact O-N 3.11Å
125	V	56.3	Low	62.1	Low	62 Å²	62	84.7 Å²	84.7	38%	0.376	48%	0.477	S	S	.	.			trans	-69.3	107.5	161.7	178.6	0	0	0	0	105.1	A76 E77 V80 G127	A76-V125 HydrophobicContact CB-CG2 3.99Å; E77-V125 HydrophobicContact CB-CG2 4.46Å; E77-V125 HydrophobicContact CG-CG2 4.16Å; V80-V125 HydrophobicContact CB-CG2 4.19Å; V80-V125 HydrophobicContact CG2-CB 4.21Å; V80-V125 HydrophobicContact CG2-CG2 3.67Å; V125-G127 PolarHBondContact O-N 3.46Å
126	T	42.5	Very low	60.2	Low	74 Å²	74	87.4 Å²	87.4	45%	0.454	50%	0.502	S	S	.	.			trans	-47.8	114.7	164	46	0	0	0	0	107	E124 R129	E124-T126 PolarHBondContact O-N 3.49Å; E124-T126 VanDerWaalsContact O-N 3.11Å; T126-R129 PolarHBondContact O-N 2.89Å; T126-R129 WeakPolarHBondContact OG1-CD 3.46Å; T126-R129 WeakPolarHBondContact OG1-CG 3.48Å
127	G	42.3	Very low	59.2	Low	65 Å²	65	90.8 Å²	90.8	67%	0.67	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.2	142.3	174.2	0	0	0	0	0	109.6	V125 R129	V125-G127 PolarHBondContact O-N 3.46Å; G127-R129 PolarHBondContact O-N 3.01Å
128	P	35.6	Very low	59.3	Low	123 Å²	123	89.6 Å²	89.6	80%	0.799	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-37.9	101.5	-134.4	25.1	-34.3	0	0	0	110.6	K130	P128-K130 PolarHBondContact O-N 3.24Å
129	R	33.5	Very low	59.7	Low	206 Å²	206	86.3 Å²	86.3	78%	0.777	48%	0.479	S	S	*	.			trans	-53.7	102.3	145	-97	178.7	172	174.7	-2.4	103.1	T126 G127 G131	T126-R129 PolarHBondContact O-N 2.89Å; T126-R129 WeakPolarHBondContact OG1-CD 3.46Å; T126-R129 WeakPolarHBondContact OG1-CG 3.48Å; G127-R129 PolarHBondContact O-N 3.01Å; R129-G131 PolarHBondContact O-N 3.23Å
130	K	35.9	Very low	60.4	Low	132 Å²	132	83.4 Å²	83.4	57%	0.574	46%	0.458	S	S	*	.			trans	-38.2	119.9	148.6	-79.6	173.6	176.7	170.3	0	102.7	P128 L133	P128-K130 PolarHBondContact O-N 3.24Å; K130-L133 HydrophobicContact CD-CD2 4.06Å
131	G	32.9	Very low	61	Low	49 Å²	49	77.3 Å²	77.3	51%	0.505	44%	0.435	S	S	.	.			trans	-51	-176.6	168.2	0	0	0	0	0	109	R129 L133	R129-G131 PolarHBondContact O-N 3.23Å; G131-L133 PolarHBondContact O-N 3.19Å
132	P	36.5	Very low	61.5	Low	111 Å²	111	77.3 Å²	77.3	72%	0.721	44%	0.435	S	S	*	.	S	Bend	trans	-44.6	118.3	153.6	23.7	-31.5	0	0	0	105.8	S134 P190	P132-S134 PolarHBondContact O-N 2.95Å; P132-P190 HydrophobicContact CB-CG 4.3Å
133	L	38.8	Very low	61.9	Low	55 Å²	55	72.4 Å²	72.4	29%	0.288	42%	0.416	S	S	.	.			trans	-44	113.4	-179.7	-81.4	160.3	0	0	0	103.8	K130 G131 P135	K130-L133 HydrophobicContact CD-CD2 4.06Å; G131-L133 PolarHBondContact O-N 3.19Å; L133-P135 WeakPolarHBondContact O-CD 3.37Å
134	S	39	Very low	62.5	Low	78 Å²	78	75.3 Å²	75.3	55%	0.545	43%	0.43	S	S	.	.			trans	-47.4	127.9	165	44.4	0	0	0	0	104	P132 A136 W137	P132-S134 PolarHBondContact O-N 2.95Å; S134-A136 PolarHBondContact O-N 3.37Å; S134-W137 PolarHBondContact O-N 2.87Å; S134-W137 VanDerWaalsContact O-N 3.16Å
135	P	47.9	Very low	63.7	Low	73 Å²	73	70.5 Å²	70.5	47%	0.474	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.4	-17.9	-175.2	-29.4	32.8	0	0	0	113.8	L133 W137	L133-P135 WeakPolarHBondContact O-CD 3.37Å; P135-W137 VanDerWaalsContact C-N 3.3Å; P135-W137 PolarHBondContact O-N 3.16Å
136	A	53.4	Low	65.7	Low	84 Å²	84	70.8 Å²	70.8	69%	0.694	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-17.5	173.6	0	0	0	0	0	118	S134	S134-A136 PolarHBondContact O-N 3.37Å
137	W	72	Confident	68.3	Low	177 Å²	177	67.2 Å²	67.2	67%	0.67	39%	0.388	S	S	*	.			trans	-146.6	77.6	175.6	-159.4	56	0	0	0	115.1	S134 P135	S134-W137 PolarHBondContact O-N 2.87Å; S134-W137 VanDerWaalsContact O-N 3.16Å; P135-W137 VanDerWaalsContact C-N 3.3Å; P135-W137 PolarHBondContact O-N 3.16Å
138	M	91.1	Very high	70.9	Confident	14 Å²	14	66.1 Å²	66.1	7%	0.069	37%	0.369	C	S	.	.			trans	-88.7	121.9	167.9	176.5	62	70.9	0	0	110.6	R145 V185 A188 L189 L202 P203	M138-R145 HydrophobicContact SD-CB 4.31Å; M138-V185 HydrophobicContact CG-CG1 4.1Å; M138-A188 HydrophobicContact CE-CB 4.21Å; M138-A188 HydrophobicContact SD-CB 4.47Å; M138-L189 HydrophobicContact CE-CD2 3.81Å; M138-L202 HydrophobicContact CB-CD2 3.74Å; M138-L202 HydrophobicContact CG-CD2 4.4Å; M138-P203 HydrophobicContact CB-CG 4.43Å; M138-P203 HydrophobicContact CG-CG 4.07Å
139	P	94.8	Very high	73.8	Confident	18 Å²	18	63.6 Å²	63.6	12%	0.117	35%	0.349	C	S	.	.			trans	-60.9	141.3	176.2	-24.9	34.9	0	0	0	113.2	Y141 Q144 R145	P139-Y141 PolarHBondContact O-N 2.83Å; P139-Q144 HydrophobicContact CB-CB 3.6Å; P139-Q144 HydrophobicContact CG-CB 4.2Å; P139-R145 PolarHBondContact O-NH1 2.79Å
140	T	95.5	Very high	76.8	Confident	59 Å²	59	59.6 Å²	59.6	36%	0.362	35%	0.347	S	S	.	.	S	Bend	trans	-66	-37.9	-178	-51.8	0	0	0	0	112.9	R145 P203 H204	T140-R145 VanDerWaalsContact C-NH1 3.25Å; T140-R145 PolarHBondContact O-NH1 3.44Å; T140-P203 HydrophobicContact CG2-CB 4.33Å; T140-H204 VanDerWaalsContact CG2-CE1 3.41Å; T140-H204 WeakPolarHBondContact CG2-CE1 3.32Å; T140-H204 VanDerWaalsContact CG2-NE2 3.29Å; T140-H204 WeakPolarHBondContact CG2-NE2 3.32Å; T140-H204 PolarHBondContact O-NE2 3.29Å
141	Y	98.1	Very high	79.8	Confident	18 Å²	18	54.8 Å²	54.8	7%	0.071	33%	0.327	C	S	.	.	S	Bend	trans	-90.9	135.1	-174	-64	-95.7	0	0	0	112.1	P139 C143 Q144 R145 R446 F447 E451	P139-Y141 PolarHBondContact O-N 2.83Å; Y141-C143 PolarHBondContact O-N 3.1Å; Y141-Q144 WeakPolarHBondContact O-CB 3.31Å; Y141-Q144 PolarHBondContact O-N 3.06Å; Y141-R145 PolarHBondContact O-NH1 3.36Å; Y141-R145 VanDerWaalsContact O-NH1 3.16Å; Y141-R446 HydrophobicContact CE1-CB 4.26Å; Y141-R446 HydrophobicContact CE1-CG 3.99Å; Y141-R446 PolarHBondContact OH-NH1 3.44Å; Y141-F447 HydrophobicContact CD1-CB 3.55Å; Y141-F447 HydrophobicContact CD1-CD2 4.13Å; Y141-F447 HydrophobicContact CD1-CG 4.35Å; Y141-F447 AromaticContact CD2-CD2 3.8Å; Y141-F447 HydrophobicContact CD2-CD2 3.8Å; Y141-F447 VanDerWaalsContact CE1-CA 3.46Å; Y141-F447 HydrophobicContact CE1-CB 3.81Å; Y141-F447 HydrophobicContact CE1-CD2 4.34Å; Y141-F447 HydrophobicContact CE2-CD2 4.08Å; Y141-F447 HydrophobicContact CG-CB 4.04Å; Y141-F447 AromaticContact CG-CD2 3.84Å; Y141-F447 HydrophobicContact CG-CD2 3.84Å; Y141-F447 HydrophobicContact CG-CG 4.42Å; Y141-E451 HydrophobicContact CE2-CG 3.81Å; Y141-E451 WeakPolarHBondContact CE2-OE1 3.47Å; Y141-E451 VanDerWaalsContact CZ-OE1 3.25Å; Y141-E451 PolarHBondContact OH-OE1 3.29Å
142	A	98.3	Very high	82.9	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-62.1	-27.4	179.8	0	0	0	0	0	113.4	Q144 R145 E443 A494	A142-Q144 PolarHBondContact O-N 3.05Å; A142-R145 PolarHBondContact O-N 2.99Å; A142-R145 VanDerWaalsContact O-O 3.13Å; A142-E443 HydrophobicContact CB-CB 3.79Å; A142-E443 HydrophobicContact CB-CG 3.89Å; A142-A494 HydrophobicContact CB-CB 3.72Å
143	C	98.2	Very high	85.8	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-71.8	-5.2	175.7	58.3	0	0	0	0	114.8	Y141 F440 L444 F447 L484 L487	Y141-C143 PolarHBondContact O-N 3.1Å; C143-F440 HydrophobicContact CB-CE2 4.17Å; C143-F440 HydrophobicContact CB-CZ 4.09Å; C143-L444 HydrophobicContact CB-CB 3.97Å; C143-L444 HydrophobicContact CB-CD1 3.57Å; C143-L444 HydrophobicContact CB-CG 4.36Å; C143-F447 VanDerWaalsContact SG-CB 3.56Å; C143-L484 HydrophobicContact CB-CD1 4.12Å; C143-L487 WeakPolarHBondContact O-CD1 3.48Å
144	Q	98.3	Very high	88.6	Confident	78 Å²	78	52.9 Å²	52.9	36%	0.364	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-107.4	4.2	178.4	-65.9	179.2	-57.7	0	0	113	P139 Y141 A142 F447 L484	P139-Q144 HydrophobicContact CB-CB 3.6Å; P139-Q144 HydrophobicContact CG-CB 4.2Å; Y141-Q144 WeakPolarHBondContact O-CB 3.31Å; Y141-Q144 PolarHBondContact O-N 3.06Å; A142-Q144 PolarHBondContact O-N 3.05Å; Q144-F447 HydrophobicContact CG-CE2 4.34Å; Q144-L484 HydrophobicContact CG-CD2 3.54Å
145	R	96.3	Very high	91.4	Very high	4 Å²	4	53 Å²	53	2%	0.015	30%	0.299	C	S	.	.	S	Bend	trans	-133.2	134.4	-178.2	56.9	-175.3	179.6	-97.3	-2.6	110.5	M138 P139 T140 Y141 A142 T147 S184 A188 L487	M138-R145 HydrophobicContact SD-CB 4.31Å; P139-R145 PolarHBondContact O-NH1 2.79Å; T140-R145 VanDerWaalsContact C-NH1 3.25Å; T140-R145 PolarHBondContact O-NH1 3.44Å; Y141-R145 PolarHBondContact O-NH1 3.36Å; Y141-R145 VanDerWaalsContact O-NH1 3.16Å; A142-R145 PolarHBondContact O-N 2.99Å; A142-R145 VanDerWaalsContact O-O 3.13Å; R145-T147 PolarHBondContact O-N 3.47Å; R145-S184 PolarHBondContact NH2-OG 2.79Å; R145-A188 HydrophobicContact CB-CB 4.35Å; R145-A188 HydrophobicContact CG-CB 4.17Å; R145-L487 WeakPolarHBondContact O-CD1 3.34Å
146	P	97.9	Very high	93.8	Very high	68 Å²	68	49.7 Å²	49.7	44%	0.442	28%	0.277	S	S	.	.			trans	-68.4	125.3	169.2	28.5	-32	0	0	0	109.1	L487 Q491	P146-L487 HydrophobicContact CB-CD2 4Å; P146-Q491 HydrophobicContact CB-CB 4.09Å; P146-Q491 HydrophobicContact CB-CG 4.25Å
147	T	98.4	Very high	96	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-119.2	103.5	173.3	-49.9	0	0	0	0	109.3	R145 K187 Q491 N493	R145-T147 PolarHBondContact O-N 3.47Å; T147-K187 HydrophobicContact CG2-CB 3.51Å; T147-K187 HydrophobicContact CG2-CD 4.32Å; T147-Q491 PolarHBondContact N-O 2.71Å; T147-Q491 CarbonylContact O-C 3.5Å; T147-Q491 WeakPolarHBondContact O-CA 3.29Å; T147-N493 VanDerWaalsContact CG2-O 3.26Å; T147-N493 WeakPolarHBondContact CG2-O 3.37Å; T147-N493 WeakPolarHBondContact O-CB 3.37Å; T147-N493 PolarHBondContact O-N 2.87Å; T147-N493 VanDerWaalsContact O-N 3.08Å
148	P	97.6	Very high	97.2	Very high	41 Å²	41	41.9 Å²	41.9	27%	0.266	23%	0.234	S	C	.	.			trans	-71	163.5	-179.9	30.6	-35.8	0	0	0	111.6	T150	P148-T150 WeakPolarHBondContact CB-O 3.49Å; P148-T150 VanDerWaalsContact CG-O 3.24Å; P148-T150 WeakPolarHBondContact CG-O 3.36Å
149	L	96.4	Very high	97.6	Very high	71 Å²	71	41.3 Å²	41.3	37%	0.372	23%	0.232	S	C	.	.	S	Bend	trans	-64.6	-45.6	175.1	177.9	64.2	0	0	0	112.2	G324 K325	L149-G324 VanDerWaalsContact CD2-O 3.29Å; L149-G324 WeakPolarHBondContact CD2-O 3.27Å; L149-K325 HydrophobicContact CD1-CG 3.78Å
150	T	96.7	Very high	97.8	Very high	121 Å²	121	40.5 Å²	40.5	74%	0.742	23%	0.226	S	C	*	.	S	Bend	trans	-101.6	135.1	175.4	51.2	0	0	0	0	109.1	P148	P148-T150 WeakPolarHBondContact CB-O 3.49Å; P148-T150 VanDerWaalsContact CG-O 3.24Å; P148-T150 WeakPolarHBondContact CG-O 3.36Å
151	H	97.4	Very high	97.9	Very high	32 Å²	32	41 Å²	41	15%	0.148	22%	0.224	C	C	.	.			trans	-145.9	173.6	-173.7	66.6	92.2	0	0	0	111	N153 T154 S157 K187	H151-N153 VanDerWaalsContact CE1-C 3.42Å; H151-N153 PolarHBondContact ND1-N 3.26Å; H151-T154 VanDerWaalsContact CE1-CA 3.41Å; H151-T154 WeakPolarHBondContact CE1-CA 3.31Å; H151-T154 PolarHBondContact CE1-N 3.34Å; H151-T154 VanDerWaalsContact CE1-N 3.3Å; H151-S157 PolarHBondContact CE1-OG 3.17Å; H151-K187 VanDerWaalsContact CB-O 3.24Å; H151-K187 WeakPolarHBondContact CB-O 3.42Å
152	H	97.7	Very high	98	Very high	106 Å²	106	40.8 Å²	40.8	49%	0.491	23%	0.225	S	C	.	.	S	Bend	trans	-90.7	-0.9	-166.9	-58.2	-71.1	0	0	0	115.6	L189 P190 S191 P192	H152-L189 PolarHBondContact CD2-O 3.27Å; H152-P190 PolarHBondContact CD2-O 3.03Å; H152-P190 PolarHBondContact NE2-O 3.17Å; H152-S191 VanDerWaalsContact CB-C 3.42Å; H152-P192 HydrophobicContact CB-CB 4.39Å; H152-P192 HydrophobicContact CB-CG 3.9Å
153	N	98.1	Very high	98	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.021	23%	0.226	C	C	.	.			trans	-130.8	32.3	-165.4	-66.8	-66.3	0	0	0	112.6	H151 S155 L156 S157 L186 S191 P192 V193	H151-N153 VanDerWaalsContact CE1-C 3.42Å; H151-N153 PolarHBondContact ND1-N 3.26Å; N153-S155 PolarHBondContact O-N 3.27Å; N153-L156 HydrophobicContact CB-CD1 4.49Å; N153-L156 PolarHBondContact O-N 3.09Å; N153-S157 PolarHBondContact O-N 2.91Å; N153-S157 PolarHBondContact O-OG 3.21Å; N153-L186 HydrophobicContact CB-CB 4.05Å; N153-L186 PolarHBondContact ND2-O 3.07Å; N153-S191 PolarHBondContact ND2-O 2.73Å; N153-S191 VanDerWaalsContact ND2-O 3.09Å; N153-P192 WeakPolarHBondContact OD1-CA 3.15Å; N153-V193 PolarHBondContact OD1-N 3.5Å
154	T	97.8	Very high	98	Very high	64 Å²	64	41.2 Å²	41.2	39%	0.393	23%	0.228	S	C	.	.	H	α-helix	trans	-53.4	-50.9	-172.5	-51.2	0	0	0	0	113	H151 L156 S157 E158	H151-T154 VanDerWaalsContact CE1-CA 3.41Å; H151-T154 WeakPolarHBondContact CE1-CA 3.31Å; H151-T154 PolarHBondContact CE1-N 3.34Å; H151-T154 VanDerWaalsContact CE1-N 3.3Å; T154-L156 VanDerWaalsContact C-N 3.3Å; T154-L156 PolarHBondContact O-N 3.35Å; T154-S157 PolarHBondContact O-N 2.76Å; T154-S157 PolarHBondContact O-OG 3.38Å; T154-S157 VanDerWaalsContact O-OG 3.08Å; T154-E158 HydrophobicContact CG2-CG 4.14Å; T154-E158 WeakPolarHBondContact CG2-OE1 3.45Å; T154-E158 VanDerWaalsContact O-CB 3.31Å; T154-E158 WeakPolarHBondContact O-CB 3.3Å; T154-E158 VanDerWaalsContact O-CG 3.26Å; T154-E158 WeakPolarHBondContact O-CG 3.32Å; T154-E158 PolarHBondContact O-N 3.42Å
155	S	97.8	Very high	98	Very high	80 Å²	80	40.4 Å²	40.4	56%	0.559	22%	0.224	S	C	*	.	H	α-helix	trans	-59.8	-39.5	-179.8	55.1	0	0	0	0	112.8	N153 A159	N153-S155 PolarHBondContact O-N 3.27Å; S155-A159 WeakPolarHBondContact O-CB 3.28Å; S155-A159 PolarHBondContact O-N 2.79Å
156	L	98.6	Very high	98.1	Very high	5 Å²	5	41 Å²	41	3%	0.026	23%	0.229	C	C	.	.	H	α-helix	trans	-72.2	-44.8	179.7	-55	-178.1	0	0	0	111.8	N153 T154 L160 L186 V193 V213 L216	N153-L156 HydrophobicContact CB-CD1 4.49Å; N153-L156 PolarHBondContact O-N 3.09Å; T154-L156 VanDerWaalsContact C-N 3.3Å; T154-L156 PolarHBondContact O-N 3.35Å; L156-L160 WeakPolarHBondContact O-CG 3.33Å; L156-L160 PolarHBondContact O-N 3.05Å; L156-L186 HydrophobicContact CB-CD1 3.68Å; L156-V193 HydrophobicContact CD1-CB 3.85Å; L156-V193 HydrophobicContact CD1-CG1 4.44Å; L156-V193 HydrophobicContact CD1-CG2 4.43Å; L156-V213 HydrophobicContact CD1-CG1 3.92Å; L156-V213 HydrophobicContact CD2-CG1 4.12Å; L156-L216 HydrophobicContact CD2-CB 3.61Å; L156-L216 HydrophobicContact CD2-CD1 3.73Å; L156-L216 HydrophobicContact CD2-CG 4.31Å
157	S	98.4	Very high	98.1	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.007	21%	0.211	C	C	.	.	H	α-helix	trans	-67.7	-42.7	179.2	62.7	0	0	0	0	111.7	H151 N153 T154 A159 L160 E161	H151-S157 PolarHBondContact CE1-OG 3.17Å; N153-S157 PolarHBondContact O-N 2.91Å; N153-S157 PolarHBondContact O-OG 3.21Å; T154-S157 PolarHBondContact O-N 2.76Å; T154-S157 PolarHBondContact O-OG 3.38Å; T154-S157 VanDerWaalsContact O-OG 3.08Å; S157-A159 VanDerWaalsContact C-N 3.3Å; S157-A159 PolarHBondContact O-N 3.22Å; S157-L160 PolarHBondContact O-N 3.18Å; S157-E161 WeakPolarHBondContact O-CB 3.34Å; S157-E161 VanDerWaalsContact O-CG 3.28Å; S157-E161 WeakPolarHBondContact O-CG 3.25Å; S157-E161 PolarHBondContact O-N 3.13Å
158	E	98.5	Very high	98.1	Very high	96 Å²	96	38.4 Å²	38.4	45%	0.449	21%	0.214	S	C	.	.	H	α-helix	trans	-63.9	-35.4	179.5	-75.2	180	169.1	0	0	112.3	T154 E161 T162	T154-E158 HydrophobicContact CG2-CG 4.14Å; T154-E158 WeakPolarHBondContact CG2-OE1 3.45Å; T154-E158 VanDerWaalsContact O-CB 3.31Å; T154-E158 WeakPolarHBondContact O-CB 3.3Å; T154-E158 VanDerWaalsContact O-CG 3.26Å; T154-E158 WeakPolarHBondContact O-CG 3.32Å; T154-E158 PolarHBondContact O-N 3.42Å; E158-E161 PolarHBondContact O-N 3.39Å; E158-T162 WeakPolarHBondContact O-CB 3.2Å; E158-T162 PolarHBondContact O-N 3.48Å; E158-T162 PolarHBondContact O-OG1 3.24Å
159	A	98.7	Very high	98.1	Very high	2 Å²	2	37 Å²	37	2%	0.017	20%	0.204	C	C	.	.	H	α-helix	trans	-63.4	-47.7	173.4	0	0	0	0	0	111.6	S155 S157 E161 T162 L163 V212 L216 V225	S155-A159 WeakPolarHBondContact O-CB 3.28Å; S155-A159 PolarHBondContact O-N 2.79Å; S157-A159 VanDerWaalsContact C-N 3.3Å; S157-A159 PolarHBondContact O-N 3.22Å; A159-E161 VanDerWaalsContact C-N 3.34Å; A159-E161 PolarHBondContact O-N 2.87Å; A159-T162 WeakPolarHBondContact O-CB 2.92Å; A159-T162 PolarHBondContact O-N 2.81Å; A159-L163 PolarHBondContact O-N 2.86Å; A159-L163 VanDerWaalsContact O-N 3.17Å; A159-V212 HydrophobicContact CB-CG1 4.42Å; A159-L216 HydrophobicContact CB-CD1 3.43Å; A159-L216 VanDerWaalsContact CB-CD1 3.43Å; A159-L216 HydrophobicContact CB-CD2 4.5Å; A159-V225 HydrophobicContact CB-CG1 4.42Å; A159-V225 HydrophobicContact CB-CG2 4.05Å
160	L	98.8	Very high	98.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65.8	-36.8	176	-65.8	174.1	0	0	0	111.8	L156 S157 T162 L163 A164 F179 A182 A183 L186 V212	L156-L160 WeakPolarHBondContact O-CG 3.33Å; L156-L160 PolarHBondContact O-N 3.05Å; S157-L160 PolarHBondContact O-N 3.18Å; L160-T162 VanDerWaalsContact C-N 3.35Å; L160-L163 PolarHBondContact O-N 3.41Å; L160-A164 WeakPolarHBondContact O-CB 3.28Å; L160-A164 PolarHBondContact O-N 3.16Å; L160-F179 HydrophobicContact CD2-CD1 3.87Å; L160-F179 HydrophobicContact CD2-CE1 4.2Å; L160-F179 WeakPolarHBondContact O-CB 3.44Å; L160-A182 HydrophobicContact CD1-CB 3.91Å; L160-A183 HydrophobicContact CB-CB 4.01Å; L160-L186 HydrophobicContact CD1-CD1 3.65Å; L160-V212 HydrophobicContact CD2-CB 4.16Å; L160-V212 HydrophobicContact CD2-CG1 3.97Å
161	E	98.7	Very high	98	Very high	70 Å²	70	35.7 Å²	35.7	33%	0.327	20%	0.202	S	C	.	.	H	α-helix	trans	-65.4	-36.8	174.7	-74.6	176.2	156.8	0	0	112.3	S157 E158 A159 L163 A164 E165 A183 K187	S157-E161 WeakPolarHBondContact O-CB 3.34Å; S157-E161 VanDerWaalsContact O-CG 3.28Å; S157-E161 WeakPolarHBondContact O-CG 3.25Å; S157-E161 PolarHBondContact O-N 3.13Å; E158-E161 PolarHBondContact O-N 3.39Å; A159-E161 VanDerWaalsContact C-N 3.34Å; A159-E161 PolarHBondContact O-N 2.87Å; E161-L163 VanDerWaalsContact C-N 3.33Å; E161-L163 PolarHBondContact O-N 3.23Å; E161-A164 WeakPolarHBondContact O-CB 3.32Å; E161-A164 PolarHBondContact O-N 2.72Å; E161-E165 WeakPolarHBondContact O-CB 3.5Å; E161-E165 PolarHBondContact O-N 3.4Å; E161-A183 HydrophobicContact CG-CB 3.88Å; E161-K187 WeakPolarHBondContact OE1-CE 3.4Å; E161-K187 IonicContact OE1-NZ 3.79Å; E161-K187 PolarHBondContact OE1-NZ 2.82Å
162	T	98.7	Very high	98	Very high	13 Å²	13	36.4 Å²	36.4	8%	0.08	21%	0.21	C	C	.	.	H	α-helix	trans	-59.8	-45	172.1	-61.8	0	0	0	0	110.7	E158 A159 L160 A164 E165 A166 V225 V228 R229	E158-T162 WeakPolarHBondContact O-CB 3.2Å; E158-T162 PolarHBondContact O-N 3.48Å; E158-T162 PolarHBondContact O-OG1 3.24Å; A159-T162 WeakPolarHBondContact O-CB 2.92Å; A159-T162 PolarHBondContact O-N 2.81Å; L160-T162 VanDerWaalsContact C-N 3.35Å; T162-A164 VanDerWaalsContact C-N 3.35Å; T162-E165 PolarHBondContact O-N 3.13Å; T162-A166 WeakPolarHBondContact O-CB 3.39Å; T162-A166 PolarHBondContact O-N 3.39Å; T162-V225 HydrophobicContact CG2-CG1 4.05Å; T162-V228 HydrophobicContact CG2-CG1 4.01Å; T162-R229 HydrophobicContact CG2-CG 4.01Å
163	L	98.8	Very high	97.8	Very high	7 Å²	7	36.5 Å²	36.5	4%	0.037	21%	0.211	C	C	.	.	H	α-helix	trans	-68.2	-33.9	175.9	-61	-179.6	0	0	0	112.4	A159 L160 E161 A167 F179 V212 E224 V225 V228	A159-L163 PolarHBondContact O-N 2.86Å; A159-L163 VanDerWaalsContact O-N 3.17Å; L160-L163 PolarHBondContact O-N 3.41Å; E161-L163 VanDerWaalsContact C-N 3.33Å; E161-L163 PolarHBondContact O-N 3.23Å; L163-A167 VanDerWaalsContact O-CB 3.31Å; L163-A167 WeakPolarHBondContact O-CB 3.44Å; L163-A167 PolarHBondContact O-N 3.23Å; L163-F179 HydrophobicContact CB-CD1 4.29Å; L163-F179 HydrophobicContact CB-CD2 3.9Å; L163-F179 HydrophobicContact CB-CE1 4.25Å; L163-F179 HydrophobicContact CB-CE2 3.85Å; L163-F179 HydrophobicContact CB-CG 4.13Å; L163-F179 HydrophobicContact CB-CZ 4.03Å; L163-F179 HydrophobicContact CD1-CE1 3.95Å; L163-F179 HydrophobicContact CD1-CZ 3.99Å; L163-V212 HydrophobicContact CD1-CG1 4.26Å; L163-V212 HydrophobicContact CD1-CG2 3.69Å; L163-E224 HydrophobicContact CD2-CG 3.99Å; L163-V225 HydrophobicContact CD1-CG2 4.1Å; L163-V225 HydrophobicContact CD2-CG2 4.02Å; L163-V225 HydrophobicContact CG-CG2 3.98Å; L163-V228 HydrophobicContact CD2-CG2 4.03Å
164	A	98.6	Very high	97.7	Very high	3 Å²	3	38.9 Å²	38.9	3%	0.025	24%	0.237	C	C	.	.	H	α-helix	trans	-65.1	-45.9	175	0	0	0	0	0	111.7	L160 E161 T162 A167 G168 L176 F179	L160-A164 WeakPolarHBondContact O-CB 3.28Å; L160-A164 PolarHBondContact O-N 3.16Å; E161-A164 WeakPolarHBondContact O-CB 3.32Å; E161-A164 PolarHBondContact O-N 2.72Å; T162-A164 VanDerWaalsContact C-N 3.35Å; A164-A167 PolarHBondContact O-N 3.5Å; A164-G168 PolarHBondContact O-N 3.09Å; A164-L176 WeakPolarHBondContact O-CG 3.31Å; A164-F179 HydrophobicContact CB-CB 3.57Å
165	E	98.4	Very high	97.7	Very high	61 Å²	61	41.4 Å²	41.4	29%	0.285	24%	0.239	S	C	.	.	H	α-helix	trans	-61.3	-48.8	177.2	-177.5	173.2	-147.3	0	0	110.5	E161 T162 A167 G168 F169 Y234 K238	E161-E165 WeakPolarHBondContact O-CB 3.5Å; E161-E165 PolarHBondContact O-N 3.4Å; T162-E165 PolarHBondContact O-N 3.13Å; E165-A167 PolarHBondContact O-N 3.19Å; E165-G168 WeakPolarHBondContact O-CA 3.28Å; E165-G168 PolarHBondContact O-N 3.01Å; E165-F169 HydrophobicContact CG-CD2 4.39Å; E165-F169 HydrophobicContact CG-CE1 4.16Å; E165-F169 HydrophobicContact CG-CE2 3.63Å; E165-F169 HydrophobicContact CG-CZ 3.49Å; E165-F169 VanDerWaalsContact CG-CZ 3.49Å; E165-F169 PolarHBondContact O-N 2.77Å; E165-Y234 HydrophobicContact CB-CE2 4.31Å; E165-Y234 HydrophobicContact CG-CE2 4.07Å; E165-Y234 PolarHBondContact OE2-OH 2.87Å; E165-K238 IonicContact OE1-NZ 3.67Å; E165-K238 IonicContact OE2-NZ 3.29Å; E165-K238 PolarHBondContact OE2-NZ 3.24Å
166	A	98.5	Very high	97.7	Very high	16 Å²	16	38.7 Å²	38.7	13%	0.132	22%	0.218	C	C	.	.	H	α-helix	trans	-59.7	-43.9	175.8	0	0	0	0	0	112.5	T162 G168 F169 E170 V228 Y234	T162-A166 WeakPolarHBondContact O-CB 3.39Å; T162-A166 PolarHBondContact O-N 3.39Å; A166-G168 PolarHBondContact O-N 3.41Å; A166-F169 PolarHBondContact O-N 3Å; A166-F169 VanDerWaalsContact O-N 3.13Å; A166-E170 WeakPolarHBondContact O-CG 3.44Å; A166-E170 PolarHBondContact O-N 2.66Å; A166-E170 VanDerWaalsContact O-N 3.1Å; A166-V228 HydrophobicContact CB-CG1 3.51Å; A166-V228 HydrophobicContact CB-CG2 4.41Å; A166-Y234 HydrophobicContact CB-CD2 3.82Å; A166-Y234 HydrophobicContact CB-CE2 4.1Å
167	A	98.3	Very high	97.6	Very high	7 Å²	7	39.7 Å²	39.7	6%	0.058	22%	0.223	C	C	.	.	H	α-helix	trans	-59.7	-36.2	174.4	0	0	0	0	0	112.2	L163 A164 E165 E170 G171 S172 R175 L176	L163-A167 VanDerWaalsContact O-CB 3.31Å; L163-A167 WeakPolarHBondContact O-CB 3.44Å; L163-A167 PolarHBondContact O-N 3.23Å; A164-A167 PolarHBondContact O-N 3.5Å; E165-A167 PolarHBondContact O-N 3.19Å; A167-E170 CarbonylContact O-C 3.52Å; A167-E170 PolarHBondContact O-N 3.25Å; A167-G171 PolarHBondContact O-N 3.18Å; A167-S172 WeakPolarHBondContact O-CA 3.41Å; A167-S172 WeakPolarHBondContact O-CB 3.49Å; A167-S172 PolarHBondContact O-N 2.73Å; A167-R175 HydrophobicContact CB-CB 3.78Å; A167-L176 HydrophobicContact CB-CB 4.24Å
168	G	97.9	Very high	97.6	Very high	6 Å²	6	42.7 Å²	42.7	6%	0.062	24%	0.242	C	C	.	.	H	α-helix	trans	-62.7	-43.4	172.9	0	0	0	0	0	113.2	A164 E165 A166 E170 G171	A164-G168 PolarHBondContact O-N 3.09Å; E165-G168 WeakPolarHBondContact O-CA 3.28Å; E165-G168 PolarHBondContact O-N 3.01Å; A166-G168 PolarHBondContact O-N 3.41Å; G168-E170 PolarHBondContact O-N 3.04Å; G168-G171 PolarHBondContact O-N 2.92Å
169	F	98	Very high	97.6	Very high	13 Å²	13	38.4 Å²	38.4	6%	0.057	22%	0.222	C	C	.	.	H	α-helix	trans	-64.2	-29.1	176.5	-62.1	-25.9	0	0	0	113.3	E165 A166 G171 R233 Y234 M237 K238 T241 V248	E165-F169 HydrophobicContact CG-CD2 4.39Å; E165-F169 HydrophobicContact CG-CE1 4.16Å; E165-F169 HydrophobicContact CG-CE2 3.63Å; E165-F169 HydrophobicContact CG-CZ 3.49Å; E165-F169 VanDerWaalsContact CG-CZ 3.49Å; E165-F169 PolarHBondContact O-N 2.77Å; A166-F169 PolarHBondContact O-N 3Å; A166-F169 VanDerWaalsContact O-N 3.13Å; F169-G171 VanDerWaalsContact C-N 3.28Å; F169-R233 PolarHBondContact O-NH2 3.39Å; F169-Y234 AromaticContact CD2-CD2 3.8Å; F169-Y234 HydrophobicContact CD2-CD2 3.8Å; F169-Y234 HydrophobicContact CD2-CE2 4.24Å; F169-Y234 AromaticContact CE2-CD2 3.79Å; F169-Y234 HydrophobicContact CE2-CD2 3.79Å; F169-Y234 AromaticContact CE2-CE2 3.87Å; F169-Y234 HydrophobicContact CE2-CE2 3.87Å; F169-M237 HydrophobicContact CB-CB 4.03Å; F169-M237 HydrophobicContact CB-CE 3.98Å; F169-M237 HydrophobicContact CB-CG 4.15Å; F169-M237 HydrophobicContact CD1-CB 4.05Å; F169-M237 HydrophobicContact CD1-CE 4.17Å; F169-M237 HydrophobicContact CD2-CB 3.5Å; F169-M237 VanDerWaalsContact CD2-CB 3.5Å; F169-M237 HydrophobicContact CD2-CG 4.44Å; F169-M237 HydrophobicContact CE1-CB 4.39Å; F169-M237 HydrophobicContact CE2-CB 3.87Å; F169-M237 HydrophobicContact CG-CB 3.6Å; F169-M237 HydrophobicContact CG-CE 4.25Å; F169-M237 HydrophobicContact CG-CG 4.28Å; F169-M237 HydrophobicContact CZ-CB 4.31Å; F169-K238 HydrophobicContact CE2-CB 3.99Å; F169-K238 HydrophobicContact CZ-CB 4.13Å; F169-T241 HydrophobicContact CE1-CG2 4Å; F169-T241 WeakPolarHBondContact CE1-OG1 3.41Å; F169-V248 HydrophobicContact CD1-CG2 4.3Å
170	E	96.1	Very high	97.6	Very high	110 Å²	110	39.9 Å²	39.9	51%	0.514	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	7.3	173.8	-59.2	-50.2	128.2	0	0	113.2	A166 A167 G168 S172 R233	A166-E170 WeakPolarHBondContact O-CG 3.44Å; A166-E170 PolarHBondContact O-N 2.66Å; A166-E170 VanDerWaalsContact O-N 3.1Å; A167-E170 CarbonylContact O-C 3.52Å; A167-E170 PolarHBondContact O-N 3.25Å; G168-E170 PolarHBondContact O-N 3.04Å; E170-S172 PolarHBondContact O-N 2.76Å; E170-R233 WeakPolarHBondContact OE1-CG 3.26Å; E170-R233 IonicContact OE1-CZ 3.75Å; E170-R233 IonicContact OE1-NE 3.64Å; E170-R233 PolarHBondContact OE1-NE 2.96Å; E170-R233 IonicContact OE1-NH2 3.79Å
171	G	94.6	Very high	97.6	Very high	53 Å²	53	41.9 Å²	41.9	55%	0.546	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	12.6	-179.8	0	0	0	0	0	114.5	A167 G168 F169 E173	A167-G171 PolarHBondContact O-N 3.18Å; G168-G171 PolarHBondContact O-N 2.92Å; F169-G171 VanDerWaalsContact C-N 3.28Å; G171-E173 PolarHBondContact O-N 3.33Å; G171-E173 VanDerWaalsContact O-N 3.1Å
172	S	96.7	Very high	97.6	Very high	47 Å²	47	38.5 Å²	38.5	33%	0.329	22%	0.223	S	C	.	.			trans	-86.2	69.3	-178.4	-67.1	0	0	0	0	111.8	A167 E170 G174 R175 L176	A167-S172 WeakPolarHBondContact O-CA 3.41Å; A167-S172 WeakPolarHBondContact O-CB 3.49Å; A167-S172 PolarHBondContact O-N 2.73Å; E170-S172 PolarHBondContact O-N 2.76Å; S172-G174 VanDerWaalsContact C-N 3.28Å; S172-G174 PolarHBondContact O-N 3.43Å; S172-R175 PolarHBondContact O-N 3.3Å; S172-R175 VanDerWaalsContact O-N 3.08Å; S172-L176 PolarHBondContact O-N 3.45Å
173	E	93.9	Very high	97.6	Very high	109 Å²	109	38 Å²	38	51%	0.509	22%	0.22	S	C	.	.	H	α-helix	trans	-54.3	-38.1	-176.4	-74.9	-62.4	138.5	0	0	114.2	G171 L177	G171-E173 PolarHBondContact O-N 3.33Å; G171-E173 VanDerWaalsContact O-N 3.1Å; E173-L177 WeakPolarHBondContact O-CB 3.42Å; E173-L177 PolarHBondContact O-N 3.24Å
174	G	96.2	Very high	97.6	Very high	54 Å²	54	37.6 Å²	37.6	56%	0.557	22%	0.218	S	C	*	.	H	α-helix	trans	-63.3	-45.6	177.3	0	0	0	0	0	112.4	S172 L177 T178	S172-G174 VanDerWaalsContact C-N 3.28Å; S172-G174 PolarHBondContact O-N 3.43Å; G174-L177 PolarHBondContact O-N 2.7Å; G174-T178 PolarHBondContact O-N 2.94Å; G174-T178 PolarHBondContact O-OG1 2.71Å; G174-T178 VanDerWaalsContact O-OG1 3.12Å
175	R	97.2	Very high	97.5	Very high	116 Å²	116	37.5 Å²	37.5	44%	0.438	22%	0.217	S	C	.	.	H	α-helix	trans	-66.6	-44.7	177.8	-72.3	175.2	58.8	92.1	1.1	111.3	A167 S172 L177 T178 F179	A167-R175 HydrophobicContact CB-CB 3.78Å; S172-R175 PolarHBondContact O-N 3.3Å; S172-R175 VanDerWaalsContact O-N 3.08Å; R175-L177 VanDerWaalsContact C-N 3.29Å; R175-L177 PolarHBondContact O-N 2.79Å; R175-T178 PolarHBondContact O-N 3.36Å; R175-F179 VanDerWaalsContact O-CD2 3.24Å; R175-F179 WeakPolarHBondContact O-CD2 3.43Å; R175-F179 PolarHBondContact O-N 3.27Å
176	L	97.8	Very high	97.5	Very high	24 Å²	24	34.6 Å²	34.6	13%	0.126	20%	0.203	C	C	.	.	H	α-helix	trans	-51.7	-51.4	173.9	174.7	158.2	0	0	0	110.5	A164 A167 S172 T178 F179 C180	A164-L176 WeakPolarHBondContact O-CG 3.31Å; A167-L176 HydrophobicContact CB-CB 4.24Å; S172-L176 PolarHBondContact O-N 3.45Å; L176-T178 PolarHBondContact O-N 3.5Å; L176-F179 PolarHBondContact O-N 3.24Å; L176-C180 WeakPolarHBondContact O-CB 3.37Å; L176-C180 PolarHBondContact O-N 3.13Å; L176-C180 PolarHBondContact O-SG 2.9Å
177	L	97.3	Very high	97.5	Very high	25 Å²	25	35.1 Å²	35.1	13%	0.131	20%	0.203	C	C	.	.	H	α-helix	trans	-66	-39.7	-176.3	-177.4	56.5	0	0	0	112.4	E173 G174 R175 C180 R181 L439	E173-L177 WeakPolarHBondContact O-CB 3.42Å; E173-L177 PolarHBondContact O-N 3.24Å; G174-L177 PolarHBondContact O-N 2.7Å; R175-L177 VanDerWaalsContact C-N 3.29Å; R175-L177 PolarHBondContact O-N 2.79Å; L177-C180 PolarHBondContact O-N 3.4Å; L177-R181 HydrophobicContact CD1-CG 4.27Å; L177-R181 WeakPolarHBondContact O-CB 3.32Å; L177-R181 VanDerWaalsContact O-CG 3.28Å; L177-R181 WeakPolarHBondContact O-CG 3.27Å; L177-R181 PolarHBondContact O-N 2.84Å; L177-L439 HydrophobicContact CD1-CD1 4Å
178	T	97.6	Very high	97.5	Very high	65 Å²	65	35.5 Å²	35.5	40%	0.399	21%	0.206	S	C	.	.	H	α-helix	trans	-61.1	-47.6	175.9	-63.3	0	0	0	0	111.4	G174 R175 L176 R181 A182	G174-T178 PolarHBondContact O-N 2.94Å; G174-T178 PolarHBondContact O-OG1 2.71Å; G174-T178 VanDerWaalsContact O-OG1 3.12Å; R175-T178 PolarHBondContact O-N 3.36Å; L176-T178 PolarHBondContact O-N 3.5Å; T178-R181 PolarHBondContact O-N 2.66Å; T178-A182 PolarHBondContact O-N 3.42Å
179	F	98.6	Very high	97.5	Very high	6 Å²	6	36.1 Å²	36.1	3%	0.026	21%	0.208	C	C	.	.	H	α-helix	trans	-66	-41.4	177.8	-73.6	-54.7	0	0	0	112.7	L160 L163 A164 R175 L176 R181 A182 A183 H208	L160-F179 HydrophobicContact CD2-CD1 3.87Å; L160-F179 HydrophobicContact CD2-CE1 4.2Å; L160-F179 WeakPolarHBondContact O-CB 3.44Å; L163-F179 HydrophobicContact CB-CD1 4.29Å; L163-F179 HydrophobicContact CB-CD2 3.9Å; L163-F179 HydrophobicContact CB-CE1 4.25Å; L163-F179 HydrophobicContact CB-CE2 3.85Å; L163-F179 HydrophobicContact CB-CG 4.13Å; L163-F179 HydrophobicContact CB-CZ 4.03Å; L163-F179 HydrophobicContact CD1-CE1 3.95Å; L163-F179 HydrophobicContact CD1-CZ 3.99Å; A164-F179 HydrophobicContact CB-CB 3.57Å; R175-F179 VanDerWaalsContact O-CD2 3.24Å; R175-F179 WeakPolarHBondContact O-CD2 3.43Å; R175-F179 PolarHBondContact O-N 3.27Å; L176-F179 PolarHBondContact O-N 3.24Å; F179-R181 VanDerWaalsContact C-N 3.31Å; F179-R181 PolarHBondContact O-N 2.66Å; F179-A182 PolarHBondContact O-N 3.4Å; F179-A183 WeakPolarHBondContact O-CB 3.29Å; F179-A183 PolarHBondContact O-N 2.96Å; F179-H208 AromaticContact CZ-CE1 3.98Å
180	C	98.6	Very high	97.3	Very high	33 Å²	33	38.5 Å²	38.5	22%	0.223	22%	0.224	C	C	.	.	H	α-helix	trans	-58	-43.2	173.1	-72	0	0	0	0	111.8	L176 L177 S184 L439	L176-C180 WeakPolarHBondContact O-CB 3.37Å; L176-C180 PolarHBondContact O-N 3.13Å; L176-C180 PolarHBondContact O-SG 2.9Å; L177-C180 PolarHBondContact O-N 3.4Å; C180-S184 WeakPolarHBondContact O-CB 3.18Å; C180-S184 PolarHBondContact O-N 2.8Å; C180-L439 HydrophobicContact CB-CD1 4.28Å; C180-L439 HydrophobicContact CB-CD2 4.22Å; C180-L439 WeakPolarHBondContact O-CD2 3.49Å
181	R	98.6	Very high	97.2	Very high	41 Å²	41	36.2 Å²	36.2	16%	0.155	22%	0.221	C	C	.	.	H	α-helix	trans	-64.6	-47.1	178.1	-76.5	170	172.7	158.8	1.2	111.8	L177 T178 F179 S184 V185 H204 L439 E443 R446	L177-R181 HydrophobicContact CD1-CG 4.27Å; L177-R181 WeakPolarHBondContact O-CB 3.32Å; L177-R181 VanDerWaalsContact O-CG 3.28Å; L177-R181 WeakPolarHBondContact O-CG 3.27Å; L177-R181 PolarHBondContact O-N 2.84Å; T178-R181 PolarHBondContact O-N 2.66Å; F179-R181 VanDerWaalsContact C-N 3.31Å; F179-R181 PolarHBondContact O-N 2.66Å; R181-S184 PolarHBondContact O-N 2.84Å; R181-S184 PolarHBondContact O-OG 3.17Å; R181-V185 WeakPolarHBondContact O-CG2 3.39Å; R181-V185 PolarHBondContact O-N 2.9Å; R181-H204 HydrophobicContact CB-CB 3.82Å; R181-L439 HydrophobicContact CG-CD1 4.29Å; R181-E443 IonicContact CZ-OE1 3.61Å; R181-E443 IonicContact NE-OE1 3.02Å; R181-E443 PolarHBondContact NE-OE1 3.24Å; R181-E443 IonicContact NE-OE2 3.32Å; R181-E443 IonicContact NH2-OE1 3.88Å; R181-E443 PolarHBondContact NH2-OE1 2.83Å; R181-R446 VanDerWaalsContact NH2-CD 3.26Å
182	A	98.4	Very high	97.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-58.6	-48.1	176.8	0	0	0	0	0	111.4	L160 T178 F179 S184 V185 L186 L205	L160-A182 HydrophobicContact CD1-CB 3.91Å; T178-A182 PolarHBondContact O-N 3.42Å; F179-A182 PolarHBondContact O-N 3.4Å; A182-S184 VanDerWaalsContact C-N 3.34Å; A182-S184 PolarHBondContact O-N 3.4Å; A182-V185 PolarHBondContact O-N 3.42Å; A182-L186 PolarHBondContact O-N 2.88Å; A182-L205 HydrophobicContact CB-CD2 4.18Å; A182-L205 HydrophobicContact CB-CG 4.41Å
183	A	98.8	Very high	97.3	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.008	20%	0.203	C	C	.	.	H	α-helix	trans	-56.6	-46.3	174.7	0	0	0	0	0	111.8	L160 E161 F179 V185 L186 K187	L160-A183 HydrophobicContact CB-CB 4.01Å; E161-A183 HydrophobicContact CG-CB 3.88Å; F179-A183 WeakPolarHBondContact O-CB 3.29Å; F179-A183 PolarHBondContact O-N 2.96Å; A183-V185 VanDerWaalsContact C-N 3.28Å; A183-V185 PolarHBondContact O-N 3.44Å; A183-L186 WeakPolarHBondContact O-CB 3.44Å; A183-L186 PolarHBondContact O-N 2.87Å; A183-L186 VanDerWaalsContact O-N 3.14Å; A183-K187 WeakPolarHBondContact O-CG 3.31Å; A183-K187 PolarHBondContact O-N 3.33Å
184	S	98.6	Very high	97.4	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-66	-27.5	-179.8	81	0	0	0	0	114.3	R145 C180 R181 A182 A188 L439 A494	R145-S184 PolarHBondContact NH2-OG 2.79Å; C180-S184 WeakPolarHBondContact O-CB 3.18Å; C180-S184 PolarHBondContact O-N 2.8Å; R181-S184 PolarHBondContact O-N 2.84Å; R181-S184 PolarHBondContact O-OG 3.17Å; A182-S184 VanDerWaalsContact C-N 3.34Å; A182-S184 PolarHBondContact O-N 3.4Å; S184-A188 PolarHBondContact O-N 2.92Å; S184-L439 WeakPolarHBondContact OG-CD2 3.21Å; S184-A494 WeakPolarHBondContact CB-OXT 3.42Å
185	V	98.4	Very high	97.2	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-68.5	-45.4	173.3	166.1	0	0	0	0	109.3	M138 R181 A182 A183 K187 A188 L189 L202 P203 L205	M138-V185 HydrophobicContact CG-CG1 4.1Å; R181-V185 WeakPolarHBondContact O-CG2 3.39Å; R181-V185 PolarHBondContact O-N 2.9Å; A182-V185 PolarHBondContact O-N 3.42Å; A183-V185 VanDerWaalsContact C-N 3.28Å; A183-V185 PolarHBondContact O-N 3.44Å; V185-K187 VanDerWaalsContact C-N 3.3Å; V185-K187 PolarHBondContact O-N 2.91Å; V185-A188 PolarHBondContact O-N 3.13Å; V185-A188 VanDerWaalsContact O-N 3.11Å; V185-L189 PolarHBondContact O-N 3.35Å; V185-L202 HydrophobicContact CG1-CB 4.23Å; V185-L202 HydrophobicContact CG1-CD1 4.25Å; V185-P203 HydrophobicContact CG2-CG 4.1Å; V185-L205 HydrophobicContact CG1-CD1 4.02Å
186	L	98.3	Very high	97	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.4	-36.1	176.8	-61.6	-179.6	0	0	0	112.8	N153 L156 L160 A182 A183 A188 L189 V193 L199 L205 V213	N153-L186 HydrophobicContact CB-CB 4.05Å; N153-L186 PolarHBondContact ND2-O 3.07Å; L156-L186 HydrophobicContact CB-CD1 3.68Å; L160-L186 HydrophobicContact CD1-CD1 3.65Å; A182-L186 PolarHBondContact O-N 2.88Å; A183-L186 WeakPolarHBondContact O-CB 3.44Å; A183-L186 PolarHBondContact O-N 2.87Å; A183-L186 VanDerWaalsContact O-N 3.14Å; L186-A188 VanDerWaalsContact C-N 3.26Å; L186-A188 PolarHBondContact O-N 2.81Å; L186-L189 HydrophobicContact CD2-CD1 3.88Å; L186-L189 PolarHBondContact O-N 2.86Å; L186-V193 HydrophobicContact CD2-CG2 4.18Å; L186-L199 HydrophobicContact CD2-CD2 4.08Å; L186-L205 HydrophobicContact CD2-CD1 4.15Å; L186-L205 HydrophobicContact CD2-CD2 4.47Å; L186-V213 HydrophobicContact CD1-CG2 4.16Å
187	K	98.5	Very high	96.7	Very high	27 Å²	27	35.3 Å²	35.3	12%	0.117	22%	0.215	C	C	.	.	H	α-helix	trans	-63.6	-30.4	174.3	-66.6	-179.8	-172.9	171.9	0	113.6	T147 H151 E161 A183 V185 A494	T147-K187 HydrophobicContact CG2-CB 3.51Å; T147-K187 HydrophobicContact CG2-CD 4.32Å; H151-K187 VanDerWaalsContact CB-O 3.24Å; H151-K187 WeakPolarHBondContact CB-O 3.42Å; E161-K187 WeakPolarHBondContact OE1-CE 3.4Å; E161-K187 IonicContact OE1-NZ 3.79Å; E161-K187 PolarHBondContact OE1-NZ 2.82Å; A183-K187 WeakPolarHBondContact O-CG 3.31Å; A183-K187 PolarHBondContact O-N 3.33Å; V185-K187 VanDerWaalsContact C-N 3.3Å; V185-K187 PolarHBondContact O-N 2.91Å; K187-A494 PolarHBondContact NZ-OXT 2.99Å
188	A	98	Very high	96.4	Very high	15 Å²	15	37 Å²	37	12%	0.124	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-5.1	-178.6	0	0	0	0	0	113.5	M138 R145 S184 V185 L186	M138-A188 HydrophobicContact CE-CB 4.21Å; M138-A188 HydrophobicContact SD-CB 4.47Å; R145-A188 HydrophobicContact CB-CB 4.35Å; R145-A188 HydrophobicContact CG-CB 4.17Å; S184-A188 PolarHBondContact O-N 2.92Å; V185-A188 PolarHBondContact O-N 3.13Å; V185-A188 VanDerWaalsContact O-N 3.11Å; L186-A188 VanDerWaalsContact C-N 3.26Å; L186-A188 PolarHBondContact O-N 2.81Å
189	L	96.6	Very high	96.2	Very high	19 Å²	19	34.2 Å²	34.2	10%	0.099	21%	0.205	C	C	.	.			trans	-70.2	138.8	177.2	-70.7	174.7	0	0	0	110.8	M138 H152 V185 L186 S191 V193 L202	M138-L189 HydrophobicContact CE-CD2 3.81Å; H152-L189 PolarHBondContact CD2-O 3.27Å; V185-L189 PolarHBondContact O-N 3.35Å; L186-L189 HydrophobicContact CD2-CD1 3.88Å; L186-L189 PolarHBondContact O-N 2.86Å; L189-S191 PolarHBondContact O-N 3.23Å; L189-V193 HydrophobicContact CD1-CG2 3.49Å; L189-V193 VanDerWaalsContact CD1-CG2 3.49Å; L189-L202 HydrophobicContact CD1-CD1 4.01Å; L189-L202 HydrophobicContact CD2-CD1 4.08Å; L189-L202 HydrophobicContact CD2-CD2 4.23Å
190	P	94.8	Very high	95.7	Very high	63 Å²	63	41.8 Å²	41.8	41%	0.409	24%	0.24	S	C	.	.	S	Bend	trans	-77.9	-2.8	-176.5	33.3	-37.6	0	0	0	113.8	P132 H152	P132-P190 HydrophobicContact CB-CG 4.3Å; H152-P190 PolarHBondContact CD2-O 3.03Å; H152-P190 PolarHBondContact NE2-O 3.17Å
191	S	94.6	Very high	95.2	Very high	63 Å²	63	43.4 Å²	43.4	44%	0.441	26%	0.263	S	S	.	.	S	Bend	trans	-150.8	161.8	-178.4	63	0	0	0	0	111.1	H152 N153 L189	H152-S191 VanDerWaalsContact CB-C 3.42Å; N153-S191 PolarHBondContact ND2-O 2.73Å; N153-S191 VanDerWaalsContact ND2-O 3.09Å; L189-S191 PolarHBondContact O-N 3.23Å
192	P	97	Very high	95	Very high	67 Å²	67	42 Å²	42	44%	0.435	26%	0.258	S	S	.	.			trans	-61.3	142.2	172.1	-18.3	29.4	0	0	0	110.9	H152 N153	H152-P192 HydrophobicContact CB-CB 4.39Å; H152-P192 HydrophobicContact CB-CG 3.9Å; N153-P192 WeakPolarHBondContact OD1-CA 3.15Å
193	V	96.4	Very high	94.9	Very high	11 Å²	11	43 Å²	43	7%	0.067	27%	0.265	C	S	.	.			trans	-79.2	125.7	165.7	178.7	0	0	0	0	107.9	N153 L156 L186 L189 Q198 L199 V213 L217	N153-V193 PolarHBondContact OD1-N 3.5Å; L156-V193 HydrophobicContact CD1-CB 3.85Å; L156-V193 HydrophobicContact CD1-CG1 4.44Å; L156-V193 HydrophobicContact CD1-CG2 4.43Å; L186-V193 HydrophobicContact CD2-CG2 4.18Å; L189-V193 HydrophobicContact CD1-CG2 3.49Å; L189-V193 VanDerWaalsContact CD1-CG2 3.49Å; V193-Q198 VanDerWaalsContact CA-OE1 3.31Å; V193-Q198 HydrophobicContact CG1-CB 4.39Å; V193-L199 HydrophobicContact CG1-CD2 3.83Å; V193-L199 HydrophobicContact CG1-CG 4.43Å; V193-L199 HydrophobicContact CG2-CD2 4.05Å; V193-V213 HydrophobicContact CG1-CG1 4.45Å; V193-L217 HydrophobicContact CG1-CD1 4.13Å; V193-L217 VanDerWaalsContact O-CD2 3.3Å; V193-L217 WeakPolarHBondContact O-CD2 3.4Å
194	T	94.8	Very high	94.7	Very high	92 Å²	92	45.3 Å²	45.3	56%	0.564	28%	0.275	S	S	*	.			trans	-120.1	-20	-179.6	57.5	0	0	0	0	112.5	Q198	T194-Q198 PolarHBondContact OG1-NE2 3.29Å
195	T	93.2	Very high	94.5	Very high	62 Å²	62	46.2 Å²	46.2	38%	0.38	28%	0.28	S	S	.	.	S	Bend	trans	-138.3	148.1	179.7	64.8	0	0	0	0	111.2	S197 Q198	T195-S197 PolarHBondContact O-N 3.19Å; T195-S197 PolarHBondContact OG1-OG 3.02Å; T195-Q198 VanDerWaalsContact N-OE1 3.14Å; T195-Q198 WeakPolarHBondContact O-CB 3.38Å; T195-Q198 PolarHBondContact O-N 3.25Å; T195-Q198 VanDerWaalsContact O-N 3.13Å; T195-Q198 PolarHBondContact O-OE1 2.84Å
196	L	91.9	Very high	94.2	Very high	69 Å²	69	48.2 Å²	48.2	36%	0.361	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-62.4	-31	-178.3	-168.2	65.2	0	0	0	113.1	Q198 L199 Q214	L196-Q198 PolarHBondContact O-N 3.33Å; L196-Q198 VanDerWaalsContact O-N 3.15Å; L196-L199 HydrophobicContact CD1-CD1 3.66Å; L196-L199 HydrophobicContact CD1-CG 4.35Å; L196-L199 WeakPolarHBondContact O-CB 3.3Å; L196-L199 PolarHBondContact O-N 3.29Å; L196-Q214 HydrophobicContact CD1-CB 4.05Å; L196-Q214 HydrophobicContact CD2-CB 4.37Å; L196-Q214 HydrophobicContact CD2-CG 4.31Å
197	S	90.9	Very high	94	Very high	83 Å²	83	56.3 Å²	56.3	58%	0.58	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-57.7	-26.8	176.7	54.2	0	0	0	0	113.6	T195 L199 Q200	T195-S197 PolarHBondContact O-N 3.19Å; T195-S197 PolarHBondContact OG1-OG 3.02Å; S197-L199 PolarHBondContact O-N 2.87Å; S197-Q200 VanDerWaalsContact O-CB 3.31Å; S197-Q200 WeakPolarHBondContact O-CB 3.48Å; S197-Q200 PolarHBondContact O-N 2.99Å
198	Q	92.8	Very high	94	Very high	60 Å²	60	57.3 Å²	57.3	28%	0.28	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-70.6	-16.6	177.4	-67.2	164.4	-21.1	0	0	112.9	V193 T194 T195 L196 Q200	V193-Q198 VanDerWaalsContact CA-OE1 3.31Å; V193-Q198 HydrophobicContact CG1-CB 4.39Å; T194-Q198 PolarHBondContact OG1-NE2 3.29Å; T195-Q198 VanDerWaalsContact N-OE1 3.14Å; T195-Q198 WeakPolarHBondContact O-CB 3.38Å; T195-Q198 PolarHBondContact O-N 3.25Å; T195-Q198 VanDerWaalsContact O-N 3.13Å; T195-Q198 PolarHBondContact O-OE1 2.84Å; L196-Q198 PolarHBondContact O-N 3.33Å; L196-Q198 VanDerWaalsContact O-N 3.15Å; Q198-Q200 VanDerWaalsContact C-N 3.32Å
199	L	92.2	Very high	93.9	Very high	7 Å²	7	56.7 Å²	56.7	4%	0.037	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-81.4	-15.4	175.1	-53.9	-171.7	0	0	0	112.6	L186 V193 L196 S197 G201 L202 L205 V213	L186-L199 HydrophobicContact CD2-CD2 4.08Å; V193-L199 HydrophobicContact CG1-CD2 3.83Å; V193-L199 HydrophobicContact CG1-CG 4.43Å; V193-L199 HydrophobicContact CG2-CD2 4.05Å; L196-L199 HydrophobicContact CD1-CD1 3.66Å; L196-L199 HydrophobicContact CD1-CG 4.35Å; L196-L199 WeakPolarHBondContact O-CB 3.3Å; L196-L199 PolarHBondContact O-N 3.29Å; S197-L199 PolarHBondContact O-N 2.87Å; L199-G201 PolarHBondContact O-N 3.24Å; L199-L202 HydrophobicContact CD2-CD1 4.2Å; L199-L202 WeakPolarHBondContact O-CB 3.23Å; L199-L202 PolarHBondContact O-N 2.95Å; L199-L205 HydrophobicContact CD1-CD2 4.46Å; L199-L205 HydrophobicContact CD2-CD1 4.21Å; L199-V213 HydrophobicContact CD1-CB 3.84Å; L199-V213 HydrophobicContact CD1-CG1 3.71Å; L199-V213 HydrophobicContact CD1-CG2 4.21Å
200	Q	88.9	Confident	94	Very high	164 Å²	164	57 Å²	57	77%	0.766	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	125.5	-176.1	-171	177.3	-4.6	0	0	110.6	S197 Q198 L202	S197-Q200 VanDerWaalsContact O-CB 3.31Å; S197-Q200 WeakPolarHBondContact O-CB 3.48Å; S197-Q200 PolarHBondContact O-N 2.99Å; Q198-Q200 VanDerWaalsContact C-N 3.32Å; Q200-L202 VanDerWaalsContact C-N 3.3Å; Q200-L202 PolarHBondContact O-N 2.92Å
201	G	87.9	Confident	94.1	Very high	67 Å²	67	58.6 Å²	58.6	69%	0.691	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	-6	-178.5	0	0	0	0	0	114.8	L199	L199-G201 PolarHBondContact O-N 3.24Å
202	L	94.3	Very high	94.3	Very high	11 Å²	11	55.6 Å²	55.6	6%	0.058	32%	0.319	C	S	.	.			trans	-73.7	135.7	174	-63	-175	0	0	0	111.1	M138 V185 L189 L199 Q200 L205	M138-L202 HydrophobicContact CB-CD2 3.74Å; M138-L202 HydrophobicContact CG-CD2 4.4Å; V185-L202 HydrophobicContact CG1-CB 4.23Å; V185-L202 HydrophobicContact CG1-CD1 4.25Å; L189-L202 HydrophobicContact CD1-CD1 4.01Å; L189-L202 HydrophobicContact CD2-CD1 4.08Å; L189-L202 HydrophobicContact CD2-CD2 4.23Å; L199-L202 HydrophobicContact CD2-CD1 4.2Å; L199-L202 WeakPolarHBondContact O-CB 3.23Å; L199-L202 PolarHBondContact O-N 2.95Å; Q200-L202 VanDerWaalsContact C-N 3.3Å; Q200-L202 PolarHBondContact O-N 2.92Å; L202-L205 HydrophobicContact CB-CD1 3.5Å; L202-L205 HydrophobicContact CD1-CD1 3.66Å; L202-L205 HydrophobicContact CG-CD1 4.24Å
203	P	95.3	Very high	94.3	Very high	22 Å²	22	52.4 Å²	52.4	14%	0.143	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	151.3	-179.1	29.4	-34.8	0	0	0	111.4	M138 T140 V185 L205	M138-P203 HydrophobicContact CB-CG 4.43Å; M138-P203 HydrophobicContact CG-CG 4.07Å; T140-P203 HydrophobicContact CG2-CB 4.33Å; V185-P203 HydrophobicContact CG2-CG 4.1Å; P203-L205 PolarHBondContact O-N 3.27Å
204	H	95.7	Very high	94.3	Very high	49 Å²	49	55.1 Å²	55.1	23%	0.227	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	-2.3	176	-44.1	-66	0	0	0	116.3	T140 R181 G206	T140-H204 VanDerWaalsContact CG2-CE1 3.41Å; T140-H204 WeakPolarHBondContact CG2-CE1 3.32Å; T140-H204 VanDerWaalsContact CG2-NE2 3.29Å; T140-H204 WeakPolarHBondContact CG2-NE2 3.32Å; T140-H204 PolarHBondContact O-NE2 3.29Å; R181-H204 HydrophobicContact CB-CB 3.82Å; H204-G206 PolarHBondContact O-N 2.81Å
205	L	94.4	Very high	94.5	Very high	20 Å²	20	52.7 Å²	52.7	11%	0.105	29%	0.293	C	S	.	.			trans	-90.7	76.3	173.3	-76.6	153.4	0	0	0	109.7	A182 V185 L186 L199 L202 P203 S210	A182-L205 HydrophobicContact CB-CD2 4.18Å; A182-L205 HydrophobicContact CB-CG 4.41Å; V185-L205 HydrophobicContact CG1-CD1 4.02Å; L186-L205 HydrophobicContact CD2-CD1 4.15Å; L186-L205 HydrophobicContact CD2-CD2 4.47Å; L199-L205 HydrophobicContact CD1-CD2 4.46Å; L199-L205 HydrophobicContact CD2-CD1 4.21Å; L202-L205 HydrophobicContact CB-CD1 3.5Å; L202-L205 HydrophobicContact CD1-CD1 3.66Å; L202-L205 HydrophobicContact CG-CD1 4.24Å; P203-L205 PolarHBondContact O-N 3.27Å; L205-S210 PolarHBondContact O-OG 2.99Å
206	G	91.9	Very high	94.7	Very high	42 Å²	42	51 Å²	51	43%	0.433	28%	0.281	S	S	.	.			trans	-74.7	-175.6	173.8	0	0	0	0	0	112.9	H204 H208 S209 S210	H204-G206 PolarHBondContact O-N 2.81Å; G206-H208 VanDerWaalsContact C-N 3.33Å; G206-H208 PolarHBondContact O-N 3.29Å; G206-S209 PolarHBondContact O-N 3.44Å; G206-S210 VanDerWaalsContact O-CB 3.3Å; G206-S210 WeakPolarHBondContact O-CB 3.46Å; G206-S210 PolarHBondContact O-N 3.31Å; G206-S210 PolarHBondContact O-OG 2.75Å
207	E	94.4	Very high	94.9	Very high	169 Å²	169	50.6 Å²	50.6	79%	0.79	28%	0.279	S	S	*	.	H	α-helix	trans	-53	-46.3	-179.2	-172	-170.9	164.8	0	0	112.7	S210 R211	E207-S210 PolarHBondContact O-N 2.86Å; E207-R211 WeakPolarHBondContact O-CB 3.35Å; E207-R211 PolarHBondContact O-N 2.59Å
208	H	97.1	Very high	95.1	Very high	48 Å²	48	52.7 Å²	52.7	22%	0.222	28%	0.28	C	S	.	.	H	α-helix	trans	-63.5	-53.1	-179.3	-165.8	159.7	0	0	0	111.6	F179 G206 S210 R211 V212 E224	F179-H208 AromaticContact CZ-CE1 3.98Å; G206-H208 VanDerWaalsContact C-N 3.33Å; G206-H208 PolarHBondContact O-N 3.29Å; H208-S210 VanDerWaalsContact C-N 3.26Å; H208-S210 PolarHBondContact O-N 2.79Å; H208-R211 PolarHBondContact CD2-NH2 3.37Å; H208-R211 PolarHBondContact NE2-NH2 3.18Å; H208-R211 PolarHBondContact O-N 3.44Å; H208-V212 WeakPolarHBondContact O-CG2 3.32Å; H208-V212 PolarHBondContact O-N 2.91Å; H208-V212 VanDerWaalsContact O-N 3.09Å; H208-E224 IonicContact CD2-OE2 3.13Å; H208-E224 IonicContact CE1-OE1 3.17Å; H208-E224 PolarHBondContact CE1-OE1 2.77Å; H208-E224 VanDerWaalsContact CE1-OE1 3.29Å; H208-E224 IonicContact CE1-OE2 3.5Å; H208-E224 VanDerWaalsContact NE2-CD 3.26Å; H208-E224 IonicContact NE2-OE1 3.54Å; H208-E224 PolarHBondContact NE2-OE1 3.32Å; H208-E224 IonicContact NE2-OE2 3.13Å; H208-E224 PolarHBondContact NE2-OE2 3.48Å
209	S	97.6	Very high	95.2	Very high	3 Å²	3	54.7 Å²	54.7	2%	0.021	29%	0.291	C	S	.	.	H	α-helix	trans	-61.8	-36.7	179	-56.7	0	0	0	0	112	G206 V212 V213	G206-S209 PolarHBondContact O-N 3.44Å; S209-V212 PolarHBondContact O-N 3.43Å; S209-V213 WeakPolarHBondContact O-CG2 3.13Å; S209-V213 PolarHBondContact O-N 2.91Å
210	S	96.9	Very high	95.3	Very high	25 Å²	25	57 Å²	57	18%	0.175	32%	0.317	C	S	.	.	H	α-helix	trans	-65	-41.9	176.6	-60.1	0	0	0	0	112	L205 G206 E207 H208 V212 V213 Q214	L205-S210 PolarHBondContact O-OG 2.99Å; G206-S210 VanDerWaalsContact O-CB 3.3Å; G206-S210 WeakPolarHBondContact O-CB 3.46Å; G206-S210 PolarHBondContact O-N 3.31Å; G206-S210 PolarHBondContact O-OG 2.75Å; E207-S210 PolarHBondContact O-N 2.86Å; H208-S210 VanDerWaalsContact C-N 3.26Å; H208-S210 PolarHBondContact O-N 2.79Å; S210-V212 PolarHBondContact O-N 2.74Å; S210-V213 PolarHBondContact O-N 2.86Å; S210-Q214 WeakPolarHBondContact O-CB 3.27Å; S210-Q214 PolarHBondContact O-N 2.8Å
211	R	97.8	Very high	95.6	Very high	96 Å²	96	52.8 Å²	52.8	36%	0.362	30%	0.302	S	S	.	.	H	α-helix	trans	-60.5	-42.8	173.8	-176.2	-176	67.8	-130.4	1.2	112.1	E207 H208 Q214 E215 E224	E207-R211 WeakPolarHBondContact O-CB 3.35Å; E207-R211 PolarHBondContact O-N 2.59Å; H208-R211 PolarHBondContact CD2-NH2 3.37Å; H208-R211 PolarHBondContact NE2-NH2 3.18Å; H208-R211 PolarHBondContact O-N 3.44Å; R211-Q214 WeakPolarHBondContact O-CB 3.42Å; R211-Q214 PolarHBondContact O-N 3.42Å; R211-E215 PolarHBondContact O-N 2.89Å; R211-E224 IonicContact NH2-OE2 3.69Å; R211-E224 PolarHBondContact NH2-OE2 2.92Å
212	V	98.2	Very high	96.1	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.4	-45.8	177.4	172.7	0	0	0	0	110.7	A159 L160 L163 H208 S209 S210 L216 C222 V225	A159-V212 HydrophobicContact CB-CG1 4.42Å; L160-V212 HydrophobicContact CD2-CB 4.16Å; L160-V212 HydrophobicContact CD2-CG1 3.97Å; L163-V212 HydrophobicContact CD1-CG1 4.26Å; L163-V212 HydrophobicContact CD1-CG2 3.69Å; H208-V212 WeakPolarHBondContact O-CG2 3.32Å; H208-V212 PolarHBondContact O-N 2.91Å; H208-V212 VanDerWaalsContact O-N 3.09Å; S209-V212 PolarHBondContact O-N 3.43Å; S210-V212 PolarHBondContact O-N 2.74Å; V212-L216 HydrophobicContact CG1-CD1 4.07Å; V212-L216 WeakPolarHBondContact O-CD1 3.24Å; V212-L216 WeakPolarHBondContact O-CG 3.34Å; V212-L216 PolarHBondContact O-N 3.47Å; V212-C222 HydrophobicContact CG1-CB 4.32Å; V212-V225 HydrophobicContact CG1-CG2 4.26Å
213	V	97.9	Very high	96.3	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.9	-43.2	176.3	173.6	0	0	0	0	110.9	L156 L186 V193 L199 S209 S210 E215 L216 L217	L156-V213 HydrophobicContact CD1-CG1 3.92Å; L156-V213 HydrophobicContact CD2-CG1 4.12Å; L186-V213 HydrophobicContact CD1-CG2 4.16Å; V193-V213 HydrophobicContact CG1-CG1 4.45Å; L199-V213 HydrophobicContact CD1-CB 3.84Å; L199-V213 HydrophobicContact CD1-CG1 3.71Å; L199-V213 HydrophobicContact CD1-CG2 4.21Å; S209-V213 WeakPolarHBondContact O-CG2 3.13Å; S209-V213 PolarHBondContact O-N 2.91Å; S210-V213 PolarHBondContact O-N 2.86Å; V213-E215 PolarHBondContact O-N 3.19Å; V213-L216 PolarHBondContact O-N 3.04Å; V213-L217 HydrophobicContact CG1-CD1 3.85Å; V213-L217 HydrophobicContact CG1-CG 4.14Å; V213-L217 VanDerWaalsContact O-CG 3.29Å; V213-L217 WeakPolarHBondContact O-CG 3.49Å; V213-L217 PolarHBondContact O-N 2.84Å
214	Q	97	Very high	96.4	Very high	69 Å²	69	56.7 Å²	56.7	32%	0.322	30%	0.298	S	S	.	.	H	α-helix	trans	-57.2	-50.8	177.7	-175	176.7	8.2	0	0	112	L196 S210 R211 L216 L217 E218	L196-Q214 HydrophobicContact CD1-CB 4.05Å; L196-Q214 HydrophobicContact CD2-CB 4.37Å; L196-Q214 HydrophobicContact CD2-CG 4.31Å; S210-Q214 WeakPolarHBondContact O-CB 3.27Å; S210-Q214 PolarHBondContact O-N 2.8Å; R211-Q214 WeakPolarHBondContact O-CB 3.42Å; R211-Q214 PolarHBondContact O-N 3.42Å; Q214-L216 VanDerWaalsContact C-N 3.28Å; Q214-L216 PolarHBondContact O-N 2.96Å; Q214-L217 PolarHBondContact O-N 2.87Å; Q214-L217 VanDerWaalsContact O-N 3.14Å; Q214-E218 HydrophobicContact CG-CG 4.35Å; Q214-E218 WeakPolarHBondContact CG-OE1 3.19Å; Q214-E218 PolarHBondContact NE2-OE1 3.46Å; Q214-E218 WeakPolarHBondContact O-CB 3.45Å; Q214-E218 WeakPolarHBondContact O-CG 3.36Å; Q214-E218 PolarHBondContact O-N 3.49Å
215	E	97.6	Very high	96.6	Very high	41 Å²	41	54.5 Å²	54.5	19%	0.192	29%	0.288	C	S	.	.	H	α-helix	trans	-58.5	-40.8	177.9	-75.1	-177.5	-152.6	0	0	111.7	R211 V213 E218 L219 C222 K223	R211-E215 PolarHBondContact O-N 2.89Å; V213-E215 PolarHBondContact O-N 3.19Å; E215-E218 PolarHBondContact O-N 3Å; E215-L219 WeakPolarHBondContact O-CA 3.48Å; E215-L219 VanDerWaalsContact O-CB 3.29Å; E215-L219 WeakPolarHBondContact O-CB 3.45Å; E215-L219 PolarHBondContact O-N 3.37Å; E215-C222 HydrophobicContact CB-CB 4.2Å; E215-C222 WeakPolarHBondContact OE2-CA 3.46Å; E215-C222 PolarHBondContact OE2-SG 2.85Å; E215-K223 PolarHBondContact OE2-N 3.36Å
216	L	97.7	Very high	96.7	Very high	26 Å²	26	56.8 Å²	56.8	14%	0.136	30%	0.298	C	S	.	.	H	α-helix	trans	-66.2	-37.7	177.5	-70.3	164.3	0	0	0	112.7	L156 A159 V212 V213 Q214 G220 C222	L156-L216 HydrophobicContact CD2-CB 3.61Å; L156-L216 HydrophobicContact CD2-CD1 3.73Å; L156-L216 HydrophobicContact CD2-CG 4.31Å; A159-L216 HydrophobicContact CB-CD1 3.43Å; A159-L216 VanDerWaalsContact CB-CD1 3.43Å; A159-L216 HydrophobicContact CB-CD2 4.5Å; V212-L216 HydrophobicContact CG1-CD1 4.07Å; V212-L216 WeakPolarHBondContact O-CD1 3.24Å; V212-L216 WeakPolarHBondContact O-CG 3.34Å; V212-L216 PolarHBondContact O-N 3.47Å; V213-L216 PolarHBondContact O-N 3.04Å; Q214-L216 VanDerWaalsContact C-N 3.28Å; Q214-L216 PolarHBondContact O-N 2.96Å; L216-G220 WeakPolarHBondContact O-CA 3.47Å; L216-G220 PolarHBondContact O-N 3Å; L216-C222 HydrophobicContact CD2-CB 4.12Å; L216-C222 HydrophobicContact CG-CB 4.04Å
217	L	95.6	Very high	97.1	Very high	60 Å²	60	63 Å²	63	31%	0.314	31%	0.309	S	S	.	.	H	α-helix	trans	-70.3	-40.1	177.3	-67.4	175.2	0	0	0	111.9	V193 V213 Q214	V193-L217 HydrophobicContact CG1-CD1 4.13Å; V193-L217 VanDerWaalsContact O-CD2 3.3Å; V193-L217 WeakPolarHBondContact O-CD2 3.4Å; V213-L217 HydrophobicContact CG1-CD1 3.85Å; V213-L217 HydrophobicContact CG1-CG 4.14Å; V213-L217 VanDerWaalsContact O-CG 3.29Å; V213-L217 WeakPolarHBondContact O-CG 3.49Å; V213-L217 PolarHBondContact O-N 2.84Å; Q214-L217 PolarHBondContact O-N 2.87Å; Q214-L217 VanDerWaalsContact O-N 3.14Å
218	E	95.9	Very high	97.3	Very high	128 Å²	128	55.9 Å²	55.9	60%	0.598	28%	0.277	S	S	*	.	H	α-helix	trans	-82.2	-39.6	-175.8	-70.2	174.9	-174.2	0	0	113	Q214 E215	Q214-E218 HydrophobicContact CG-CG 4.35Å; Q214-E218 WeakPolarHBondContact CG-OE1 3.19Å; Q214-E218 PolarHBondContact NE2-OE1 3.46Å; Q214-E218 WeakPolarHBondContact O-CB 3.45Å; Q214-E218 WeakPolarHBondContact O-CG 3.36Å; Q214-E218 PolarHBondContact O-N 3.49Å; E215-E218 PolarHBondContact O-N 3Å
219	L	95.1	Very high	97.3	Very high	101 Å²	101	58.1 Å²	58.1	53%	0.529	28%	0.283	S	S	.	.	H	α-helix	trans	-115.1	-10.5	-169.3	-52.4	177.7	0	0	0	113.3	E215 V221	E215-L219 WeakPolarHBondContact O-CA 3.48Å; E215-L219 VanDerWaalsContact O-CB 3.29Å; E215-L219 WeakPolarHBondContact O-CB 3.45Å; E215-L219 PolarHBondContact O-N 3.37Å; L219-V221 HydrophobicContact CB-CG2 4.33Å; L219-V221 PolarHBondContact O-N 2.86Å; L219-V221 VanDerWaalsContact O-N 3.17Å
220	G	94.4	Very high	97.3	Very high	56 Å²	56	62.4 Å²	62.4	58%	0.577	31%	0.312	S	S	*	.	S	Bend	trans	73.6	-7.5	-172.2	0	0	0	0	0	114.4	L216	L216-G220 WeakPolarHBondContact O-CA 3.47Å; L216-G220 PolarHBondContact O-N 3Å
221	V	95.4	Very high	97.4	Very high	75 Å²	75	63.1 Å²	63.1	46%	0.455	32%	0.317	S	S	.	.	S	Bend	trans	-142.3	147.6	-178.8	-68.2	0	0	0	0	110.4	L219	L219-V221 HydrophobicContact CB-CG2 4.33Å; L219-V221 PolarHBondContact O-N 2.86Å; L219-V221 VanDerWaalsContact O-N 3.17Å
222	C	98.2	Very high	97.4	Very high	1 Å²	1	63.7 Å²	63.7	1%	0.007	32%	0.324	C	S	.	.			trans	-108.7	124.3	170.4	174.6	0	0	0	0	109.7	V212 E215 L216 E224 V225 E226	V212-C222 HydrophobicContact CG1-CB 4.32Å; E215-C222 HydrophobicContact CB-CB 4.2Å; E215-C222 WeakPolarHBondContact OE2-CA 3.46Å; E215-C222 PolarHBondContact OE2-SG 2.85Å; L216-C222 HydrophobicContact CD2-CB 4.12Å; L216-C222 HydrophobicContact CG-CB 4.04Å; C222-E224 VanDerWaalsContact C-N 3.26Å; C222-E224 PolarHBondContact O-N 3.28Å; C222-V225 HydrophobicContact CB-CB 4.1Å; C222-V225 HydrophobicContact CB-CG2 3.79Å; C222-V225 PolarHBondContact O-N 3.25Å; C222-V225 VanDerWaalsContact O-N 3.13Å; C222-E226 PolarHBondContact O-N 2.54Å
223	K	97.8	Very high	97.4	Very high	155 Å²	155	65.4 Å²	65.4	67%	0.674	33%	0.331	S	S	*	.	H	α-helix	trans	-61.7	-36.3	-175	-69	178	-178.7	173.4	0	112.2	E215 R227	E215-K223 PolarHBondContact OE2-N 3.36Å; K223-R227 WeakPolarHBondContact O-CB 3.21Å; K223-R227 PolarHBondContact O-N 3.3Å
224	E	98.3	Very high	97.5	Very high	27 Å²	27	66.1 Å²	66.1	13%	0.126	33%	0.333	C	S	.	.	H	α-helix	trans	-63.9	-44	177.1	-177.9	177	176.2	0	0	111.7	L163 H208 R211 C222 R227 V228	L163-E224 HydrophobicContact CD2-CG 3.99Å; H208-E224 IonicContact CD2-OE2 3.13Å; H208-E224 IonicContact CE1-OE1 3.17Å; H208-E224 PolarHBondContact CE1-OE1 2.77Å; H208-E224 VanDerWaalsContact CE1-OE1 3.29Å; H208-E224 IonicContact CE1-OE2 3.5Å; H208-E224 VanDerWaalsContact NE2-CD 3.26Å; H208-E224 IonicContact NE2-OE1 3.54Å; H208-E224 PolarHBondContact NE2-OE1 3.32Å; H208-E224 IonicContact NE2-OE2 3.13Å; H208-E224 PolarHBondContact NE2-OE2 3.48Å; R211-E224 IonicContact NH2-OE2 3.69Å; R211-E224 PolarHBondContact NH2-OE2 2.92Å; C222-E224 VanDerWaalsContact C-N 3.26Å; C222-E224 PolarHBondContact O-N 3.28Å; E224-R227 PolarHBondContact O-N 3.22Å; E224-V228 WeakPolarHBondContact O-CG2 3.17Å; E224-V228 PolarHBondContact O-N 2.99Å
225	V	98.5	Very high	97.5	Very high	2 Å²	2	67.8 Å²	67.8	1%	0.012	34%	0.341	C	S	.	.	H	α-helix	trans	-65.4	-45.4	-179.8	176.3	0	0	0	0	110.5	A159 T162 L163 V212 C222 V228 R229	A159-V225 HydrophobicContact CB-CG1 4.42Å; A159-V225 HydrophobicContact CB-CG2 4.05Å; T162-V225 HydrophobicContact CG2-CG1 4.05Å; L163-V225 HydrophobicContact CD1-CG2 4.1Å; L163-V225 HydrophobicContact CD2-CG2 4.02Å; L163-V225 HydrophobicContact CG-CG2 3.98Å; V212-V225 HydrophobicContact CG1-CG2 4.26Å; C222-V225 HydrophobicContact CB-CB 4.1Å; C222-V225 HydrophobicContact CB-CG2 3.79Å; C222-V225 PolarHBondContact O-N 3.25Å; C222-V225 VanDerWaalsContact O-N 3.13Å; V225-V228 WeakPolarHBondContact O-CB 3.45Å; V225-V228 PolarHBondContact O-N 2.8Å; V225-R229 WeakPolarHBondContact O-CG 3.49Å; V225-R229 PolarHBondContact O-N 2.82Å
226	E	98.4	Very high	97.6	Very high	69 Å²	69	66.3 Å²	66.3	32%	0.322	34%	0.335	S	S	.	.	H	α-helix	trans	-64.6	-41.1	177.6	-66.9	-52.3	119.5	0	0	111.8	C222 V228 R229 C230	C222-E226 PolarHBondContact O-N 2.54Å; E226-V228 VanDerWaalsContact C-N 3.29Å; E226-V228 PolarHBondContact O-N 3.47Å; E226-R229 PolarHBondContact O-N 2.61Å; E226-R229 WeakPolarHBondContact OE1-CD 3.24Å; E226-R229 IonicContact OE1-CZ 3.65Å; E226-R229 IonicContact OE1-NE 3.93Å; E226-R229 IonicContact OE1-NH1 3.67Å; E226-R229 PolarHBondContact OE1-NH1 2.87Å; E226-C230 WeakPolarHBondContact O-CB 3.2Å; E226-C230 PolarHBondContact O-N 3.02Å; E226-C230 PolarHBondContact O-SG 3.11Å; E226-C230 VanDerWaalsContact O-SG 3.41Å
227	R	98.5	Very high	97.6	Very high	171 Å²	171	65 Å²	65	65%	0.645	33%	0.328	S	S	*	.	H	α-helix	trans	-59.1	-41	173.6	-175.4	-175.4	64.6	-155	-3.4	111.9	K223 E224 S231	K223-R227 WeakPolarHBondContact O-CB 3.21Å; K223-R227 PolarHBondContact O-N 3.3Å; E224-R227 PolarHBondContact O-N 3.22Å; R227-S231 WeakPolarHBondContact O-CB 3.33Å; R227-S231 PolarHBondContact O-N 2.91Å; R227-S231 VanDerWaalsContact O-N 3.12Å
228	V	98.4	Very high	97.8	Very high	20 Å²	20	65.2 Å²	65.2	12%	0.121	33%	0.326	C	S	.	.	H	α-helix	trans	-63.5	-50.3	175.5	165.4	0	0	0	0	110.5	T162 L163 A166 E224 V225 E226 C230 S231 Y234	T162-V228 HydrophobicContact CG2-CG1 4.01Å; L163-V228 HydrophobicContact CD2-CG2 4.03Å; A166-V228 HydrophobicContact CB-CG1 3.51Å; A166-V228 HydrophobicContact CB-CG2 4.41Å; E224-V228 WeakPolarHBondContact O-CG2 3.17Å; E224-V228 PolarHBondContact O-N 2.99Å; V225-V228 WeakPolarHBondContact O-CB 3.45Å; V225-V228 PolarHBondContact O-N 2.8Å; E226-V228 VanDerWaalsContact C-N 3.29Å; E226-V228 PolarHBondContact O-N 3.47Å; V228-C230 VanDerWaalsContact C-N 3.26Å; V228-C230 PolarHBondContact O-N 3.4Å; V228-S231 WeakPolarHBondContact O-CB 3.44Å; V228-S231 PolarHBondContact O-N 3.44Å; V228-S231 PolarHBondContact O-OG 2.96Å; V228-Y234 HydrophobicContact CG1-CD1 4.27Å; V228-Y234 HydrophobicContact CG1-CD2 3.66Å; V228-Y234 HydrophobicContact CG1-CE2 4Å; V228-Y234 HydrophobicContact CG1-CG 3.8Å; V228-Y234 WeakPolarHBondContact O-CB 3.45Å; V228-Y234 WeakPolarHBondContact O-CD1 3.19Å
229	R	98.1	Very high	97.9	Very high	96 Å²	96	61.5 Å²	61.5	36%	0.362	31%	0.31	S	S	.	.	H	α-helix	trans	-57.1	-38.7	179.8	-73.6	172.6	172.4	178.4	-7.7	112.8	T162 V225 E226 Q235	T162-R229 HydrophobicContact CG2-CG 4.01Å; V225-R229 WeakPolarHBondContact O-CG 3.49Å; V225-R229 PolarHBondContact O-N 2.82Å; E226-R229 PolarHBondContact O-N 2.61Å; E226-R229 WeakPolarHBondContact OE1-CD 3.24Å; E226-R229 IonicContact OE1-CZ 3.65Å; E226-R229 IonicContact OE1-NE 3.93Å; E226-R229 IonicContact OE1-NH1 3.67Å; E226-R229 PolarHBondContact OE1-NH1 2.87Å; R229-Q235 WeakPolarHBondContact O-CG 3.39Å; R229-Q235 PolarHBondContact O-NE2 2.73Å
230	C	98.1	Very high	98	Very high	92 Å²	92	56.7 Å²	56.7	62%	0.622	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-7.1	179.9	-65.9	0	0	0	0	114	E226 V228	E226-C230 WeakPolarHBondContact O-CB 3.2Å; E226-C230 PolarHBondContact O-N 3.02Å; E226-C230 PolarHBondContact O-SG 3.11Å; E226-C230 VanDerWaalsContact O-SG 3.41Å; V228-C230 VanDerWaalsContact C-N 3.26Å; V228-C230 PolarHBondContact O-N 3.4Å
231	S	98.4	Very high	98.2	Very high	41 Å²	41	55.8 Å²	55.8	29%	0.287	27%	0.268	S	S	.	.			trans	-74.4	131.7	-179.5	72	0	0	0	0	111.3	R227 V228 R233 Y234 Q235	R227-S231 WeakPolarHBondContact O-CB 3.33Å; R227-S231 PolarHBondContact O-N 2.91Å; R227-S231 VanDerWaalsContact O-N 3.12Å; V228-S231 WeakPolarHBondContact O-CB 3.44Å; V228-S231 PolarHBondContact O-N 3.44Å; V228-S231 PolarHBondContact O-OG 2.96Å; S231-R233 PolarHBondContact O-N 3.06Å; S231-Y234 PolarHBondContact O-N 2.96Å; S231-Y234 VanDerWaalsContact O-N 3.17Å; S231-Y234 WeakPolarHBondContact OG-CB 3.42Å; S231-Y234 PolarHBondContact OG-N 3.5Å; S231-Q235 WeakPolarHBondContact O-CG 3.31Å; S231-Q235 PolarHBondContact O-N 2.9Å
232	E	98.5	Very high	98.2	Very high	107 Å²	107	57.2 Å²	57.2	50%	0.5	27%	0.27	S	S	.	.	H	α-helix	trans	-51.9	-45	174.8	-177.9	-170	-158.9	0	0	110.9	Y234 Q235 T236 Y255 R260	E232-Y234 PolarHBondContact O-N 3.48Å; E232-Q235 PolarHBondContact O-N 3.22Å; E232-T236 WeakPolarHBondContact O-CB 3.44Å; E232-T236 PolarHBondContact O-N 2.77Å; E232-T236 PolarHBondContact O-OG1 3.36Å; E232-T236 VanDerWaalsContact O-OG1 3.13Å; E232-Y255 HydrophobicContact CG-CE2 4.41Å; E232-R260 VanDerWaalsContact CD-NE 3.28Å; E232-R260 VanDerWaalsContact OE1-CD 3.24Å; E232-R260 WeakPolarHBondContact OE1-CD 3.34Å; E232-R260 IonicContact OE1-CZ 2.74Å; E232-R260 IonicContact OE1-NE 3.83Å; E232-R260 PolarHBondContact OE1-NE 3.14Å; E232-R260 IonicContact OE1-NH2 3.79Å; E232-R260 IonicContact OE2-NE 2.71Å
233	R	98.1	Very high	98.2	Very high	37 Å²	37	57.3 Å²	57.3	14%	0.14	27%	0.27	C	S	.	.	H	α-helix	trans	-52.8	-54.4	177.2	175.7	58.8	178.9	-179.6	-1.3	112.3	F169 E170 S231 M237 D252 Y255	F169-R233 PolarHBondContact O-NH2 3.39Å; E170-R233 WeakPolarHBondContact OE1-CG 3.26Å; E170-R233 IonicContact OE1-CZ 3.75Å; E170-R233 IonicContact OE1-NE 3.64Å; E170-R233 PolarHBondContact OE1-NE 2.96Å; E170-R233 IonicContact OE1-NH2 3.79Å; S231-R233 PolarHBondContact O-N 3.06Å; R233-M237 HydrophobicContact CG-CG 4.5Å; R233-M237 VanDerWaalsContact CZ-SD 3.5Å; R233-M237 PolarHBondContact NH1-SD 2.99Å; R233-M237 VanDerWaalsContact O-CB 3.25Å; R233-M237 WeakPolarHBondContact O-CB 3.38Å; R233-M237 WeakPolarHBondContact O-CG 3.27Å; R233-M237 PolarHBondContact O-N 2.97Å; R233-D252 IonicContact CZ-OD1 3.91Å; R233-D252 IonicContact NH1-OD1 3.67Å; R233-D252 PolarHBondContact NH1-OD1 3.46Å; R233-D252 IonicContact NH2-OD1 3.84Å; R233-D252 PolarHBondContact NH2-OD1 3.45Å; R233-Y255 HydrophobicContact CB-CE2 4.3Å; R233-Y255 VanDerWaalsContact NH1-CB 3.28Å
234	Y	98.6	Very high	98.1	Very high	15 Å²	15	51.4 Å²	51.4	6%	0.059	25%	0.245	C	C	.	.	H	α-helix	trans	-64.5	-44	-178.5	175.5	-100.4	0	0	0	111.5	E165 A166 F169 V228 S231 E232 M237 K238	E165-Y234 HydrophobicContact CB-CE2 4.31Å; E165-Y234 HydrophobicContact CG-CE2 4.07Å; E165-Y234 PolarHBondContact OE2-OH 2.87Å; A166-Y234 HydrophobicContact CB-CD2 3.82Å; A166-Y234 HydrophobicContact CB-CE2 4.1Å; F169-Y234 AromaticContact CD2-CD2 3.8Å; F169-Y234 HydrophobicContact CD2-CD2 3.8Å; F169-Y234 HydrophobicContact CD2-CE2 4.24Å; F169-Y234 AromaticContact CE2-CD2 3.79Å; F169-Y234 HydrophobicContact CE2-CD2 3.79Å; F169-Y234 AromaticContact CE2-CE2 3.87Å; F169-Y234 HydrophobicContact CE2-CE2 3.87Å; V228-Y234 HydrophobicContact CG1-CD1 4.27Å; V228-Y234 HydrophobicContact CG1-CD2 3.66Å; V228-Y234 HydrophobicContact CG1-CE2 4Å; V228-Y234 HydrophobicContact CG1-CG 3.8Å; V228-Y234 WeakPolarHBondContact O-CB 3.45Å; V228-Y234 WeakPolarHBondContact O-CD1 3.19Å; S231-Y234 PolarHBondContact O-N 2.96Å; S231-Y234 VanDerWaalsContact O-N 3.17Å; S231-Y234 WeakPolarHBondContact OG-CB 3.42Å; S231-Y234 PolarHBondContact OG-N 3.5Å; E232-Y234 PolarHBondContact O-N 3.48Å; Y234-M237 PolarHBondContact O-N 2.97Å; Y234-K238 HydrophobicContact CE1-CD 4.02Å; Y234-K238 WeakPolarHBondContact O-CB 3.25Å; Y234-K238 PolarHBondContact O-N 2.88Å; Y234-K238 PolarHBondContact OH-NZ 3.37Å
235	Q	98.7	Very high	98	Very high	104 Å²	104	51.1 Å²	51.1	49%	0.486	25%	0.25	S	C	.	.	H	α-helix	trans	-62	-47.3	-179.6	-68.3	176.8	0.6	0	0	112	R229 S231 E232 K238 L239	R229-Q235 WeakPolarHBondContact O-CG 3.39Å; R229-Q235 PolarHBondContact O-NE2 2.73Å; S231-Q235 WeakPolarHBondContact O-CG 3.31Å; S231-Q235 PolarHBondContact O-N 2.9Å; E232-Q235 PolarHBondContact O-N 3.22Å; Q235-K238 PolarHBondContact O-N 2.86Å; Q235-L239 WeakPolarHBondContact O-CB 3.17Å; Q235-L239 PolarHBondContact O-N 3.05Å
236	T	98.7	Very high	98	Very high	9 Å²	9	51.6 Å²	51.6	6%	0.055	25%	0.252	C	S	.	.	H	α-helix	trans	-66.8	-43	177.8	-58.4	0	0	0	0	111.9	E232 K238 L239 F240 Y255 R260	E232-T236 WeakPolarHBondContact O-CB 3.44Å; E232-T236 PolarHBondContact O-N 2.77Å; E232-T236 PolarHBondContact O-OG1 3.36Å; E232-T236 VanDerWaalsContact O-OG1 3.13Å; T236-K238 VanDerWaalsContact C-N 3.33Å; T236-K238 PolarHBondContact O-N 3.29Å; T236-L239 PolarHBondContact O-N 3.36Å; T236-F240 HydrophobicContact CG2-CD2 3.64Å; T236-F240 HydrophobicContact CG2-CE1 4.28Å; T236-F240 HydrophobicContact CG2-CE2 3.28Å; T236-F240 HydrophobicContact CG2-CG 4.29Å; T236-F240 HydrophobicContact CG2-CZ 3.65Å; T236-F240 WeakPolarHBondContact O-CB 3.43Å; T236-F240 WeakPolarHBondContact O-CG 3.24Å; T236-F240 PolarHBondContact O-N 2.74Å; T236-Y255 HydrophobicContact CG2-CD2 3.66Å; T236-Y255 HydrophobicContact CG2-CE2 4.32Å; T236-R260 VanDerWaalsContact OG1-CD 3.3Å; T236-R260 WeakPolarHBondContact OG1-CD 3.32Å
237	M	98.6	Very high	97.9	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.3	-42.1	177.7	-72.7	-62.8	-70	0	0	111.7	F169 R233 Y234 F240 T241 V248 A251 D252	F169-M237 HydrophobicContact CB-CB 4.03Å; F169-M237 HydrophobicContact CB-CE 3.98Å; F169-M237 HydrophobicContact CB-CG 4.15Å; F169-M237 HydrophobicContact CD1-CB 4.05Å; F169-M237 HydrophobicContact CD1-CE 4.17Å; F169-M237 HydrophobicContact CD2-CB 3.5Å; F169-M237 VanDerWaalsContact CD2-CB 3.5Å; F169-M237 HydrophobicContact CD2-CG 4.44Å; F169-M237 HydrophobicContact CE1-CB 4.39Å; F169-M237 HydrophobicContact CE2-CB 3.87Å; F169-M237 HydrophobicContact CG-CB 3.6Å; F169-M237 HydrophobicContact CG-CE 4.25Å; F169-M237 HydrophobicContact CG-CG 4.28Å; F169-M237 HydrophobicContact CZ-CB 4.31Å; R233-M237 HydrophobicContact CG-CG 4.5Å; R233-M237 VanDerWaalsContact CZ-SD 3.5Å; R233-M237 PolarHBondContact NH1-SD 2.99Å; R233-M237 VanDerWaalsContact O-CB 3.25Å; R233-M237 WeakPolarHBondContact O-CB 3.38Å; R233-M237 WeakPolarHBondContact O-CG 3.27Å; R233-M237 PolarHBondContact O-N 2.97Å; Y234-M237 PolarHBondContact O-N 2.97Å; M237-F240 PolarHBondContact O-N 3.12Å; M237-T241 WeakPolarHBondContact O-CB 3.45Å; M237-T241 VanDerWaalsContact O-CG2 3.31Å; M237-T241 WeakPolarHBondContact O-CG2 3.36Å; M237-T241 PolarHBondContact O-N 2.87Å; M237-T241 PolarHBondContact O-OG1 2.67Å; M237-V248 HydrophobicContact CE-CG1 4.13Å; M237-A251 HydrophobicContact CE-CB 3.89Å; M237-A251 VanDerWaalsContact SD-C 3.59Å; M237-A251 HydrophobicContact SD-CB 3.87Å; M237-D252 HydrophobicContact CE-CB 3.71Å; M237-D252 VanDerWaalsContact SD-CA 3.59Å; M237-D252 HydrophobicContact SD-CB 4.14Å
238	K	98.1	Very high	97.8	Very high	64 Å²	64	45 Å²	45	28%	0.278	24%	0.244	S	C	.	.	H	α-helix	trans	-63.2	-46.7	175.3	-171.2	162.6	-171	146.1	0	111.7	E165 F169 Y234 Q235 T236 F240 T241 Q242	E165-K238 IonicContact OE1-NZ 3.67Å; E165-K238 IonicContact OE2-NZ 3.29Å; E165-K238 PolarHBondContact OE2-NZ 3.24Å; F169-K238 HydrophobicContact CE2-CB 3.99Å; F169-K238 HydrophobicContact CZ-CB 4.13Å; Y234-K238 HydrophobicContact CE1-CD 4.02Å; Y234-K238 WeakPolarHBondContact O-CB 3.25Å; Y234-K238 PolarHBondContact O-N 2.88Å; Y234-K238 PolarHBondContact OH-NZ 3.37Å; Q235-K238 PolarHBondContact O-N 2.86Å; T236-K238 VanDerWaalsContact C-N 3.33Å; T236-K238 PolarHBondContact O-N 3.29Å; K238-F240 PolarHBondContact O-N 3.21Å; K238-T241 PolarHBondContact O-N 3.13Å; K238-T241 PolarHBondContact O-OG1 2.9Å; K238-Q242 VanDerWaalsContact O-CG 3.25Å; K238-Q242 WeakPolarHBondContact O-CG 3.47Å; K238-Q242 PolarHBondContact O-N 2.89Å
239	L	98.2	Very high	97.7	Very high	50 Å²	50	54.7 Å²	54.7	26%	0.262	28%	0.278	S	S	.	.	H	α-helix	trans	-56.9	-49.9	175.6	177.2	65.1	0	0	0	111.7	Q235 T236 Q242 L262	Q235-L239 WeakPolarHBondContact O-CB 3.17Å; Q235-L239 PolarHBondContact O-N 3.05Å; T236-L239 PolarHBondContact O-N 3.36Å; L239-Q242 PolarHBondContact O-N 2.95Å; L239-L262 HydrophobicContact CD1-CD1 4.28Å; L239-L262 HydrophobicContact CD1-CD2 3.95Å; L239-L262 HydrophobicContact CD1-CG 4.02Å; L239-L262 HydrophobicContact CD2-CD2 4.31Å; L239-L262 HydrophobicContact CD2-CG 4.32Å; L239-L262 HydrophobicContact CG-CD2 3.94Å; L239-L262 HydrophobicContact CG-CG 4.3Å
240	F	98.4	Very high	97.7	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-69.2	-40.7	-177.1	-70.1	-16.7	0	0	0	112.9	T236 M237 K238 Q242 I243 V246 A251 W254 L259 T261 L265	T236-F240 HydrophobicContact CG2-CD2 3.64Å; T236-F240 HydrophobicContact CG2-CE1 4.28Å; T236-F240 HydrophobicContact CG2-CE2 3.28Å; T236-F240 HydrophobicContact CG2-CG 4.29Å; T236-F240 HydrophobicContact CG2-CZ 3.65Å; T236-F240 WeakPolarHBondContact O-CB 3.43Å; T236-F240 WeakPolarHBondContact O-CG 3.24Å; T236-F240 PolarHBondContact O-N 2.74Å; M237-F240 PolarHBondContact O-N 3.12Å; K238-F240 PolarHBondContact O-N 3.21Å; F240-Q242 PolarHBondContact O-N 3.49Å; F240-I243 HydrophobicContact CD1-CD1 4.31Å; F240-I243 WeakPolarHBondContact O-CB 3.36Å; F240-I243 WeakPolarHBondContact O-CG1 3.3Å; F240-I243 PolarHBondContact O-N 3.28Å; F240-I243 VanDerWaalsContact O-N 3.12Å; F240-V246 HydrophobicContact CB-CG1 4.38Å; F240-V246 VanDerWaalsContact O-CB 3.27Å; F240-V246 WeakPolarHBondContact O-CB 3.39Å; F240-V246 VanDerWaalsContact O-CG1 3.23Å; F240-V246 WeakPolarHBondContact O-CG1 3.39Å; F240-A251 HydrophobicContact CB-CB 3.58Å; F240-A251 HydrophobicContact CD2-CB 4.33Å; F240-A251 HydrophobicContact CG-CB 4.49Å; F240-W254 HydrophobicContact CB-CE3 4.28Å; F240-W254 HydrophobicContact CD1-CE3 4.48Å; F240-W254 HydrophobicContact CD2-CB 4.04Å; F240-W254 HydrophobicContact CD2-CE3 4.06Å; F240-W254 HydrophobicContact CE2-CB 3.76Å; F240-W254 HydrophobicContact CE2-CE3 4.5Å; F240-W254 HydrophobicContact CG-CE3 4.04Å; F240-L259 HydrophobicContact CE2-CB 4.23Å; F240-L259 WeakPolarHBondContact CE2-O 3.29Å; F240-L259 HydrophobicContact CZ-CB 3.91Å; F240-T261 WeakPolarHBondContact CE1-O 3.42Å; F240-L265 HydrophobicContact CD1-CD1 3.8Å; F240-L265 HydrophobicContact CE1-CD1 3.72Å; F240-L265 HydrophobicContact CE1-CD2 4.42Å; F240-L265 HydrophobicContact CE1-CG 4.08Å; F240-L265 HydrophobicContact CZ-CD2 4.44Å
241	T	97.8	Very high	97.7	Very high	36 Å²	36	47 Å²	47	22%	0.221	24%	0.239	C	C	.	.	H	α-helix	trans	-74	-11.9	-179.1	54.4	0	0	0	0	113.9	F169 M237 K238 I243 V248 A251	F169-T241 HydrophobicContact CE1-CG2 4Å; F169-T241 WeakPolarHBondContact CE1-OG1 3.41Å; M237-T241 WeakPolarHBondContact O-CB 3.45Å; M237-T241 VanDerWaalsContact O-CG2 3.31Å; M237-T241 WeakPolarHBondContact O-CG2 3.36Å; M237-T241 PolarHBondContact O-N 2.87Å; M237-T241 PolarHBondContact O-OG1 2.67Å; K238-T241 PolarHBondContact O-N 3.13Å; K238-T241 PolarHBondContact O-OG1 2.9Å; T241-I243 VanDerWaalsContact C-N 3.28Å; T241-V248 HydrophobicContact CG2-CG2 4.47Å; T241-A251 HydrophobicContact CG2-CB 3.65Å
242	Q	96.4	Very high	97.7	Very high	106 Å²	106	46.3 Å²	46.3	50%	0.495	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-14.9	168.8	-76.2	174.1	-6.8	0	0	113.2	K238 L239 F240 F244	K238-Q242 VanDerWaalsContact O-CG 3.25Å; K238-Q242 WeakPolarHBondContact O-CG 3.47Å; K238-Q242 PolarHBondContact O-N 2.89Å; L239-Q242 PolarHBondContact O-N 2.95Å; F240-Q242 PolarHBondContact O-N 3.49Å; Q242-F244 PolarHBondContact O-N 2.94Å
243	I	97.6	Very high	97.7	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.01	23%	0.23	C	C	.	.	S	Bend	trans	-74.8	124.6	175.7	-55	162.8	0	0	0	109.1	F240 T241 G245 V246 W254 L262 L265 L280	F240-I243 HydrophobicContact CD1-CD1 4.31Å; F240-I243 WeakPolarHBondContact O-CB 3.36Å; F240-I243 WeakPolarHBondContact O-CG1 3.3Å; F240-I243 PolarHBondContact O-N 3.28Å; F240-I243 VanDerWaalsContact O-N 3.12Å; T241-I243 VanDerWaalsContact C-N 3.28Å; I243-G245 PolarHBondContact O-N 3.31Å; I243-V246 HydrophobicContact CB-CB 4.1Å; I243-V246 HydrophobicContact CB-CG2 3.67Å; I243-V246 HydrophobicContact CD1-CG2 4.35Å; I243-V246 HydrophobicContact CG2-CG2 3.73Å; I243-V246 WeakPolarHBondContact O-CB 3.42Å; I243-V246 PolarHBondContact O-N 2.95Å; I243-W254 HydrophobicContact CD1-CZ3 4.26Å; I243-L262 HydrophobicContact CD1-CD2 3.62Å; I243-L262 HydrophobicContact CG1-CD2 3.98Å; I243-L265 HydrophobicContact CD1-CD1 3.46Å; I243-L265 VanDerWaalsContact CD1-CD1 3.46Å; I243-L280 HydrophobicContact CD1-CD2 3.8Å; I243-L280 HydrophobicContact CD1-CG 4.35Å; I243-L280 HydrophobicContact CG1-CD2 4.26Å; I243-L280 HydrophobicContact CG2-CD2 4.33Å; I243-L280 HydrophobicContact CG2-CG 3.93Å
244	F	96.8	Very high	97.7	Very high	31 Å²	31	45.2 Å²	45.2	14%	0.136	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	127.2	173.6	174.3	-120.6	0	0	0	111.6	Q242 Q275 L286 Y362 F389 I391 R416	Q242-F244 PolarHBondContact O-N 2.94Å; F244-Q275 HydrophobicContact CD1-CG 3.87Å; F244-Q275 HydrophobicContact CE1-CG 3.5Å; F244-Q275 VanDerWaalsContact CE1-CG 3.5Å; F244-Q275 HydrophobicContact CE2-CG 4.3Å; F244-Q275 HydrophobicContact CG-CG 4.47Å; F244-Q275 HydrophobicContact CZ-CG 3.74Å; F244-Q275 VanDerWaalsContact CZ-NE2 3.34Å; F244-L286 HydrophobicContact CB-CD1 4.08Å; F244-Y362 AromaticContact CE1-CD1 3.67Å; F244-Y362 HydrophobicContact CE1-CD1 3.67Å; F244-Y362 AromaticContact CE1-CE1 3.45Å; F244-Y362 HydrophobicContact CE1-CE1 3.45Å; F244-Y362 VanDerWaalsContact CE1-CE1 3.45Å; F244-Y362 HydrophobicContact CZ-CD1 4.31Å; F244-Y362 AromaticContact CZ-CE1 3.83Å; F244-Y362 HydrophobicContact CZ-CE1 3.83Å; F244-F389 HydrophobicContact CZ-CB 4.18Å; F244-I391 HydrophobicContact CD1-CD1 3.95Å; F244-I391 HydrophobicContact CD1-CG1 4.3Å; F244-I391 HydrophobicContact CE1-CD1 4.22Å; F244-I391 HydrophobicContact CE1-CG1 4.24Å; F244-R416 VanDerWaalsContact CD2-NE 3.26Å
245	G	95.3	Very high	97.7	Very high	22 Å²	22	46.5 Å²	46.5	23%	0.227	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.7	6.7	-174.3	0	0	0	0	0	115.4	I243 Q275 Q276	I243-G245 PolarHBondContact O-N 3.31Å; G245-Q275 VanDerWaalsContact CA-OE1 3.23Å; G245-Q276 VanDerWaalsContact O-CG 3.29Å; G245-Q276 WeakPolarHBondContact O-CG 3.39Å; G245-Q276 PolarHBondContact O-NE2 3.27Å
246	V	97.5	Very high	97.7	Very high	12 Å²	12	49.9 Å²	49.9	7%	0.073	24%	0.237	C	C	.	.			trans	-115.5	109.7	177.4	-176.1	0	0	0	0	110.2	F240 I243 T250 A251 W254 Q276	F240-V246 HydrophobicContact CB-CG1 4.38Å; F240-V246 VanDerWaalsContact O-CB 3.27Å; F240-V246 WeakPolarHBondContact O-CB 3.39Å; F240-V246 VanDerWaalsContact O-CG1 3.23Å; F240-V246 WeakPolarHBondContact O-CG1 3.39Å; I243-V246 HydrophobicContact CB-CB 4.1Å; I243-V246 HydrophobicContact CB-CG2 3.67Å; I243-V246 HydrophobicContact CD1-CG2 4.35Å; I243-V246 HydrophobicContact CG2-CG2 3.73Å; I243-V246 WeakPolarHBondContact O-CB 3.42Å; I243-V246 PolarHBondContact O-N 2.95Å; V246-T250 HydrophobicContact CG1-CG2 4.06Å; V246-A251 HydrophobicContact CG1-CB 4.05Å; V246-W254 HydrophobicContact CB-CH2 4.46Å; V246-W254 HydrophobicContact CB-CZ3 4.19Å; V246-W254 HydrophobicContact CG1-CE3 4.1Å; V246-W254 HydrophobicContact CG1-CH2 4.14Å; V246-W254 HydrophobicContact CG1-CZ3 3.55Å; V246-W254 HydrophobicContact CG2-CH2 3.43Å; V246-W254 VanDerWaalsContact CG2-CH2 3.43Å; V246-W254 HydrophobicContact CG2-CZ3 3.49Å; V246-W254 VanDerWaalsContact CG2-CZ3 3.49Å; V246-Q276 HydrophobicContact CG2-CG 3.84Å
247	G	96.5	Very high	97.6	Very high	42 Å²	42	53.7 Å²	53.7	43%	0.433	25%	0.254	S	S	.	.			trans	-92.7	172.5	170.5	0	0	0	0	0	112.4	R249 T250 A251	G247-R249 VanDerWaalsContact C-N 3.27Å; G247-R249 PolarHBondContact O-N 3.41Å; G247-R249 VanDerWaalsContact O-N 3.17Å; G247-T250 PolarHBondContact O-N 2.8Å; G247-A251 PolarHBondContact O-N 3.11Å
248	V	97.1	Very high	97.6	Very high	58 Å²	58	55.9 Å²	55.9	35%	0.352	28%	0.276	S	S	.	.	H	α-helix	trans	-47.2	-47.4	179.2	175.3	0	0	0	0	112.3	F169 M237 T241 T250 A251 D252	F169-V248 HydrophobicContact CD1-CG2 4.3Å; M237-V248 HydrophobicContact CE-CG1 4.13Å; T241-V248 HydrophobicContact CG2-CG2 4.47Å; V248-T250 VanDerWaalsContact C-N 3.34Å; V248-T250 PolarHBondContact O-N 3.26Å; V248-A251 PolarHBondContact O-N 2.79Å; V248-D252 WeakPolarHBondContact O-CB 3.45Å; V248-D252 PolarHBondContact O-N 2.95Å
249	R	97.2	Very high	97.6	Very high	225 Å²	225	53.5 Å²	53.5	85%	0.849	27%	0.266	S	S	*	.	H	α-helix	trans	-60.5	-39.7	-179.1	-69	-170.2	-110.8	-152.5	-3	113.4	G247 R253	G247-R249 VanDerWaalsContact C-N 3.27Å; G247-R249 PolarHBondContact O-N 3.41Å; G247-R249 VanDerWaalsContact O-N 3.17Å; R249-R253 WeakPolarHBondContact O-CB 3.39Å; R249-R253 PolarHBondContact O-N 2.92Å; R249-R253 VanDerWaalsContact O-N 3.09Å
250	T	97.9	Very high	97.6	Very high	27 Å²	27	54.1 Å²	54.1	17%	0.166	27%	0.265	C	S	.	.	H	α-helix	trans	-72.7	-46.7	179.5	-59.8	0	0	0	0	110.8	V246 G247 V248 D252 R253 W254	V246-T250 HydrophobicContact CG1-CG2 4.06Å; G247-T250 PolarHBondContact O-N 2.8Å; V248-T250 VanDerWaalsContact C-N 3.34Å; V248-T250 PolarHBondContact O-N 3.26Å; T250-D252 VanDerWaalsContact C-N 3.3Å; T250-D252 PolarHBondContact O-N 3.1Å; T250-R253 PolarHBondContact O-N 2.9Å; T250-W254 HydrophobicContact CG2-CD2 3.92Å; T250-W254 HydrophobicContact CG2-CE3 4.17Å; T250-W254 HydrophobicContact CG2-CH2 3.82Å; T250-W254 HydrophobicContact CG2-CZ2 3.51Å; T250-W254 HydrophobicContact CG2-CZ3 4.14Å; T250-W254 PolarHBondContact O-N 3.24Å
251	A	98.3	Very high	97.6	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-58.8	-43.9	176.6	0	0	0	0	0	111.8	M237 F240 T241 V246 G247 V248 W254 Y255	M237-A251 HydrophobicContact CE-CB 3.89Å; M237-A251 VanDerWaalsContact SD-C 3.59Å; M237-A251 HydrophobicContact SD-CB 3.87Å; F240-A251 HydrophobicContact CB-CB 3.58Å; F240-A251 HydrophobicContact CD2-CB 4.33Å; F240-A251 HydrophobicContact CG-CB 4.49Å; T241-A251 HydrophobicContact CG2-CB 3.65Å; V246-A251 HydrophobicContact CG1-CB 4.05Å; G247-A251 PolarHBondContact O-N 3.11Å; V248-A251 PolarHBondContact O-N 2.79Å; A251-W254 PolarHBondContact O-N 2.91Å; A251-Y255 WeakPolarHBondContact O-CB 3.32Å; A251-Y255 PolarHBondContact O-N 3.22Å
252	D	98.2	Very high	97.5	Very high	25 Å²	25	56.3 Å²	56.3	13%	0.134	28%	0.278	C	S	.	.	H	α-helix	trans	-65.5	-41.5	179.5	166.8	61.2	0	0	0	112.3	R233 M237 V248 T250 Y255 R256	R233-D252 IonicContact CZ-OD1 3.91Å; R233-D252 IonicContact NH1-OD1 3.67Å; R233-D252 PolarHBondContact NH1-OD1 3.46Å; R233-D252 IonicContact NH2-OD1 3.84Å; R233-D252 PolarHBondContact NH2-OD1 3.45Å; M237-D252 HydrophobicContact CE-CB 3.71Å; M237-D252 VanDerWaalsContact SD-CA 3.59Å; M237-D252 HydrophobicContact SD-CB 4.14Å; V248-D252 WeakPolarHBondContact O-CB 3.45Å; V248-D252 PolarHBondContact O-N 2.95Å; T250-D252 VanDerWaalsContact C-N 3.3Å; T250-D252 PolarHBondContact O-N 3.1Å; D252-Y255 PolarHBondContact O-N 3.31Å; D252-R256 VanDerWaalsContact CG-CZ 3.42Å; D252-R256 VanDerWaalsContact CG-NH1 3.32Å; D252-R256 WeakPolarHBondContact O-CG 3.45Å; D252-R256 PolarHBondContact O-N 3.02Å; D252-R256 VanDerWaalsContact O-N 3.08Å; D252-R256 IonicContact OD1-CZ 2.75Å; D252-R256 IonicContact OD1-NE 3.88Å; D252-R256 IonicContact OD1-NH1 3.23Å; D252-R256 IonicContact OD1-NH2 3.91Å; D252-R256 PolarHBondContact OD1-NH2 2.65Å; D252-R256 VanDerWaalsContact OD1-NH2 3.14Å; D252-R256 IonicContact OD2-CZ 3.78Å; D252-R256 IonicContact OD2-NH1 3.03Å; D252-R256 PolarHBondContact OD2-NH1 3.25Å; D252-R256 IonicContact OD2-NH2 2.7Å; D252-R256 PolarHBondContact OD2-NH2 3.31Å
253	R	98.1	Very high	97.6	Very high	118 Å²	118	55.5 Å²	55.5	45%	0.445	28%	0.277	S	S	.	.	H	α-helix	trans	-58.5	-49.9	170.4	179.1	-179.1	62.9	-161.9	1.7	111.5	R249 T250 Y255 R256 E257	R249-R253 WeakPolarHBondContact O-CB 3.39Å; R249-R253 PolarHBondContact O-N 2.92Å; R249-R253 VanDerWaalsContact O-N 3.09Å; T250-R253 PolarHBondContact O-N 2.9Å; R253-Y255 VanDerWaalsContact C-N 3.32Å; R253-Y255 PolarHBondContact O-N 3.42Å; R253-R256 PolarHBondContact O-N 3.49Å; R253-R256 VanDerWaalsContact O-N 3.14Å; R253-E257 VanDerWaalsContact CG-OE1 3.29Å; R253-E257 WeakPolarHBondContact CG-OE1 3.17Å; R253-E257 PolarHBondContact O-N 3.42Å
254	W	98.1	Very high	97.6	Very high	4 Å²	4	57.3 Å²	57.3	2%	0.015	29%	0.286	C	S	.	.	H	α-helix	trans	-60.2	-40.4	178.6	-70.1	-24.2	0	0	0	113	F240 I243 V246 T250 A251 R256 E257 G258 L259 L265 L272	F240-W254 HydrophobicContact CB-CE3 4.28Å; F240-W254 HydrophobicContact CD1-CE3 4.48Å; F240-W254 HydrophobicContact CD2-CB 4.04Å; F240-W254 HydrophobicContact CD2-CE3 4.06Å; F240-W254 HydrophobicContact CE2-CB 3.76Å; F240-W254 HydrophobicContact CE2-CE3 4.5Å; F240-W254 HydrophobicContact CG-CE3 4.04Å; I243-W254 HydrophobicContact CD1-CZ3 4.26Å; V246-W254 HydrophobicContact CB-CH2 4.46Å; V246-W254 HydrophobicContact CB-CZ3 4.19Å; V246-W254 HydrophobicContact CG1-CE3 4.1Å; V246-W254 HydrophobicContact CG1-CH2 4.14Å; V246-W254 HydrophobicContact CG1-CZ3 3.55Å; V246-W254 HydrophobicContact CG2-CH2 3.43Å; V246-W254 VanDerWaalsContact CG2-CH2 3.43Å; V246-W254 HydrophobicContact CG2-CZ3 3.49Å; V246-W254 VanDerWaalsContact CG2-CZ3 3.49Å; T250-W254 HydrophobicContact CG2-CD2 3.92Å; T250-W254 HydrophobicContact CG2-CE3 4.17Å; T250-W254 HydrophobicContact CG2-CH2 3.82Å; T250-W254 HydrophobicContact CG2-CZ2 3.51Å; T250-W254 HydrophobicContact CG2-CZ3 4.14Å; T250-W254 PolarHBondContact O-N 3.24Å; A251-W254 PolarHBondContact O-N 2.91Å; W254-R256 VanDerWaalsContact C-N 3.35Å; W254-R256 PolarHBondContact O-N 3.4Å; W254-E257 WeakPolarHBondContact O-CB 3.31Å; W254-E257 PolarHBondContact O-N 3.38Å; W254-G258 PolarHBondContact O-N 2.85Å; W254-L259 HydrophobicContact CB-CB 4.32Å; W254-L259 HydrophobicContact CB-CD1 3.96Å; W254-L259 HydrophobicContact CB-CG 4.48Å; W254-L259 HydrophobicContact CG-CD1 4.02Å; W254-L259 WeakPolarHBondContact O-CB 3.43Å; W254-L259 PolarHBondContact O-N 3.06Å; W254-L265 HydrophobicContact CD2-CD2 3.56Å; W254-L265 HydrophobicContact CE3-CD1 3.94Å; W254-L265 HydrophobicContact CE3-CD2 3.55Å; W254-L265 HydrophobicContact CE3-CG 4.42Å; W254-L265 HydrophobicContact CG-CD2 4.02Å; W254-L265 HydrophobicContact CH2-CD1 4.18Å; W254-L265 HydrophobicContact CH2-CD2 4.16Å; W254-L265 HydrophobicContact CZ2-CD2 4.19Å; W254-L265 HydrophobicContact CZ3-CD1 3.61Å; W254-L265 HydrophobicContact CZ3-CD2 3.85Å; W254-L265 HydrophobicContact CZ3-CG 4.4Å; W254-L272 HydrophobicContact CH2-CD2 4.03Å; W254-L272 HydrophobicContact CZ2-CD2 3.64Å
255	Y	98.4	Very high	97.6	Very high	42 Å²	42	55.9 Å²	55.9	17%	0.165	28%	0.28	C	S	.	.	H	α-helix	trans	-59.9	-44.2	174.2	-175.1	-89.2	0	0	0	112	E232 R233 T236 A251 D252 R253 E257 G258 R260	E232-Y255 HydrophobicContact CG-CE2 4.41Å; R233-Y255 HydrophobicContact CB-CE2 4.3Å; R233-Y255 VanDerWaalsContact NH1-CB 3.28Å; T236-Y255 HydrophobicContact CG2-CD2 3.66Å; T236-Y255 HydrophobicContact CG2-CE2 4.32Å; A251-Y255 WeakPolarHBondContact O-CB 3.32Å; A251-Y255 PolarHBondContact O-N 3.22Å; D252-Y255 PolarHBondContact O-N 3.31Å; R253-Y255 VanDerWaalsContact C-N 3.32Å; R253-Y255 PolarHBondContact O-N 3.42Å; Y255-E257 VanDerWaalsContact C-N 3.29Å; Y255-E257 PolarHBondContact O-N 3.2Å; Y255-G258 PolarHBondContact O-N 3.31Å; Y255-R260 VanDerWaalsContact CE2-CZ 3.44Å; Y255-R260 PolarHBondContact O-NH1 3.4Å
256	R	98.1	Very high	97.6	Very high	175 Å²	175	60.3 Å²	60.3	66%	0.66	29%	0.29	S	S	*	.	H	α-helix	trans	-66.5	-29.9	175.8	-67.6	-167.9	-156.5	91.3	-1.8	113.2	D252 R253 W254 G258	D252-R256 VanDerWaalsContact CG-CZ 3.42Å; D252-R256 VanDerWaalsContact CG-NH1 3.32Å; D252-R256 WeakPolarHBondContact O-CG 3.45Å; D252-R256 PolarHBondContact O-N 3.02Å; D252-R256 VanDerWaalsContact O-N 3.08Å; D252-R256 IonicContact OD1-CZ 2.75Å; D252-R256 IonicContact OD1-NE 3.88Å; D252-R256 IonicContact OD1-NH1 3.23Å; D252-R256 IonicContact OD1-NH2 3.91Å; D252-R256 PolarHBondContact OD1-NH2 2.65Å; D252-R256 VanDerWaalsContact OD1-NH2 3.14Å; D252-R256 IonicContact OD2-CZ 3.78Å; D252-R256 IonicContact OD2-NH1 3.03Å; D252-R256 PolarHBondContact OD2-NH1 3.25Å; D252-R256 IonicContact OD2-NH2 2.7Å; D252-R256 PolarHBondContact OD2-NH2 3.31Å; R253-R256 PolarHBondContact O-N 3.49Å; R253-R256 VanDerWaalsContact O-N 3.14Å; W254-R256 VanDerWaalsContact C-N 3.35Å; W254-R256 PolarHBondContact O-N 3.4Å; R256-G258 PolarHBondContact O-N 3.39Å
257	E	97.7	Very high	97.5	Very high	89 Å²	89	66.8 Å²	66.8	42%	0.416	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-2.5	171.8	-72	178.1	-143.4	0	0	112.9	R253 W254 Y255 L259 K271	R253-E257 VanDerWaalsContact CG-OE1 3.29Å; R253-E257 WeakPolarHBondContact CG-OE1 3.17Å; R253-E257 PolarHBondContact O-N 3.42Å; W254-E257 WeakPolarHBondContact O-CB 3.31Å; W254-E257 PolarHBondContact O-N 3.38Å; Y255-E257 VanDerWaalsContact C-N 3.29Å; Y255-E257 PolarHBondContact O-N 3.2Å; E257-L259 HydrophobicContact CB-CG 4.36Å; E257-K271 IonicContact OE2-NZ 2.92Å; E257-K271 PolarHBondContact OE2-NZ 2.73Å
258	G	98	Very high	97.4	Very high	45 Å²	45	67.2 Å²	67.2	46%	0.464	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.9	1.3	178	0	0	0	0	0	114.6	W254 Y255 R256 R260	W254-G258 PolarHBondContact O-N 2.85Å; Y255-G258 PolarHBondContact O-N 3.31Å; R256-G258 PolarHBondContact O-N 3.39Å; G258-R260 VanDerWaalsContact C-NH1 3.35Å
259	L	98.3	Very high	97.1	Very high	14 Å²	14	67.5 Å²	67.5	7%	0.073	31%	0.313	C	S	.	.			trans	-73.9	138.3	179.3	-45.6	-179.8	0	0	0	109.9	F240 W254 E257 D264 L265	F240-L259 HydrophobicContact CE2-CB 4.23Å; F240-L259 WeakPolarHBondContact CE2-O 3.29Å; F240-L259 HydrophobicContact CZ-CB 3.91Å; W254-L259 HydrophobicContact CB-CB 4.32Å; W254-L259 HydrophobicContact CB-CD1 3.96Å; W254-L259 HydrophobicContact CB-CG 4.48Å; W254-L259 HydrophobicContact CG-CD1 4.02Å; W254-L259 WeakPolarHBondContact O-CB 3.43Å; W254-L259 PolarHBondContact O-N 3.06Å; E257-L259 HydrophobicContact CB-CG 4.36Å; L259-D264 HydrophobicContact CB-CB 4.14Å; L259-D264 HydrophobicContact CD2-CB 3.92Å; L259-L265 HydrophobicContact CD1-CD2 3.7Å
260	R	98.2	Very high	96.9	Very high	64 Å²	64	63.7 Å²	63.7	24%	0.242	31%	0.305	C	S	.	.			trans	-131.1	-26.9	-177.5	-63.8	-61.4	179.5	-91.4	1.7	113.9	E232 T236 Y255 G258 D264	E232-R260 VanDerWaalsContact CD-NE 3.28Å; E232-R260 VanDerWaalsContact OE1-CD 3.24Å; E232-R260 WeakPolarHBondContact OE1-CD 3.34Å; E232-R260 IonicContact OE1-CZ 2.74Å; E232-R260 IonicContact OE1-NE 3.83Å; E232-R260 PolarHBondContact OE1-NE 3.14Å; E232-R260 IonicContact OE1-NH2 3.79Å; E232-R260 IonicContact OE2-NE 2.71Å; T236-R260 VanDerWaalsContact OG1-CD 3.3Å; T236-R260 WeakPolarHBondContact OG1-CD 3.32Å; Y255-R260 VanDerWaalsContact CE2-CZ 3.44Å; Y255-R260 PolarHBondContact O-NH1 3.4Å; G258-R260 VanDerWaalsContact C-NH1 3.35Å; R260-D264 PolarHBondContact N-OD2 3.19Å
261	T	98.2	Very high	96.6	Very high	58 Å²	58	67.3 Å²	67.3	36%	0.356	32%	0.319	S	S	.	.	S	Bend	trans	-119.1	165.2	-172.6	84.1	0	0	0	0	112.4	F240 D263 D264	F240-T261 WeakPolarHBondContact CE1-O 3.42Å; T261-D263 PolarHBondContact O-N 3.24Å; T261-D263 PolarHBondContact OG1-N 3.03Å; T261-D264 PolarHBondContact N-OD2 3.42Å; T261-D264 PolarHBondContact OG1-N 3.16Å; T261-D264 VanDerWaalsContact OG1-N 3.16Å; T261-D264 PolarHBondContact OG1-OD1 3.47Å
262	L	97	Very high	96.6	Very high	24 Å²	24	68.1 Å²	68.1	13%	0.126	32%	0.323	C	S	.	.	H	α-helix	trans	-67.5	-27.4	172.4	-59.7	-176.6	0	0	0	112.2	L239 I243 L265 R266 L280	L239-L262 HydrophobicContact CD1-CD1 4.28Å; L239-L262 HydrophobicContact CD1-CD2 3.95Å; L239-L262 HydrophobicContact CD1-CG 4.02Å; L239-L262 HydrophobicContact CD2-CD2 4.31Å; L239-L262 HydrophobicContact CD2-CG 4.32Å; L239-L262 HydrophobicContact CG-CD2 3.94Å; L239-L262 HydrophobicContact CG-CG 4.3Å; I243-L262 HydrophobicContact CD1-CD2 3.62Å; I243-L262 HydrophobicContact CG1-CD2 3.98Å; L262-L265 HydrophobicContact CD2-CD1 4.44Å; L262-L265 WeakPolarHBondContact O-CB 3.35Å; L262-L265 PolarHBondContact O-N 3.17Å; L262-R266 WeakPolarHBondContact O-CG 3.49Å; L262-R266 PolarHBondContact O-N 3.42Å; L262-R266 VanDerWaalsContact O-N 3.13Å; L262-L280 HydrophobicContact CB-CD2 4.4Å; L262-L280 HydrophobicContact CD2-CD2 4.06Å
263	D	97.3	Very high	96.5	Very high	89 Å²	89	70.3 Å²	70.3	48%	0.476	34%	0.337	S	S	.	.	H	α-helix	trans	-72.5	-37.6	-179.9	-66.8	-32.6	0	0	0	111	T261 L265 R266 E267	T261-D263 PolarHBondContact O-N 3.24Å; T261-D263 PolarHBondContact OG1-N 3.03Å; D263-L265 PolarHBondContact O-N 3.12Å; D263-L265 VanDerWaalsContact O-N 3.12Å; D263-R266 WeakPolarHBondContact O-CA 3.35Å; D263-R266 WeakPolarHBondContact O-CB 3.34Å; D263-R266 PolarHBondContact O-N 2.67Å; D263-R266 IonicContact OD1-CZ 2.73Å; D263-R266 IonicContact OD1-NH1 3.79Å; D263-R266 PolarHBondContact OD1-NH1 2.96Å; D263-E267 WeakPolarHBondContact O-CG 3.4Å; D263-E267 PolarHBondContact O-N 3.22Å
264	D	97.3	Very high	96.4	Very high	39 Å²	39	71.1 Å²	71.1	21%	0.209	35%	0.346	C	S	.	.	H	α-helix	trans	-55.1	-34.9	172.3	-47.5	-12	0	0	0	111.6	L259 R260 T261	L259-D264 HydrophobicContact CB-CB 4.14Å; L259-D264 HydrophobicContact CD2-CB 3.92Å; R260-D264 PolarHBondContact N-OD2 3.19Å; T261-D264 PolarHBondContact N-OD2 3.42Å; T261-D264 PolarHBondContact OG1-N 3.16Å; T261-D264 VanDerWaalsContact OG1-N 3.16Å; T261-D264 PolarHBondContact OG1-OD1 3.47Å
265	L	96.6	Very high	96.4	Very high	2 Å²	2	72.9 Å²	72.9	1%	0.01	36%	0.355	C	S	.	.	H	α-helix	trans	-74.7	-38.1	175.8	-57	176.6	0	0	0	112	F240 I243 W254 L259 L262 D263 E267 Q268 L280	F240-L265 HydrophobicContact CD1-CD1 3.8Å; F240-L265 HydrophobicContact CE1-CD1 3.72Å; F240-L265 HydrophobicContact CE1-CD2 4.42Å; F240-L265 HydrophobicContact CE1-CG 4.08Å; F240-L265 HydrophobicContact CZ-CD2 4.44Å; I243-L265 HydrophobicContact CD1-CD1 3.46Å; I243-L265 VanDerWaalsContact CD1-CD1 3.46Å; W254-L265 HydrophobicContact CD2-CD2 3.56Å; W254-L265 HydrophobicContact CE3-CD1 3.94Å; W254-L265 HydrophobicContact CE3-CD2 3.55Å; W254-L265 HydrophobicContact CE3-CG 4.42Å; W254-L265 HydrophobicContact CG-CD2 4.02Å; W254-L265 HydrophobicContact CH2-CD1 4.18Å; W254-L265 HydrophobicContact CH2-CD2 4.16Å; W254-L265 HydrophobicContact CZ2-CD2 4.19Å; W254-L265 HydrophobicContact CZ3-CD1 3.61Å; W254-L265 HydrophobicContact CZ3-CD2 3.85Å; W254-L265 HydrophobicContact CZ3-CG 4.4Å; L259-L265 HydrophobicContact CD1-CD2 3.7Å; L262-L265 HydrophobicContact CD2-CD1 4.44Å; L262-L265 WeakPolarHBondContact O-CB 3.35Å; L262-L265 PolarHBondContact O-N 3.17Å; D263-L265 PolarHBondContact O-N 3.12Å; D263-L265 VanDerWaalsContact O-N 3.12Å; L265-E267 VanDerWaalsContact C-N 3.28Å; L265-E267 PolarHBondContact O-N 3.31Å; L265-Q268 PolarHBondContact O-N 2.95Å; L265-L280 HydrophobicContact CB-CD1 3.88Å; L265-L280 HydrophobicContact CB-CD2 4.44Å; L265-L280 HydrophobicContact CD1-CD1 4.36Å; L265-L280 HydrophobicContact CD1-CD2 4.14Å
266	R	95.3	Very high	96.3	Very high	115 Å²	115	71.4 Å²	71.4	43%	0.434	35%	0.349	S	S	.	.	H	α-helix	trans	-67.7	-28.9	178.3	-71.7	178	-176.5	113.3	7.1	112.6	L262 D263 Q268 P269	L262-R266 WeakPolarHBondContact O-CG 3.49Å; L262-R266 PolarHBondContact O-N 3.42Å; L262-R266 VanDerWaalsContact O-N 3.13Å; D263-R266 WeakPolarHBondContact O-CA 3.35Å; D263-R266 WeakPolarHBondContact O-CB 3.34Å; D263-R266 PolarHBondContact O-N 2.67Å; D263-R266 IonicContact OD1-CZ 2.73Å; D263-R266 IonicContact OD1-NH1 3.79Å; D263-R266 PolarHBondContact OD1-NH1 2.96Å; R266-Q268 PolarHBondContact O-N 2.87Å; R266-P269 WeakPolarHBondContact O-CD 3.45Å
267	E	95.9	Very high	96.3	Very high	148 Å²	148	66.5 Å²	66.5	69%	0.692	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-12.8	175.2	-70.2	177.9	176.9	0	0	113.1	D263 L265 P269	D263-E267 WeakPolarHBondContact O-CG 3.4Å; D263-E267 PolarHBondContact O-N 3.22Å; L265-E267 VanDerWaalsContact C-N 3.28Å; L265-E267 PolarHBondContact O-N 3.31Å; E267-P269 WeakPolarHBondContact O-CD 3.36Å
268	Q	93.8	Very high	96.3	Very high	51 Å²	51	62.6 Å²	62.6	24%	0.238	32%	0.316	C	S	.	.			trans	-122.6	50.9	-179.5	-54.6	-175.5	22.2	0	0	112.9	L265 R266 Q270 K271	L265-Q268 PolarHBondContact O-N 2.95Å; R266-Q268 PolarHBondContact O-N 2.87Å; Q268-Q270 VanDerWaalsContact C-OE1 3.3Å; Q268-Q270 PolarHBondContact O-N 3.05Å; Q268-Q270 VanDerWaalsContact O-N 3.09Å; Q268-K271 HydrophobicContact CB-CD 4.36Å; Q268-K271 PolarHBondContact O-N 2.77Å; Q268-K271 VanDerWaalsContact OE1-CE 3.29Å
269	P	92.2	Very high	96.3	Very high	63 Å²	63	60.5 Å²	60.5	41%	0.409	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-63.5	-24.2	-169.7	28.4	-36.2	0	0	0	113.9	R266 E267 K271 L272 K277	R266-P269 WeakPolarHBondContact O-CD 3.45Å; E267-P269 WeakPolarHBondContact O-CD 3.36Å; P269-K271 PolarHBondContact O-N 2.76Å; P269-L272 PolarHBondContact O-N 3.45Å; P269-K277 WeakPolarHBondContact O-CE 3.38Å; P269-K277 PolarHBondContact O-NZ 3.15Å
270	Q	92.7	Very high	96.3	Very high	145 Å²	145	60.1 Å²	60.1	68%	0.678	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-65.6	-24.2	176.1	67.3	-78.2	6.6	0	0	113.5	Q268 L272	Q268-Q270 VanDerWaalsContact C-OE1 3.3Å; Q268-Q270 PolarHBondContact O-N 3.05Å; Q268-Q270 VanDerWaalsContact O-N 3.09Å; Q270-L272 VanDerWaalsContact C-N 3.35Å
271	K	92.1	Very high	96.2	Very high	103 Å²	103	64.1 Å²	64.1	45%	0.448	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-85.4	-8.9	178.3	-66.9	-173.1	178.6	174.2	0	113.3	E257 Q268 P269	E257-K271 IonicContact OE2-NZ 2.92Å; E257-K271 PolarHBondContact OE2-NZ 2.73Å; Q268-K271 HydrophobicContact CB-CD 4.36Å; Q268-K271 PolarHBondContact O-N 2.77Å; Q268-K271 VanDerWaalsContact OE1-CE 3.29Å; P269-K271 PolarHBondContact O-N 2.76Å
272	L	96.6	Very high	96.1	Very high	18 Å²	18	62.2 Å²	62.2	9%	0.094	30%	0.3	C	S	.	.	S	Bend	trans	-92.5	136.3	-173.5	-56.5	178	0	0	0	111.6	W254 P269 Q270 Q276 K277 L280	W254-L272 HydrophobicContact CH2-CD2 4.03Å; W254-L272 HydrophobicContact CZ2-CD2 3.64Å; P269-L272 PolarHBondContact O-N 3.45Å; Q270-L272 VanDerWaalsContact C-N 3.35Å; L272-Q276 HydrophobicContact CB-CB 4.23Å; L272-Q276 HydrophobicContact CD2-CB 4.43Å; L272-K277 HydrophobicContact CB-CG 3.74Å; L272-K277 HydrophobicContact CD1-CG 4.24Å; L272-K277 VanDerWaalsContact O-CE 3.32Å; L272-K277 WeakPolarHBondContact O-CE 3.43Å; L272-L280 HydrophobicContact CD1-CD1 3.43Å; L272-L280 VanDerWaalsContact CD1-CD1 3.43Å; L272-L280 HydrophobicContact CD2-CD1 4.18Å; L272-L280 HydrophobicContact CG-CD1 4.44Å
273	T	97.1	Very high	96.1	Very high	70 Å²	70	62.1 Å²	62.1	43%	0.429	30%	0.299	S	S	.	.			trans	-68.1	161.5	167.7	68.2	0	0	0	0	110.8	Q275 Q276 K277	T273-Q275 PolarHBondContact O-N 3.28Å; T273-Q276 PolarHBondContact O-N 3.24Å; T273-Q276 VanDerWaalsContact O-N 3.1Å; T273-Q276 VanDerWaalsContact OG1-CG 3.25Å; T273-Q276 WeakPolarHBondContact OG1-CG 3.43Å; T273-Q276 PolarHBondContact OG1-N 3.42Å; T273-Q276 PolarHBondContact OG1-OE1 2.81Å; T273-K277 WeakPolarHBondContact O-CG 3.5Å; T273-K277 PolarHBondContact O-N 3.44Å
274	Q	96.4	Very high	96	Very high	136 Å²	136	66.4 Å²	66.4	64%	0.636	31%	0.309	S	S	*	.	H	α-helix	trans	-59.8	-34.9	176.9	-64.3	-62.2	-0.9	0	0	112.8	K277 A278	Q274-K277 PolarHBondContact O-N 3.47Å; Q274-A278 PolarHBondContact O-N 3.02Å
275	Q	96.9	Very high	96	Very high	41 Å²	41	66.3 Å²	66.3	19%	0.192	31%	0.308	C	S	.	.	H	α-helix	trans	-62.4	-45.7	174.1	-166.4	170.7	59.9	0	0	111.7	F244 G245 T273 A278 G279 Y362	F244-Q275 HydrophobicContact CD1-CG 3.87Å; F244-Q275 HydrophobicContact CE1-CG 3.5Å; F244-Q275 VanDerWaalsContact CE1-CG 3.5Å; F244-Q275 HydrophobicContact CE2-CG 4.3Å; F244-Q275 HydrophobicContact CG-CG 4.47Å; F244-Q275 HydrophobicContact CZ-CG 3.74Å; F244-Q275 VanDerWaalsContact CZ-NE2 3.34Å; G245-Q275 VanDerWaalsContact CA-OE1 3.23Å; T273-Q275 PolarHBondContact O-N 3.28Å; Q275-A278 PolarHBondContact O-N 2.91Å; Q275-G279 PolarHBondContact O-N 3.48Å; Q275-Y362 WeakPolarHBondContact CA-OH 3.24Å; Q275-Y362 HydrophobicContact CB-CE2 4.36Å; Q275-Y362 WeakPolarHBondContact CB-OH 3.48Å; Q275-Y362 HydrophobicContact CG-CE1 4.21Å; Q275-Y362 VanDerWaalsContact CG-OH 3.31Å; Q275-Y362 WeakPolarHBondContact CG-OH 3.39Å; Q275-Y362 PolarHBondContact NE2-OH 3.37Å
276	Q	97.8	Very high	96	Very high	10 Å²	10	67.4 Å²	67.4	5%	0.047	31%	0.314	C	S	.	.	H	α-helix	trans	-67.5	-37	179.1	-70.4	160.7	-8.6	0	0	112.1	G245 V246 L272 T273 G279 L280	G245-Q276 VanDerWaalsContact O-CG 3.29Å; G245-Q276 WeakPolarHBondContact O-CG 3.39Å; G245-Q276 PolarHBondContact O-NE2 3.27Å; V246-Q276 HydrophobicContact CG2-CG 3.84Å; L272-Q276 HydrophobicContact CB-CB 4.23Å; L272-Q276 HydrophobicContact CD2-CB 4.43Å; T273-Q276 PolarHBondContact O-N 3.24Å; T273-Q276 VanDerWaalsContact O-N 3.1Å; T273-Q276 VanDerWaalsContact OG1-CG 3.25Å; T273-Q276 WeakPolarHBondContact OG1-CG 3.43Å; T273-Q276 PolarHBondContact OG1-N 3.42Å; T273-Q276 PolarHBondContact OG1-OE1 2.81Å; Q276-G279 PolarHBondContact O-N 2.68Å; Q276-L280 WeakPolarHBondContact O-CB 3.2Å; Q276-L280 PolarHBondContact O-N 2.84Å
277	K	98	Very high	96	Very high	72 Å²	72	64.7 Å²	64.7	31%	0.313	31%	0.312	S	S	.	.	H	α-helix	trans	-59.9	-49.4	172.7	-71.3	175.5	-179.7	178.7	0	110.9	P269 L272 T273 Q274 G279 L280 Q281	P269-K277 WeakPolarHBondContact O-CE 3.38Å; P269-K277 PolarHBondContact O-NZ 3.15Å; L272-K277 HydrophobicContact CB-CG 3.74Å; L272-K277 HydrophobicContact CD1-CG 4.24Å; L272-K277 VanDerWaalsContact O-CE 3.32Å; L272-K277 WeakPolarHBondContact O-CE 3.43Å; T273-K277 WeakPolarHBondContact O-CG 3.5Å; T273-K277 PolarHBondContact O-N 3.44Å; Q274-K277 PolarHBondContact O-N 3.47Å; K277-G279 VanDerWaalsContact C-N 3.35Å; K277-G279 PolarHBondContact O-N 2.75Å; K277-L280 PolarHBondContact O-N 2.84Å; K277-Q281 VanDerWaalsContact O-CB 3.24Å; K277-Q281 WeakPolarHBondContact O-CB 3.33Å; K277-Q281 PolarHBondContact O-N 3.31Å
278	A	97.5	Very high	95.9	Very high	8 Å²	8	61 Å²	61	7%	0.066	30%	0.3	C	S	.	.	H	α-helix	trans	-62.4	-41.9	176.6	0	0	0	0	0	112	Q274 Q275 L280 Q281 H282 Y362 I391	Q274-A278 PolarHBondContact O-N 3.02Å; Q275-A278 PolarHBondContact O-N 2.91Å; A278-L280 PolarHBondContact O-N 2.89Å; A278-Q281 PolarHBondContact O-N 2.85Å; A278-H282 PolarHBondContact O-CD2 2.98Å; A278-H282 PolarHBondContact O-N 2.82Å; A278-Y362 HydrophobicContact CB-CD2 3.56Å; A278-Y362 HydrophobicContact CB-CE2 4.25Å; A278-Y362 HydrophobicContact CB-CG 3.81Å; A278-I391 HydrophobicContact CB-CD1 3.93Å
279	G	97.4	Very high	96.1	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-60.9	-42.2	175.5	0	0	0	0	0	113.4	Q275 Q276 K277 H283	Q275-G279 PolarHBondContact O-N 3.48Å; Q276-G279 PolarHBondContact O-N 2.68Å; K277-G279 VanDerWaalsContact C-N 3.35Å; K277-G279 PolarHBondContact O-N 2.75Å; G279-H283 VanDerWaalsContact O-CA 3.23Å; G279-H283 WeakPolarHBondContact O-CA 3.46Å; G279-H283 WeakPolarHBondContact O-CB 3.33Å; G279-H283 PolarHBondContact O-N 3.45Å
280	L	97.2	Very high	96.3	Very high	7 Å²	7	58.4 Å²	58.4	4%	0.037	29%	0.288	C	S	.	.	H	α-helix	trans	-72	-39.1	176.1	-83.1	166	0	0	0	112.9	I243 L262 L265 L272 Q276 K277 A278 H282 H283	I243-L280 HydrophobicContact CD1-CD2 3.8Å; I243-L280 HydrophobicContact CD1-CG 4.35Å; I243-L280 HydrophobicContact CG1-CD2 4.26Å; I243-L280 HydrophobicContact CG2-CD2 4.33Å; I243-L280 HydrophobicContact CG2-CG 3.93Å; L262-L280 HydrophobicContact CB-CD2 4.4Å; L262-L280 HydrophobicContact CD2-CD2 4.06Å; L265-L280 HydrophobicContact CB-CD1 3.88Å; L265-L280 HydrophobicContact CB-CD2 4.44Å; L265-L280 HydrophobicContact CD1-CD1 4.36Å; L265-L280 HydrophobicContact CD1-CD2 4.14Å; L272-L280 HydrophobicContact CD1-CD1 3.43Å; L272-L280 VanDerWaalsContact CD1-CD1 3.43Å; L272-L280 HydrophobicContact CD2-CD1 4.18Å; L272-L280 HydrophobicContact CG-CD1 4.44Å; Q276-L280 WeakPolarHBondContact O-CB 3.2Å; Q276-L280 PolarHBondContact O-N 2.84Å; K277-L280 PolarHBondContact O-N 2.84Å; A278-L280 PolarHBondContact O-N 2.89Å; L280-H282 VanDerWaalsContact C-N 3.33Å; L280-H282 PolarHBondContact O-N 3Å; L280-H283 PolarHBondContact O-N 3.29Å
281	Q	97.1	Very high	96.5	Very high	148 Å²	148	55.4 Å²	55.4	69%	0.692	28%	0.276	S	S	*	.	H	α-helix	trans	-61.5	-42	178	179.4	176.6	-7.3	0	0	111.3	K277 A278	K277-Q281 VanDerWaalsContact O-CB 3.24Å; K277-Q281 WeakPolarHBondContact O-CB 3.33Å; K277-Q281 PolarHBondContact O-N 3.31Å; A278-Q281 PolarHBondContact O-N 2.85Å
282	H	97	Very high	96.7	Very high	18 Å²	18	54.1 Å²	54.1	8%	0.083	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	10.3	-177.4	-61.2	-61.8	0	0	0	113.8	A278 L280 R284 D285 L286 A414	A278-H282 PolarHBondContact O-CD2 2.98Å; A278-H282 PolarHBondContact O-N 2.82Å; L280-H282 VanDerWaalsContact C-N 3.33Å; L280-H282 PolarHBondContact O-N 3Å; H282-R284 PolarHBondContact O-N 3.48Å; H282-R284 VanDerWaalsContact O-N 3.08Å; H282-D285 PolarHBondContact O-N 3.34Å; H282-L286 HydrophobicContact CB-CD1 4.2Å; H282-L286 HydrophobicContact CB-CG 4.06Å; H282-L286 WeakPolarHBondContact O-CG 3.38Å; H282-L286 PolarHBondContact O-N 2.86Å; H282-A414 HydrophobicContact CB-CB 3.75Å
283	H	96.4	Very high	96.6	Very high	22 Å²	22	56.8 Å²	56.8	10%	0.102	29%	0.289	C	S	.	.	H	α-helix	trans	-50.7	-41.8	-172	-179.1	-86	0	0	0	113.6	G279 L280 L286 S287	G279-H283 VanDerWaalsContact O-CA 3.23Å; G279-H283 WeakPolarHBondContact O-CA 3.46Å; G279-H283 WeakPolarHBondContact O-CB 3.33Å; G279-H283 PolarHBondContact O-N 3.45Å; L280-H283 PolarHBondContact O-N 3.29Å; H283-L286 PolarHBondContact O-N 2.71Å; H283-S287 PolarHBondContact CE1-OG 3.42Å; H283-S287 PolarHBondContact ND1-OG 2.92Å; H283-S287 VanDerWaalsContact O-CB 3.27Å; H283-S287 WeakPolarHBondContact O-CB 3.21Å; H283-S287 PolarHBondContact O-N 3.09Å; H283-S287 PolarHBondContact O-OG 3.06Å
284	R	95.3	Very high	96.6	Very high	178 Å²	178	53.8 Å²	53.8	67%	0.672	27%	0.27	S	S	*	.	H	α-helix	trans	-59.7	-49.3	-179.3	-178.6	-177.5	174.4	-161.2	-6.8	111.9	H282 S287 T288	H282-R284 PolarHBondContact O-N 3.48Å; H282-R284 VanDerWaalsContact O-N 3.08Å; R284-S287 PolarHBondContact O-N 3.13Å; R284-T288 PolarHBondContact O-N 2.96Å; R284-T288 PolarHBondContact O-OG1 3.42Å; R284-T288 VanDerWaalsContact O-OG1 3.1Å
285	D	96.3	Very high	96.7	Very high	38 Å²	38	47.3 Å²	47.3	20%	0.203	24%	0.239	C	C	.	.	H	α-helix	trans	-70.8	-42.4	-179.4	-70.8	1.8	0	0	0	110.5	H282 S287 T288 K413 A414	H282-D285 PolarHBondContact O-N 3.34Å; D285-S287 PolarHBondContact O-N 2.81Å; D285-T288 WeakPolarHBondContact O-CA 3.35Å; D285-T288 VanDerWaalsContact O-CB 3.22Å; D285-T288 WeakPolarHBondContact O-CB 3.5Å; D285-T288 PolarHBondContact O-N 2.75Å; D285-K413 WeakPolarHBondContact OD2-CA 3.39Å; D285-A414 HydrophobicContact CB-CB 3.73Å; D285-A414 PolarHBondContact OD2-N 3.01Å
286	L	96.8	Very high	96.6	Very high	24 Å²	24	49.8 Å²	49.8	13%	0.126	25%	0.254	C	S	.	.	H	α-helix	trans	-66.2	-21.9	178	-62.3	-172	0	0	0	113.7	F244 H282 H283 T288 I391 A414 R416	F244-L286 HydrophobicContact CB-CD1 4.08Å; H282-L286 HydrophobicContact CB-CD1 4.2Å; H282-L286 HydrophobicContact CB-CG 4.06Å; H282-L286 WeakPolarHBondContact O-CG 3.38Å; H282-L286 PolarHBondContact O-N 2.86Å; H283-L286 PolarHBondContact O-N 2.71Å; L286-T288 VanDerWaalsContact C-N 3.32Å; L286-I391 HydrophobicContact CD1-CD1 4.03Å; L286-I391 HydrophobicContact CD1-CG1 4.49Å; L286-I391 HydrophobicContact CD2-CG2 4.32Å; L286-A414 HydrophobicContact CD2-CB 4.18Å; L286-R416 HydrophobicContact CD1-CG 4.04Å; L286-R416 HydrophobicContact CD2-CB 4.39Å; L286-R416 HydrophobicContact CD2-CG 3.68Å; L286-R416 HydrophobicContact CG-CG 4.41Å
287	S	95.3	Very high	96.6	Very high	58 Å²	58	51.2 Å²	51.2	41%	0.406	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-12.7	172	-59	0	0	0	0	112.7	H283 R284 D285	H283-S287 PolarHBondContact CE1-OG 3.42Å; H283-S287 PolarHBondContact ND1-OG 2.92Å; H283-S287 VanDerWaalsContact O-CB 3.27Å; H283-S287 WeakPolarHBondContact O-CB 3.21Å; H283-S287 PolarHBondContact O-N 3.09Å; H283-S287 PolarHBondContact O-OG 3.06Å; R284-S287 PolarHBondContact O-N 3.13Å; D285-S287 PolarHBondContact O-N 2.81Å
288	T	95.1	Very high	96.6	Very high	70 Å²	70	47.9 Å²	47.9	43%	0.429	25%	0.253	S	S	.	.	S	Bend	trans	-81.6	128.1	176.7	-56.3	0	0	0	0	108.8	R284 D285 L286 V290	R284-T288 PolarHBondContact O-N 2.96Å; R284-T288 PolarHBondContact O-OG1 3.42Å; R284-T288 VanDerWaalsContact O-OG1 3.1Å; D285-T288 WeakPolarHBondContact O-CA 3.35Å; D285-T288 VanDerWaalsContact O-CB 3.22Å; D285-T288 WeakPolarHBondContact O-CB 3.5Å; D285-T288 PolarHBondContact O-N 2.75Å; L286-T288 VanDerWaalsContact C-N 3.32Å; T288-V290 PolarHBondContact O-N 2.69Å
289	P	96.8	Very high	96.7	Very high	56 Å²	56	49.7 Å²	49.7	36%	0.364	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-57.1	132.3	-179.8	-24.5	33.3	0	0	0	112.2	Q327	P289-Q327 HydrophobicContact CB-CB 4Å; P289-Q327 HydrophobicContact CB-CG 4.46Å
290	V	97.1	Very high	96.7	Very high	5 Å²	5	56 Å²	56	3%	0.03	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	131.4	169.9	-175.2	0	0	0	0	108	T288 D294 V295 F321 Q327 G328 V331 V415	T288-V290 PolarHBondContact O-N 2.69Å; V290-D294 HydrophobicContact CG1-CB 3.76Å; V290-V295 HydrophobicContact CG1-CG2 4.18Å; V290-F321 HydrophobicContact CB-CE2 4.4Å; V290-F321 HydrophobicContact CB-CZ 4.05Å; V290-F321 HydrophobicContact CG1-CE2 4.23Å; V290-F321 HydrophobicContact CG1-CZ 3.99Å; V290-F321 WeakPolarHBondContact O-CZ 2.94Å; V290-Q327 CarbonylContact O-C 3.6Å; V290-Q327 WeakPolarHBondContact O-CA 3.46Å; V290-G328 PolarHBondContact N-O 3.33Å; V290-G328 PolarHBondContact O-N 2.88Å; V290-V331 HydrophobicContact CG1-CG2 3.74Å; V290-V415 HydrophobicContact CG1-CG1 4.09Å; V290-V415 HydrophobicContact CG2-CG1 3.66Å
291	L	96.8	Very high	96.7	Very high	81 Å²	81	56.6 Å²	56.6	42%	0.424	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	165.9	-179.5	-55.9	180	0	0	0	111.1	S293 D294 V295 Q327	L291-S293 VanDerWaalsContact C-N 3.3Å; L291-S293 PolarHBondContact O-N 3Å; L291-D294 WeakPolarHBondContact CB-OD2 3.37Å; L291-D294 PolarHBondContact N-OD2 2.78Å; L291-D294 VanDerWaalsContact O-CB 3.31Å; L291-D294 WeakPolarHBondContact O-CB 3.47Å; L291-D294 PolarHBondContact O-N 3.31Å; L291-V295 WeakPolarHBondContact O-CG2 3.46Å; L291-V295 PolarHBondContact O-N 2.88Å; L291-V295 VanDerWaalsContact O-N 3.1Å; L291-Q327 HydrophobicContact CD2-CB 4.39Å
292	R	95.1	Very high	96.8	Very high	76 Å²	76	49.5 Å²	49.5	29%	0.287	26%	0.262	S	S	.	.	H	α-helix	trans	-55.5	-41.4	176.2	-77.5	-70.1	-178.8	168.8	2.2	113.9	D294 V295 D296 F321 K325	R292-D294 PolarHBondContact O-N 3.11Å; R292-V295 WeakPolarHBondContact O-CA 3.26Å; R292-V295 WeakPolarHBondContact O-CB 3.22Å; R292-V295 PolarHBondContact O-N 3.42Å; R292-D296 VanDerWaalsContact O-CG 3.22Å; R292-D296 PolarHBondContact O-N 3.06Å; R292-F321 PolarHBondContact NH1-O 3.47Å; R292-F321 PolarHBondContact NH2-O 2.79Å; R292-K325 PolarHBondContact NE-O 3.01Å; R292-K325 VanDerWaalsContact NE-O 3.09Å; R292-K325 PolarHBondContact NH2-O 2.99Å
293	S	95.2	Very high	96.9	Very high	75 Å²	75	52.7 Å²	52.7	52%	0.524	28%	0.277	S	S	.	.	H	α-helix	trans	-60.5	-32	176	55.2	0	0	0	0	113	L291 A297	L291-S293 VanDerWaalsContact C-N 3.3Å; L291-S293 PolarHBondContact O-N 3Å; S293-A297 PolarHBondContact O-N 3.25Å
294	D	96.9	Very high	96.9	Very high	6 Å²	6	56.1 Å²	56.1	3%	0.032	29%	0.293	C	S	.	.	H	α-helix	trans	-72.6	-40.7	175.3	-53.8	-51.4	0	0	0	111	V290 L291 R292 D296 A297 L298 L394 K413	V290-D294 HydrophobicContact CG1-CB 3.76Å; L291-D294 WeakPolarHBondContact CB-OD2 3.37Å; L291-D294 PolarHBondContact N-OD2 2.78Å; L291-D294 VanDerWaalsContact O-CB 3.31Å; L291-D294 WeakPolarHBondContact O-CB 3.47Å; L291-D294 PolarHBondContact O-N 3.31Å; R292-D294 PolarHBondContact O-N 3.11Å; D294-D296 VanDerWaalsContact C-N 3.34Å; D294-A297 PolarHBondContact O-N 3.1Å; D294-L298 WeakPolarHBondContact O-CB 3.5Å; D294-L298 WeakPolarHBondContact O-CD1 3.5Å; D294-L298 WeakPolarHBondContact O-CG 3.45Å; D294-L298 PolarHBondContact O-N 2.84Å; D294-L394 HydrophobicContact CB-CD2 3.58Å; D294-K413 WeakPolarHBondContact OD1-CE 3.29Å; D294-K413 IonicContact OD1-NZ 3.45Å; D294-K413 PolarHBondContact OD1-NZ 2.91Å; D294-K413 WeakPolarHBondContact OD2-CE 3.35Å; D294-K413 IonicContact OD2-NZ 3.67Å; D294-K413 PolarHBondContact OD2-NZ 3.09Å
295	V	98.1	Very high	97.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-59.5	-46.4	176.1	177.4	0	0	0	0	110.3	V290 L291 R292 A297 L298 Q299 L317 F321 V331	V290-V295 HydrophobicContact CG1-CG2 4.18Å; L291-V295 WeakPolarHBondContact O-CG2 3.46Å; L291-V295 PolarHBondContact O-N 2.88Å; L291-V295 VanDerWaalsContact O-N 3.1Å; R292-V295 WeakPolarHBondContact O-CA 3.26Å; R292-V295 WeakPolarHBondContact O-CB 3.22Å; R292-V295 PolarHBondContact O-N 3.42Å; V295-A297 PolarHBondContact O-N 2.99Å; V295-L298 PolarHBondContact O-N 2.92Å; V295-Q299 VanDerWaalsContact O-CB 3.24Å; V295-Q299 WeakPolarHBondContact O-CB 3.49Å; V295-Q299 PolarHBondContact O-N 3.16Å; V295-L317 HydrophobicContact CG1-CD1 3.58Å; V295-L317 HydrophobicContact CG1-CD2 3.66Å; V295-L317 HydrophobicContact CG1-CG 4.26Å; V295-F321 HydrophobicContact CG2-CD1 3.8Å; V295-F321 HydrophobicContact CG2-CD2 3.63Å; V295-F321 HydrophobicContact CG2-CE1 3.64Å; V295-F321 HydrophobicContact CG2-CE2 3.45Å; V295-F321 VanDerWaalsContact CG2-CE2 3.45Å; V295-F321 HydrophobicContact CG2-CG 3.79Å; V295-F321 HydrophobicContact CG2-CZ 3.45Å; V295-F321 VanDerWaalsContact CG2-CZ 3.45Å; V295-V331 HydrophobicContact CG1-CG1 3.99Å; V295-V331 HydrophobicContact CG2-CG1 4.28Å; V295-V331 HydrophobicContact CG2-CG2 3.88Å
296	D	96.7	Very high	97.2	Very high	94 Å²	94	45.9 Å²	45.9	50%	0.503	25%	0.252	S	S	.	.	H	α-helix	trans	-62.6	-44.7	-179.3	-60	-26	0	0	0	111.1	R292 D294 Q299 Q300	R292-D296 VanDerWaalsContact O-CG 3.22Å; R292-D296 PolarHBondContact O-N 3.06Å; D294-D296 VanDerWaalsContact C-N 3.34Å; D296-Q299 PolarHBondContact O-N 3.08Å; D296-Q300 PolarHBondContact O-N 2.91Å
297	A	97	Very high	97.3	Very high	39 Å²	39	46.3 Å²	46.3	32%	0.322	26%	0.262	S	S	.	.	H	α-helix	trans	-64.9	-40.6	177	0	0	0	0	0	112.6	S293 D294 V295 A301 L394	S293-A297 PolarHBondContact O-N 3.25Å; D294-A297 PolarHBondContact O-N 3.1Å; V295-A297 PolarHBondContact O-N 2.99Å; A297-A301 PolarHBondContact O-N 2.77Å; A297-L394 HydrophobicContact CB-CD1 3.89Å
298	L	98.1	Very high	97.4	Very high	3 Å²	3	47.9 Å²	47.9	2%	0.016	26%	0.263	C	S	.	.	H	α-helix	trans	-68.6	-39.7	175.8	-72.6	166.2	0	0	0	111.7	D294 V295 Q300 A301 V302 V331 F333 F392 L394 V415 V417	D294-L298 WeakPolarHBondContact O-CB 3.5Å; D294-L298 WeakPolarHBondContact O-CD1 3.5Å; D294-L298 WeakPolarHBondContact O-CG 3.45Å; D294-L298 PolarHBondContact O-N 2.84Å; V295-L298 PolarHBondContact O-N 2.92Å; L298-Q300 VanDerWaalsContact C-N 3.35Å; L298-A301 PolarHBondContact O-N 2.91Å; L298-V302 WeakPolarHBondContact O-CB 3.47Å; L298-V302 VanDerWaalsContact O-CG2 3.26Å; L298-V302 WeakPolarHBondContact O-CG2 3.29Å; L298-V302 PolarHBondContact O-N 3.23Å; L298-V331 HydrophobicContact CD1-CB 4.47Å; L298-V331 HydrophobicContact CD1-CG2 3.77Å; L298-F333 HydrophobicContact CB-CE2 4.31Å; L298-F333 HydrophobicContact CB-CZ 4.41Å; L298-F392 HydrophobicContact CD2-CB 3.88Å; L298-F392 HydrophobicContact CD2-CD1 3.62Å; L298-F392 HydrophobicContact CD2-CE1 4.41Å; L298-F392 HydrophobicContact CD2-CG 3.99Å; L298-L394 HydrophobicContact CD1-CD2 4.37Å; L298-L394 HydrophobicContact CD2-CB 4.48Å; L298-L394 HydrophobicContact CD2-CD1 4.06Å; L298-L394 HydrophobicContact CG-CD1 4.09Å; L298-L394 HydrophobicContact CG-CD2 4.27Å; L298-V415 HydrophobicContact CD1-CB 4.01Å; L298-V415 HydrophobicContact CD1-CG1 3.55Å; L298-V415 HydrophobicContact CD1-CG2 4.44Å; L298-V417 HydrophobicContact CD1-CG2 3.93Å; L298-V417 HydrophobicContact CD2-CG2 4.04Å; L298-V417 HydrophobicContact CG-CG2 4.49Å
299	Q	98.4	Very high	97.5	Very high	46 Å²	46	44.6 Å²	44.6	22%	0.215	24%	0.243	C	C	.	.	H	α-helix	trans	-61.8	-45.8	177.6	-178.2	166.8	-14.6	0	0	110.4	V295 D296 A301 V302 E303 F333	V295-Q299 VanDerWaalsContact O-CB 3.24Å; V295-Q299 WeakPolarHBondContact O-CB 3.49Å; V295-Q299 PolarHBondContact O-N 3.16Å; D296-Q299 PolarHBondContact O-N 3.08Å; Q299-A301 PolarHBondContact O-N 3.07Å; Q299-V302 PolarHBondContact O-N 3.12Å; Q299-E303 HydrophobicContact CG-CG 4.23Å; Q299-E303 VanDerWaalsContact CG-OE1 3.31Å; Q299-E303 WeakPolarHBondContact CG-OE1 3.29Å; Q299-E303 PolarHBondContact NE2-OE1 2.84Å; Q299-E303 VanDerWaalsContact O-CB 3.32Å; Q299-E303 WeakPolarHBondContact O-CB 3.44Å; Q299-E303 VanDerWaalsContact O-CG 3.3Å; Q299-E303 WeakPolarHBondContact O-CG 3.37Å; Q299-E303 PolarHBondContact O-N 3.1Å; Q299-F333 VanDerWaalsContact CA-CZ 3.48Å; Q299-F333 HydrophobicContact CB-CE1 3.7Å; Q299-F333 HydrophobicContact CB-CZ 3.69Å; Q299-F333 HydrophobicContact CG-CE1 3.85Å; Q299-F333 HydrophobicContact CG-CZ 4.33Å
300	Q	98	Very high	97.6	Very high	133 Å²	133	42.7 Å²	42.7	62%	0.621	23%	0.23	S	C	*	.	H	α-helix	trans	-58.2	-47.1	175.6	-174.9	179.2	3.6	0	0	112	D296 L298 V302 E303 E304	D296-Q300 PolarHBondContact O-N 2.91Å; L298-Q300 VanDerWaalsContact C-N 3.35Å; Q300-V302 PolarHBondContact O-N 2.86Å; Q300-E303 PolarHBondContact O-N 2.89Å; Q300-E304 WeakPolarHBondContact O-CB 3.41Å; Q300-E304 PolarHBondContact O-N 2.95Å
301	A	97.8	Very high	97.7	Very high	18 Å²	18	47.2 Å²	47.2	15%	0.149	26%	0.259	C	S	.	.	H	α-helix	trans	-64	-40.3	179.2	0	0	0	0	0	112.5	A297 L298 Q299 A305 L359	A297-A301 PolarHBondContact O-N 2.77Å; L298-A301 PolarHBondContact O-N 2.91Å; Q299-A301 PolarHBondContact O-N 3.07Å; A301-A305 WeakPolarHBondContact O-CB 3.43Å; A301-A305 PolarHBondContact O-N 2.97Å; A301-A305 VanDerWaalsContact O-N 3.1Å; A301-L359 HydrophobicContact CB-CD1 4.2Å
302	V	98.5	Very high	97.7	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-69	-43.6	177.4	173.1	0	0	0	0	111	L298 Q299 Q300 E304 A305 V306 V315 F333 F392 L419	L298-V302 WeakPolarHBondContact O-CB 3.47Å; L298-V302 VanDerWaalsContact O-CG2 3.26Å; L298-V302 WeakPolarHBondContact O-CG2 3.29Å; L298-V302 PolarHBondContact O-N 3.23Å; Q299-V302 PolarHBondContact O-N 3.12Å; Q300-V302 PolarHBondContact O-N 2.86Å; V302-E304 PolarHBondContact O-N 2.94Å; V302-A305 PolarHBondContact O-N 2.68Å; V302-V306 HydrophobicContact CG1-CG2 4.1Å; V302-V306 VanDerWaalsContact O-CB 3.28Å; V302-V306 WeakPolarHBondContact O-CB 3.27Å; V302-V306 WeakPolarHBondContact O-CG2 3.49Å; V302-V306 PolarHBondContact O-N 3.41Å; V302-V315 HydrophobicContact CG1-CG1 3.91Å; V302-V315 HydrophobicContact CG1-CG2 4.25Å; V302-F333 HydrophobicContact CB-CD2 4.4Å; V302-F333 HydrophobicContact CB-CE2 4.45Å; V302-F333 HydrophobicContact CG1-CD2 4.3Å; V302-F333 HydrophobicContact CG1-CG 4.46Å; V302-F333 HydrophobicContact CG2-CD2 4.01Å; V302-F333 HydrophobicContact CG2-CE2 3.98Å; V302-F392 HydrophobicContact CG2-CE1 4.06Å; V302-F392 HydrophobicContact CG2-CZ 4.08Å; V302-L419 HydrophobicContact CG1-CD2 3.97Å; V302-L419 HydrophobicContact CG2-CD2 4.11Å
303	E	98.7	Very high	97.9	Very high	84 Å²	84	43 Å²	43	39%	0.393	26%	0.257	S	S	.	.	H	α-helix	trans	-60.7	-42.7	176.4	-77.9	173.7	179	0	0	112	Q299 Q300 V306 G307 V315	Q299-E303 HydrophobicContact CG-CG 4.23Å; Q299-E303 VanDerWaalsContact CG-OE1 3.31Å; Q299-E303 WeakPolarHBondContact CG-OE1 3.29Å; Q299-E303 PolarHBondContact NE2-OE1 2.84Å; Q299-E303 VanDerWaalsContact O-CB 3.32Å; Q299-E303 WeakPolarHBondContact O-CB 3.44Å; Q299-E303 VanDerWaalsContact O-CG 3.3Å; Q299-E303 WeakPolarHBondContact O-CG 3.37Å; Q299-E303 PolarHBondContact O-N 3.1Å; Q300-E303 PolarHBondContact O-N 2.89Å; E303-V306 PolarHBondContact O-N 2.9Å; E303-G307 PolarHBondContact O-N 3.26Å; E303-V315 HydrophobicContact CG-CB 3.77Å; E303-V315 HydrophobicContact CG-CG1 4.42Å; E303-V315 HydrophobicContact CG-CG2 3.84Å
304	E	98.3	Very high	98	Very high	94 Å²	94	42.6 Å²	42.6	44%	0.439	25%	0.251	S	S	.	.	H	α-helix	trans	-62.1	-50	175.6	-172.3	-174.5	157.3	0	0	111.4	Q300 V302 V306 G307 Q308	Q300-E304 WeakPolarHBondContact O-CB 3.41Å; Q300-E304 PolarHBondContact O-N 2.95Å; V302-E304 PolarHBondContact O-N 2.94Å; E304-V306 VanDerWaalsContact C-N 3.34Å; E304-V306 PolarHBondContact O-N 2.86Å; E304-G307 PolarHBondContact O-N 3.34Å; E304-Q308 WeakPolarHBondContact O-CG 3.27Å; E304-Q308 PolarHBondContact O-N 3.24Å; E304-Q308 PolarHBondContact OE1-NE2 2.98Å; E304-Q308 VanDerWaalsContact OE1-NE2 3.12Å
305	A	98.5	Very high	98.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64.3	-38.3	179.8	0	0	0	0	0	112.5	A301 V302 A309 V350 H353 L354	A301-A305 WeakPolarHBondContact O-CB 3.43Å; A301-A305 PolarHBondContact O-N 2.97Å; A301-A305 VanDerWaalsContact O-N 3.1Å; V302-A305 PolarHBondContact O-N 2.68Å; A305-A309 VanDerWaalsContact O-CB 3.28Å; A305-A309 WeakPolarHBondContact O-CB 3.27Å; A305-A309 PolarHBondContact O-N 3.25Å; A305-V350 HydrophobicContact CB-CG1 4.11Å; A305-H353 HydrophobicContact CB-CB 4.17Å; A305-L354 HydrophobicContact CB-CD1 4.4Å; A305-L354 HydrophobicContact CB-CD2 3.66Å; A305-L354 HydrophobicContact CB-CG 3.73Å
306	V	98.6	Very high	98.2	Very high	1 Å²	1	45 Å²	45	1%	0.006	27%	0.266	C	S	.	.	H	α-helix	trans	-66.7	-43.7	174.8	168.5	0	0	0	0	110.9	V302 E303 E304 Q308 A309 L310 A313 V315 I335 V350	V302-V306 HydrophobicContact CG1-CG2 4.1Å; V302-V306 VanDerWaalsContact O-CB 3.28Å; V302-V306 WeakPolarHBondContact O-CB 3.27Å; V302-V306 WeakPolarHBondContact O-CG2 3.49Å; V302-V306 PolarHBondContact O-N 3.41Å; E303-V306 PolarHBondContact O-N 2.9Å; E304-V306 VanDerWaalsContact C-N 3.34Å; E304-V306 PolarHBondContact O-N 2.86Å; V306-Q308 PolarHBondContact O-N 3.04Å; V306-A309 PolarHBondContact O-N 3.1Å; V306-L310 PolarHBondContact O-N 3.24Å; V306-A313 HydrophobicContact CG1-CB 3.58Å; V306-V315 HydrophobicContact CB-CG2 3.86Å; V306-V315 HydrophobicContact CG1-CG2 3.89Å; V306-V315 HydrophobicContact CG2-CG2 3.85Å; V306-I335 HydrophobicContact CG1-CG2 3.97Å; V306-I335 HydrophobicContact CG2-CD1 3.78Å; V306-I335 HydrophobicContact CG2-CG1 4.35Å; V306-I335 HydrophobicContact CG2-CG2 4.36Å; V306-V350 HydrophobicContact CG2-CG1 4.07Å; V306-V350 HydrophobicContact CG2-CG2 3.87Å
307	G	98.3	Very high	98.3	Very high	34 Å²	34	41.7 Å²	41.7	35%	0.351	25%	0.248	S	C	.	.	H	α-helix	trans	-63.7	-37.8	177.9	0	0	0	0	0	113.2	E303 E304	E303-G307 PolarHBondContact O-N 3.26Å; E304-G307 PolarHBondContact O-N 3.34Å
308	Q	97.7	Very high	98.3	Very high	91 Å²	91	39.8 Å²	39.8	43%	0.425	23%	0.233	S	C	.	.	H	α-helix	trans	-68.2	-40.7	173	-70	177.2	18.5	0	0	112	E304 V306 H353	E304-Q308 WeakPolarHBondContact O-CG 3.27Å; E304-Q308 PolarHBondContact O-N 3.24Å; E304-Q308 PolarHBondContact OE1-NE2 2.98Å; E304-Q308 VanDerWaalsContact OE1-NE2 3.12Å; V306-Q308 PolarHBondContact O-N 3.04Å; Q308-H353 PolarHBondContact OE1-ND1 3.4Å
309	A	98.1	Very high	98.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-72.1	-39.4	-179.9	0	0	0	0	0	112.6	A305 V306 L346 R349 V350	A305-A309 VanDerWaalsContact O-CB 3.28Å; A305-A309 WeakPolarHBondContact O-CB 3.27Å; A305-A309 PolarHBondContact O-N 3.25Å; V306-A309 PolarHBondContact O-N 3.1Å; A309-L346 HydrophobicContact CB-CD1 3.8Å; A309-R349 HydrophobicContact CB-CB 3.93Å; A309-R349 PolarHBondContact O-NE 3.39Å; A309-R349 PolarHBondContact O-NH1 2.94Å; A309-R349 PolarHBondContact O-NH2 3.47Å; A309-V350 HydrophobicContact CB-CG2 3.63Å
310	L	98.1	Very high	98.3	Very high	17 Å²	17	38.3 Å²	38.3	9%	0.089	23%	0.231	C	C	.	.	S	Bend	trans	-151.1	95.2	-177.8	-178.5	61.5	0	0	0	110.7	V306 G312 A313 H337 Q342 L346	V306-L310 PolarHBondContact O-N 3.24Å; L310-G312 PolarHBondContact O-N 3.27Å; L310-A313 HydrophobicContact CB-CB 4.12Å; L310-A313 HydrophobicContact CD2-CB 4.05Å; L310-A313 HydrophobicContact CG-CB 4.06Å; L310-A313 VanDerWaalsContact O-CB 3.26Å; L310-A313 WeakPolarHBondContact O-CB 3.47Å; L310-A313 PolarHBondContact O-N 3.44Å; L310-H337 HydrophobicContact CD2-CB 4.05Å; L310-Q342 VanDerWaalsContact CD2-O 3.23Å; L310-Q342 WeakPolarHBondContact CD2-O 3.08Å; L310-L346 HydrophobicContact CB-CD1 3.51Å; L310-L346 HydrophobicContact CD2-CD1 4.12Å; L310-L346 HydrophobicContact CD2-CD2 4.16Å; L310-L346 HydrophobicContact CG-CD1 4.48Å
311	P	98.2	Very high	98.3	Very high	100 Å²	100	32.2 Å²	32.2	65%	0.649	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	130	175.6	-27.2	35.5	0	0	0	111.9
312	G	97.8	Very high	98.4	Very high	49 Å²	49	33.9 Å²	33.9	51%	0.505	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.8	-7.4	-177.4	0	0	0	0	0	114.8	L310 P338	L310-G312 PolarHBondContact O-N 3.27Å; G312-P338 WeakPolarHBondContact O-CD 3.27Å
313	A	98.6	Very high	98.4	Very high	18 Å²	18	35.1 Å²	35.1	15%	0.149	21%	0.209	C	C	.	.			trans	-68.7	149.4	168.6	0	0	0	0	0	111	V306 L310 T336 L346	V306-A313 HydrophobicContact CG1-CB 3.58Å; L310-A313 HydrophobicContact CB-CB 4.12Å; L310-A313 HydrophobicContact CD2-CB 4.05Å; L310-A313 HydrophobicContact CG-CB 4.06Å; L310-A313 VanDerWaalsContact O-CB 3.26Å; L310-A313 WeakPolarHBondContact O-CB 3.47Å; L310-A313 PolarHBondContact O-N 3.44Å; A313-T336 CarbonylContact C-O 3.55Å; A313-T336 VanDerWaalsContact CA-O 3.27Å; A313-T336 WeakPolarHBondContact CA-O 3.49Å; A313-T336 WeakPolarHBondContact CB-O 3.26Å; A313-L346 HydrophobicContact CB-CD2 4.46Å
314	T	98.6	Very high	98.3	Very high	68 Å²	68	32.2 Å²	32.2	42%	0.417	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	141.8	-178.4	57.2	0	0	0	0	110.5	I335 T336	T314-I335 WeakPolarHBondContact O-CA 3.31Å; T314-T336 PolarHBondContact N-O 3.19Å; T314-T336 PolarHBondContact O-N 2.89Å; T314-T336 VanDerWaalsContact O-N 3.1Å; T314-T336 WeakPolarHBondContact OG1-CG2 3.4Å
315	V	98.8	Very high	98.3	Very high	18 Å²	18	31.3 Å²	31.3	11%	0.109	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	136.1	175.1	-172	0	0	0	0	108.5	V302 E303 V306 F333 L334 I335	V302-V315 HydrophobicContact CG1-CG1 3.91Å; V302-V315 HydrophobicContact CG1-CG2 4.25Å; E303-V315 HydrophobicContact CG-CB 3.77Å; E303-V315 HydrophobicContact CG-CG1 4.42Å; E303-V315 HydrophobicContact CG-CG2 3.84Å; V306-V315 HydrophobicContact CB-CG2 3.86Å; V306-V315 HydrophobicContact CG1-CG2 3.89Å; V306-V315 HydrophobicContact CG2-CG2 3.85Å; V315-F333 HydrophobicContact CG1-CB 3.89Å; V315-F333 HydrophobicContact CG1-CD1 3.72Å; V315-F333 HydrophobicContact CG1-CG 3.97Å; V315-L334 CarbonylContact C-O 3.53Å; V315-I335 HydrophobicContact CG1-CG1 4.36Å; V315-I335 HydrophobicContact CG2-CG1 4.3Å
316	T	98.8	Very high	98.2	Very high	38 Å²	38	37.5 Å²	37.5	23%	0.233	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	121.1	177.9	-62.8	0	0	0	0	109.5	T318 L334 F427 L431	T316-T318 PolarHBondContact O-N 2.67Å; T316-L334 PolarHBondContact N-O 3.06Å; T316-L334 PolarHBondContact O-N 3.05Å; T316-F427 HydrophobicContact CG2-CZ 4.46Å; T316-L431 HydrophobicContact CG2-CD1 3.83Å
317	L	98.8	Very high	98.1	Very high	24 Å²	24	43 Å²	43	13%	0.126	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	130.3	169.8	179	65.7	0	0	0	110	V295 F321 R322 V331 F333	V295-L317 HydrophobicContact CG1-CD1 3.58Å; V295-L317 HydrophobicContact CG1-CD2 3.66Å; V295-L317 HydrophobicContact CG1-CG 4.26Å; L317-F321 HydrophobicContact CD1-CB 4.15Å; L317-F321 HydrophobicContact CD2-CB 3.88Å; L317-F321 HydrophobicContact CG-CB 4.2Å; L317-R322 WeakPolarHBondContact O-CD 3.47Å; L317-V331 HydrophobicContact CD1-CG1 3.72Å; L317-F333 HydrophobicContact CB-CD1 4.44Å; L317-F333 HydrophobicContact CB-CE1 4.24Å; L317-F333 HydrophobicContact CD1-CD1 4.31Å; L317-F333 HydrophobicContact CD1-CE1 3.83Å; L317-F333 HydrophobicContact CD1-CZ 4.42Å
318	T	98.5	Very high	97.9	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.244	C	C	.	.			trans	-127.3	-157.8	-177.4	162.7	0	0	0	0	110	T316 R322 D332 L334 W434 T435	T316-T318 PolarHBondContact O-N 2.67Å; T318-R322 PolarHBondContact O-N 2.92Å; T318-D332 HydrophobicContact CG2-CB 3.78Å; T318-D332 WeakPolarHBondContact CG2-O 3.5Å; T318-D332 PolarHBondContact N-O 3.26Å; T318-L334 HydrophobicContact CG2-CB 3.91Å; T318-W434 HydrophobicContact CG2-CB 4.18Å; T318-W434 WeakPolarHBondContact OG1-CB 3.38Å; T318-W434 PolarHBondContact OG1-O 3.33Å; T318-W434 VanDerWaalsContact OG1-O 3.04Å; T318-T435 PolarHBondContact OG1-N 3.26Å
319	G	98.1	Very high	97.8	Very high	3 Å²	3	44.7 Å²	44.7	3%	0.031	26%	0.256	C	S	.	.	H	α-helix	trans	66.3	-150.6	171.9	0	0	0	0	0	114.5	F321 R322 R323 D332 W434	G319-F321 VanDerWaalsContact C-N 3.3Å; G319-F321 PolarHBondContact O-N 3.09Å; G319-R322 PolarHBondContact O-N 2.78Å; G319-R323 PolarHBondContact O-N 2.7Å; G319-R323 PolarHBondContact O-NH1 3.27Å; G319-D332 WeakPolarHBondContact CA-OD2 3.31Å; G319-W434 VanDerWaalsContact CA-O 3.29Å; G319-W434 WeakPolarHBondContact CA-O 3.47Å; G319-W434 PolarHBondContact N-O 3.48Å; G319-W434 VanDerWaalsContact N-O 3.14Å
320	G	98	Very high	97.7	Very high	15 Å²	15	47.1 Å²	47.1	16%	0.155	27%	0.269	C	S	.	.	H	α-helix	trans	-60.3	-38	-178.1	0	0	0	0	0	113.7	R323 K325	G320-R323 PolarHBondContact O-N 3.34Å; G320-K325 VanDerWaalsContact O-CB 3.27Å; G320-K325 WeakPolarHBondContact O-CB 3.2Å; G320-K325 WeakPolarHBondContact O-CG 3.26Å; G320-K325 PolarHBondContact O-N 3.39Å; G320-K325 VanDerWaalsContact O-N 3.11Å
321	F	98.5	Very high	97.7	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.018	27%	0.265	C	S	.	.	H	α-helix	trans	-71	-36.8	-179	-68.9	-74.4	0	0	0	112.1	V290 R292 V295 L317 G319 R323 G324 K325 D330 V331	V290-F321 HydrophobicContact CB-CE2 4.4Å; V290-F321 HydrophobicContact CB-CZ 4.05Å; V290-F321 HydrophobicContact CG1-CE2 4.23Å; V290-F321 HydrophobicContact CG1-CZ 3.99Å; V290-F321 WeakPolarHBondContact O-CZ 2.94Å; R292-F321 PolarHBondContact NH1-O 3.47Å; R292-F321 PolarHBondContact NH2-O 2.79Å; V295-F321 HydrophobicContact CG2-CD1 3.8Å; V295-F321 HydrophobicContact CG2-CD2 3.63Å; V295-F321 HydrophobicContact CG2-CE1 3.64Å; V295-F321 HydrophobicContact CG2-CE2 3.45Å; V295-F321 VanDerWaalsContact CG2-CE2 3.45Å; V295-F321 HydrophobicContact CG2-CG 3.79Å; V295-F321 HydrophobicContact CG2-CZ 3.45Å; V295-F321 VanDerWaalsContact CG2-CZ 3.45Å; L317-F321 HydrophobicContact CD1-CB 4.15Å; L317-F321 HydrophobicContact CD2-CB 3.88Å; L317-F321 HydrophobicContact CG-CB 4.2Å; G319-F321 VanDerWaalsContact C-N 3.3Å; G319-F321 PolarHBondContact O-N 3.09Å; F321-R323 PolarHBondContact O-N 2.64Å; F321-G324 PolarHBondContact O-N 3.11Å; F321-K325 VanDerWaalsContact CD1-O 3.32Å; F321-K325 WeakPolarHBondContact CD1-O 3Å; F321-D330 VanDerWaalsContact CE2-O 3.29Å; F321-D330 WeakPolarHBondContact CE2-O 3.49Å; F321-V331 HydrophobicContact CE2-CG2 4.21Å
322	R	98.6	Very high	97.7	Very high	53 Å²	53	42.3 Å²	42.3	20%	0.2	24%	0.239	C	C	.	.	H	α-helix	trans	-61.6	-29.1	171.1	-171.6	176.1	178.5	-108.9	-2.9	112.6	L317 T318 G319 G324 T435 E475 P489	L317-R322 WeakPolarHBondContact O-CD 3.47Å; T318-R322 PolarHBondContact O-N 2.92Å; G319-R322 PolarHBondContact O-N 2.78Å; R322-G324 PolarHBondContact O-N 3.41Å; R322-T435 WeakPolarHBondContact CD-OG1 3.45Å; R322-T435 HydrophobicContact CG-CG2 4.4Å; R322-T435 PolarHBondContact NH1-OG1 3.14Å; R322-E475 IonicContact CZ-OE1 2.94Å; R322-E475 IonicContact CZ-OE2 3.8Å; R322-E475 VanDerWaalsContact NH1-CD 3.33Å; R322-E475 IonicContact NH1-OE1 3.63Å; R322-E475 PolarHBondContact NH1-OE1 3.05Å; R322-E475 IonicContact NH1-OE2 3.98Å; R322-E475 PolarHBondContact NH1-OE2 3.28Å; R322-E475 VanDerWaalsContact NH1-OE2 3.16Å; R322-E475 IonicContact NH2-OE1 3.21Å; R322-E475 IonicContact NH2-OE2 2.75Å; R322-E475 PolarHBondContact NH2-OE2 2.76Å; R322-P489 HydrophobicContact CG-CB 4.12Å; R322-P489 HydrophobicContact CG-CG 4.3Å; R322-P489 WeakPolarHBondContact O-CB 3.41Å
323	R	98.5	Very high	97.8	Very high	27 Å²	27	40 Å²	40	10%	0.102	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	12.6	174.5	-54.9	-165.9	-52.2	-80.8	-0.4	114.6	G319 G320 F321 T435 P489 N493	G319-R323 PolarHBondContact O-N 2.7Å; G319-R323 PolarHBondContact O-NH1 3.27Å; G320-R323 PolarHBondContact O-N 3.34Å; F321-R323 PolarHBondContact O-N 2.64Å; R323-T435 WeakPolarHBondContact CD-O 3.19Å; R323-T435 HydrophobicContact CG-CG2 3.83Å; R323-T435 WeakPolarHBondContact CG-O 3.32Å; R323-T435 PolarHBondContact NH1-O 2.98Å; R323-P489 WeakPolarHBondContact CB-O 3.3Å; R323-P489 WeakPolarHBondContact CG-O 3.24Å; R323-N493 WeakPolarHBondContact CB-OD1 3.27Å; R323-N493 PolarHBondContact NE-OD1 3Å; R323-N493 PolarHBondContact O-ND2 3.36Å
324	G	97.9	Very high	97.8	Very high	23 Å²	23	39.1 Å²	39.1	24%	0.237	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.4	4.1	175.6	0	0	0	0	0	115.6	L149 F321 R322 L326	L149-G324 VanDerWaalsContact CD2-O 3.29Å; L149-G324 WeakPolarHBondContact CD2-O 3.27Å; F321-G324 PolarHBondContact O-N 3.11Å; R322-G324 PolarHBondContact O-N 3.41Å; G324-L326 PolarHBondContact O-N 3.34Å
325	K	97.6	Very high	97.8	Very high	74 Å²	74	35.9 Å²	35.9	32%	0.322	19%	0.188	S	C	.	.			trans	-57.1	139.8	176	-72.5	-167.8	169.5	-168.2	0	111.1	L149 R292 G320 F321	L149-K325 HydrophobicContact CD1-CG 3.78Å; R292-K325 PolarHBondContact NE-O 3.01Å; R292-K325 VanDerWaalsContact NE-O 3.09Å; R292-K325 PolarHBondContact NH2-O 2.99Å; G320-K325 VanDerWaalsContact O-CB 3.27Å; G320-K325 WeakPolarHBondContact O-CB 3.2Å; G320-K325 WeakPolarHBondContact O-CG 3.26Å; G320-K325 PolarHBondContact O-N 3.39Å; G320-K325 VanDerWaalsContact O-N 3.11Å; F321-K325 VanDerWaalsContact CD1-O 3.32Å; F321-K325 WeakPolarHBondContact CD1-O 3Å
326	L	96.4	Very high	97.8	Very high	131 Å²	131	35.1 Å²	35.1	69%	0.686	18%	0.183	S	C	*	.	S	Bend	trans	-85.7	-24.3	174.8	-60.3	-179.6	0	0	0	112	G324	G324-L326 PolarHBondContact O-N 3.34Å
327	Q	96.7	Very high	97.8	Very high	117 Å²	117	34 Å²	34	55%	0.547	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	150.5	177	67.5	-175.1	38.3	0	0	111.9	P289 V290 L291	P289-Q327 HydrophobicContact CB-CB 4Å; P289-Q327 HydrophobicContact CB-CG 4.46Å; V290-Q327 CarbonylContact O-C 3.6Å; V290-Q327 WeakPolarHBondContact O-CA 3.46Å; L291-Q327 HydrophobicContact CD2-CB 4.39Å
328	G	94.8	Very high	97.7	Very high	13 Å²	13	36.9 Å²	36.9	13%	0.134	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	175.7	-177.3	0	0	0	0	0	113	V290	V290-G328 PolarHBondContact N-O 3.33Å; V290-G328 PolarHBondContact O-N 2.88Å
329	H	93.7	Very high	97.7	Very high	146 Å²	146	43.9 Å²	43.9	68%	0.676	23%	0.226	S	C	*	.	S	Bend	trans	-92	-29.2	173.6	-63.4	-66.9	0	0	0	111.8
330	D	97.1	Very high	97.6	Very high	51 Å²	51	48.6 Å²	48.6	27%	0.273	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	170.2	-175.2	49.1	5.1	0	0	0	110.5	F321 R416	F321-D330 VanDerWaalsContact CE2-O 3.29Å; F321-D330 WeakPolarHBondContact CE2-O 3.49Å; D330-R416 CarbonylContact C-O 3.55Å; D330-R416 VanDerWaalsContact CA-O 3.29Å; D330-R416 WeakPolarHBondContact CA-O 3.29Å; D330-R416 HydrophobicContact CB-CB 3.63Å
331	V	98.5	Very high	97.5	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	123.6	175.4	-168.3	0	0	0	0	109.4	V290 V295 L298 L317 F321 F333 V415 R416 V417 D418	V290-V331 HydrophobicContact CG1-CG2 3.74Å; V295-V331 HydrophobicContact CG1-CG1 3.99Å; V295-V331 HydrophobicContact CG2-CG1 4.28Å; V295-V331 HydrophobicContact CG2-CG2 3.88Å; L298-V331 HydrophobicContact CD1-CB 4.47Å; L298-V331 HydrophobicContact CD1-CG2 3.77Å; L317-V331 HydrophobicContact CD1-CG1 3.72Å; F321-V331 HydrophobicContact CE2-CG2 4.21Å; V331-F333 HydrophobicContact CB-CE2 4.27Å; V331-F333 HydrophobicContact CG1-CD2 4.24Å; V331-F333 HydrophobicContact CG1-CE1 4.07Å; V331-F333 HydrophobicContact CG1-CE2 3.51Å; V331-F333 HydrophobicContact CG1-CZ 3.41Å; V331-F333 VanDerWaalsContact CG1-CZ 3.41Å; V331-V415 HydrophobicContact CG2-CG1 4.31Å; V331-R416 PolarHBondContact N-O 3.49Å; V331-V417 HydrophobicContact CB-CG2 4.48Å; V331-V417 CarbonylContact O-C 3.58Å; V331-V417 VanDerWaalsContact O-CA 3.26Å; V331-V417 WeakPolarHBondContact O-CA 3.32Å; V331-D418 PolarHBondContact O-N 3.01Å
332	D	98.6	Very high	97.4	Very high	17 Å²	17	54.9 Å²	54.9	9%	0.091	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	128.2	-179.9	-53.6	-74.7	0	0	0	110.3	T318 G319 W434	T318-D332 HydrophobicContact CG2-CB 3.78Å; T318-D332 WeakPolarHBondContact CG2-O 3.5Å; T318-D332 PolarHBondContact N-O 3.26Å; G319-D332 WeakPolarHBondContact CA-OD2 3.31Å; D332-W434 HydrophobicContact CB-CE3 4.25Å
333	F	98.9	Very high	97.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	130.2	173.8	-64.9	-66.7	0	0	0	111.4	L298 Q299 V302 V315 L317 V331 V417 D418 L419 V420	L298-F333 HydrophobicContact CB-CE2 4.31Å; L298-F333 HydrophobicContact CB-CZ 4.41Å; Q299-F333 VanDerWaalsContact CA-CZ 3.48Å; Q299-F333 HydrophobicContact CB-CE1 3.7Å; Q299-F333 HydrophobicContact CB-CZ 3.69Å; Q299-F333 HydrophobicContact CG-CE1 3.85Å; Q299-F333 HydrophobicContact CG-CZ 4.33Å; V302-F333 HydrophobicContact CB-CD2 4.4Å; V302-F333 HydrophobicContact CB-CE2 4.45Å; V302-F333 HydrophobicContact CG1-CD2 4.3Å; V302-F333 HydrophobicContact CG1-CG 4.46Å; V302-F333 HydrophobicContact CG2-CD2 4.01Å; V302-F333 HydrophobicContact CG2-CE2 3.98Å; V315-F333 HydrophobicContact CG1-CB 3.89Å; V315-F333 HydrophobicContact CG1-CD1 3.72Å; V315-F333 HydrophobicContact CG1-CG 3.97Å; L317-F333 HydrophobicContact CB-CD1 4.44Å; L317-F333 HydrophobicContact CB-CE1 4.24Å; L317-F333 HydrophobicContact CD1-CD1 4.31Å; L317-F333 HydrophobicContact CD1-CE1 3.83Å; L317-F333 HydrophobicContact CD1-CZ 4.42Å; V331-F333 HydrophobicContact CB-CE2 4.27Å; V331-F333 HydrophobicContact CG1-CD2 4.24Å; V331-F333 HydrophobicContact CG1-CE1 4.07Å; V331-F333 HydrophobicContact CG1-CE2 3.51Å; V331-F333 HydrophobicContact CG1-CZ 3.41Å; V331-F333 VanDerWaalsContact CG1-CZ 3.41Å; F333-V417 HydrophobicContact CD2-CG1 3.76Å; F333-V417 HydrophobicContact CE2-CG1 3.96Å; F333-D418 PolarHBondContact N-O 3.04Å; F333-L419 HydrophobicContact CB-CD2 3.91Å; F333-L419 HydrophobicContact CD2-CD2 3.85Å; F333-L419 HydrophobicContact CG-CD2 4.35Å; F333-V420 PolarHBondContact O-N 3.46Å
334	L	98.7	Very high	97.1	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	129.1	170.3	-175.8	64.7	0	0	0	109.2	V315 T316 T318 V420 A422 F427 A430 L431	V315-L334 CarbonylContact C-O 3.53Å; T316-L334 PolarHBondContact N-O 3.06Å; T316-L334 PolarHBondContact O-N 3.05Å; T318-L334 HydrophobicContact CG2-CB 3.91Å; L334-V420 CarbonylContact C-O 3.55Å; L334-V420 HydrophobicContact CD1-CB 3.88Å; L334-V420 HydrophobicContact CD1-CG1 3.77Å; L334-A422 HydrophobicContact CD1-CB 3.97Å; L334-F427 HydrophobicContact CB-CE2 4.37Å; L334-F427 HydrophobicContact CD2-CD2 3.59Å; L334-F427 HydrophobicContact CD2-CE2 3.41Å; L334-F427 VanDerWaalsContact CD2-CE2 3.41Å; L334-F427 HydrophobicContact CD2-CG 4.38Å; L334-F427 HydrophobicContact CD2-CZ 4.03Å; L334-F427 HydrophobicContact CG-CD2 3.91Å; L334-F427 HydrophobicContact CG-CE2 3.6Å; L334-A430 HydrophobicContact CD1-CB 3.91Å; L334-A430 HydrophobicContact CD2-CB 3.83Å; L334-L431 HydrophobicContact CD2-CB 3.79Å; L334-L431 HydrophobicContact CD2-CD1 4.28Å; L334-L431 VanDerWaalsContact CD2-N 3.35Å
335	I	98.8	Very high	97	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	139.5	-175.5	-54.9	163.4	0	0	0	108.4	V306 T314 V315 L346 L347 L419 V420 V421 A422	V306-I335 HydrophobicContact CG1-CG2 3.97Å; V306-I335 HydrophobicContact CG2-CD1 3.78Å; V306-I335 HydrophobicContact CG2-CG1 4.35Å; V306-I335 HydrophobicContact CG2-CG2 4.36Å; T314-I335 WeakPolarHBondContact O-CA 3.31Å; V315-I335 HydrophobicContact CG1-CG1 4.36Å; V315-I335 HydrophobicContact CG2-CG1 4.3Å; I335-L346 HydrophobicContact CG2-CD2 3.57Å; I335-L347 HydrophobicContact CD1-CD2 4.13Å; I335-L419 HydrophobicContact CD1-CB 4.39Å; I335-V420 PolarHBondContact N-O 2.93Å; I335-V421 HydrophobicContact CB-CG2 4.13Å; I335-V421 HydrophobicContact CD1-CG2 4.43Å; I335-V421 WeakPolarHBondContact O-CA 3.05Å; I335-A422 PolarHBondContact O-N 3.33Å
336	T	98.6	Very high	96.9	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.012	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	174.8	173.7	-164.4	0	0	0	0	110.7	A313 T314 A422 I424 F427	A313-T336 CarbonylContact C-O 3.55Å; A313-T336 VanDerWaalsContact CA-O 3.27Å; A313-T336 WeakPolarHBondContact CA-O 3.49Å; A313-T336 WeakPolarHBondContact CB-O 3.26Å; T314-T336 PolarHBondContact N-O 3.19Å; T314-T336 PolarHBondContact O-N 2.89Å; T314-T336 VanDerWaalsContact O-N 3.1Å; T314-T336 WeakPolarHBondContact OG1-CG2 3.4Å; T336-A422 VanDerWaalsContact CB-O 3.24Å; T336-A422 WeakPolarHBondContact CB-O 3.37Å; T336-A422 PolarHBondContact OG1-O 3.47Å; T336-I424 HydrophobicContact CG2-CD1 3.9Å; T336-I424 WeakPolarHBondContact OG1-CA 3.46Å; T336-I424 PolarHBondContact OG1-N 2.9Å; T336-F427 HydrophobicContact CG2-CD2 3.41Å; T336-F427 VanDerWaalsContact CG2-CD2 3.41Å; T336-F427 HydrophobicContact CG2-CE2 3.6Å; T336-F427 HydrophobicContact CG2-CG 3.99Å; T336-F427 HydrophobicContact CG2-CZ 4.36Å
337	H	98.6	Very high	97	Very high	14 Å²	14	46.6 Å²	46.6	7%	0.065	26%	0.264	C	S	.	.			trans	-133.1	136.9	173.9	-176.7	-84.6	0	0	0	109.4	L310 K339 Q342 E343 I424	L310-H337 HydrophobicContact CD2-CB 4.05Å; H337-K339 PolarHBondContact ND1-N 3.02Å; H337-K339 PolarHBondContact ND1-O 3.14Å; H337-K339 VanDerWaalsContact ND1-O 3.1Å; H337-K339 PolarHBondContact O-N 3.19Å; H337-K339 VanDerWaalsContact O-N 3.1Å; H337-Q342 HydrophobicContact CB-CB 4.23Å; H337-Q342 VanDerWaalsContact ND1-CB 3.34Å; H337-Q342 WeakPolarHBondContact ND1-CB 3.38Å; H337-E343 HydrophobicContact CB-CB 4.12Å; H337-I424 WeakPolarHBondContact O-CB 3.3Å
338	P	97.7	Very high	97.1	Very high	85 Å²	85	43.7 Å²	43.7	55%	0.552	26%	0.255	S	S	*	.	S	Bend	trans	-64.8	-19.1	-173.6	25.5	-36.3	0	0	0	114.4	G312	G312-P338 WeakPolarHBondContact O-CD 3.27Å
339	K	97.8	Very high	97.2	Very high	147 Å²	147	48.9 Å²	48.9	64%	0.639	27%	0.27	S	S	*	.	S	Bend	trans	-99.1	113.1	170	-55	178.9	-177.1	175.2	0	109	H337 Q342	H337-K339 PolarHBondContact ND1-N 3.02Å; H337-K339 PolarHBondContact ND1-O 3.14Å; H337-K339 VanDerWaalsContact ND1-O 3.1Å; H337-K339 PolarHBondContact O-N 3.19Å; H337-K339 VanDerWaalsContact O-N 3.1Å; K339-Q342 HydrophobicContact CB-CG 3.91Å; K339-Q342 WeakPolarHBondContact O-CB 3.41Å; K339-Q342 PolarHBondContact O-N 3.31Å
340	E	96.2	Very high	97.4	Very high	101 Å²	101	42 Å²	42	47%	0.472	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.2	134.6	178.9	-170.2	79.5	178.9	0	0	112.2	Q342 P423 I424 S425	E340-Q342 VanDerWaalsContact C-N 3.28Å; E340-Q342 PolarHBondContact O-N 3.27Å; E340-P423 VanDerWaalsContact OE1-CB 3.28Å; E340-P423 WeakPolarHBondContact OE1-CB 3.24Å; E340-I424 HydrophobicContact CB-CG2 4.17Å; E340-I424 WeakPolarHBondContact OE2-CG2 3.38Å; E340-I424 PolarHBondContact OE2-N 3.32Å; E340-S425 WeakPolarHBondContact OE1-CB 3.31Å; E340-S425 PolarHBondContact OE1-OG 3.13Å; E340-S425 WeakPolarHBondContact OE2-CB 3.23Å; E340-S425 PolarHBondContact OE2-N 3.36Å; E340-S425 PolarHBondContact OE2-OG 2.77Å
341	G	95.1	Very high	97.5	Very high	43 Å²	43	39.7 Å²	39.7	44%	0.443	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.2	-13.9	175.9	0	0	0	0	0	114.7	E343 A344	G341-E343 VanDerWaalsContact C-N 3.27Å; G341-E343 WeakPolarHBondContact CA-OE1 3.29Å; G341-E343 WeakPolarHBondContact CA-OE2 3.28Å; G341-E343 PolarHBondContact N-OE1 3.22Å; G341-E343 PolarHBondContact N-OE2 2.64Å; G341-E343 PolarHBondContact O-N 3.39Å; G341-A344 WeakPolarHBondContact O-CB 3.29Å; G341-A344 PolarHBondContact O-N 3.46Å
342	Q	97.3	Very high	97.4	Very high	109 Å²	109	46.8 Å²	46.8	51%	0.509	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-24.1	176	-69.7	-67.2	-14.7	0	0	112.6	L310 H337 K339 E340 A344	L310-Q342 VanDerWaalsContact CD2-O 3.23Å; L310-Q342 WeakPolarHBondContact CD2-O 3.08Å; H337-Q342 HydrophobicContact CB-CB 4.23Å; H337-Q342 VanDerWaalsContact ND1-CB 3.34Å; H337-Q342 WeakPolarHBondContact ND1-CB 3.38Å; K339-Q342 HydrophobicContact CB-CG 3.91Å; K339-Q342 WeakPolarHBondContact O-CB 3.41Å; K339-Q342 PolarHBondContact O-N 3.31Å; E340-Q342 VanDerWaalsContact C-N 3.28Å; E340-Q342 PolarHBondContact O-N 3.27Å; Q342-A344 PolarHBondContact O-N 2.96Å
343	E	96.6	Very high	97.3	Very high	15 Å²	15	48.5 Å²	48.5	7%	0.07	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-12.3	176.1	76.2	-67.3	156.7	0	0	113.5	H337 G341 G345 L346 V421 P423	H337-E343 HydrophobicContact CB-CB 4.12Å; G341-E343 VanDerWaalsContact C-N 3.27Å; G341-E343 WeakPolarHBondContact CA-OE1 3.29Å; G341-E343 WeakPolarHBondContact CA-OE2 3.28Å; G341-E343 PolarHBondContact N-OE1 3.22Å; G341-E343 PolarHBondContact N-OE2 2.64Å; G341-E343 PolarHBondContact O-N 3.39Å; E343-G345 PolarHBondContact O-N 2.91Å; E343-L346 WeakPolarHBondContact O-CB 3.47Å; E343-L346 PolarHBondContact O-N 3.25Å; E343-V421 HydrophobicContact CB-CG1 3.56Å; E343-V421 HydrophobicContact CG-CG1 3.67Å; E343-V421 WeakPolarHBondContact O-CG1 3.25Å; E343-P423 WeakPolarHBondContact OE1-CA 3.23Å; E343-P423 WeakPolarHBondContact OE1-CB 3.31Å
344	A	94.6	Very high	97.3	Very high	76 Å²	76	48.5 Å²	48.5	63%	0.628	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	126.3	-175.2	0	0	0	0	0	112.4	G341 Q342 L346	G341-A344 WeakPolarHBondContact O-CB 3.29Å; G341-A344 PolarHBondContact O-N 3.46Å; Q342-A344 PolarHBondContact O-N 2.96Å; A344-L346 VanDerWaalsContact C-N 3.29Å; A344-L346 PolarHBondContact O-N 2.97Å
345	G	94.4	Very high	97.2	Very high	40 Å²	40	52.6 Å²	52.6	41%	0.412	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	24.6	178.5	0	0	0	0	0	113.5	E343 E386	E343-G345 PolarHBondContact O-N 2.91Å; G345-E386 PolarHBondContact N-OE2 3.27Å
346	L	97.3	Very high	97.1	Very high	3 Å²	3	58.7 Å²	58.7	2%	0.016	31%	0.312	C	S	.	.	H	α-helix	trans	-70.1	-41.2	-178.3	176.6	58.8	0	0	0	112.1	A309 L310 A313 I335 E343 A344 R349 V350 E386 V421	A309-L346 HydrophobicContact CB-CD1 3.8Å; L310-L346 HydrophobicContact CB-CD1 3.51Å; L310-L346 HydrophobicContact CD2-CD1 4.12Å; L310-L346 HydrophobicContact CD2-CD2 4.16Å; L310-L346 HydrophobicContact CG-CD1 4.48Å; A313-L346 HydrophobicContact CB-CD2 4.46Å; I335-L346 HydrophobicContact CG2-CD2 3.57Å; E343-L346 WeakPolarHBondContact O-CB 3.47Å; E343-L346 PolarHBondContact O-N 3.25Å; A344-L346 VanDerWaalsContact C-N 3.29Å; A344-L346 PolarHBondContact O-N 2.97Å; L346-R349 WeakPolarHBondContact O-CB 3.43Å; L346-R349 PolarHBondContact O-N 3.04Å; L346-R349 VanDerWaalsContact O-N 3.08Å; L346-V350 HydrophobicContact CD1-CG2 3.79Å; L346-V350 HydrophobicContact CG-CG2 3.84Å; L346-V350 PolarHBondContact O-N 2.91Å; L346-V350 VanDerWaalsContact O-N 3.13Å; L346-E386 PolarHBondContact N-OE2 2.98Å; L346-V421 HydrophobicContact CB-CG2 4.35Å; L346-V421 HydrophobicContact CD2-CG2 4.36Å
347	L	97.8	Very high	96.9	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-60.3	-42.8	-170.6	-68.1	-173.4	0	0	0	114	I335 R349 V350 M351 E386 R387 L419 V421	I335-L347 HydrophobicContact CD1-CD2 4.13Å; L347-R349 PolarHBondContact O-N 2.95Å; L347-R349 VanDerWaalsContact O-N 3.17Å; L347-V350 PolarHBondContact O-N 3.29Å; L347-M351 WeakPolarHBondContact O-CB 3.41Å; L347-M351 WeakPolarHBondContact O-CG 3.29Å; L347-M351 PolarHBondContact O-N 3.34Å; L347-E386 HydrophobicContact CB-CG 4.33Å; L347-E386 HydrophobicContact CD1-CG 3.94Å; L347-E386 HydrophobicContact CG-CG 4.14Å; L347-R387 VanDerWaalsContact CD1-CA 3.41Å; L347-L419 HydrophobicContact CD1-CB 4.49Å; L347-L419 HydrophobicContact CD2-CB 3.9Å; L347-L419 HydrophobicContact CD2-CD1 4.35Å; L347-V421 HydrophobicContact CD1-CG2 4.16Å; L347-V421 HydrophobicContact CD2-CG2 3.5Å; L347-V421 HydrophobicContact CG-CG2 3.51Å
348	P	97.9	Very high	96.8	Very high	55 Å²	55	63.7 Å²	63.7	36%	0.357	35%	0.345	S	S	.	.	H	α-helix	trans	-55.2	-34.6	176.3	-29.4	34.6	0	0	0	113.8	R352 E386	P348-R352 PolarHBondContact O-N 2.93Å; P348-E386 WeakPolarHBondContact CD-OE1 3.38Å
349	R	97.8	Very high	96.7	Very high	123 Å²	123	60.9 Å²	60.9	46%	0.464	33%	0.326	S	S	.	.	H	α-helix	trans	-72.9	-48.8	177.6	-61.3	174.1	65.8	-175.2	0.2	110.5	A309 L346 L347 M351 R352 H353	A309-R349 HydrophobicContact CB-CB 3.93Å; A309-R349 PolarHBondContact O-NE 3.39Å; A309-R349 PolarHBondContact O-NH1 2.94Å; A309-R349 PolarHBondContact O-NH2 3.47Å; L346-R349 WeakPolarHBondContact O-CB 3.43Å; L346-R349 PolarHBondContact O-N 3.04Å; L346-R349 VanDerWaalsContact O-N 3.08Å; L347-R349 PolarHBondContact O-N 2.95Å; L347-R349 VanDerWaalsContact O-N 3.17Å; R349-M351 VanDerWaalsContact C-N 3.33Å; R349-M351 PolarHBondContact O-N 3.08Å; R349-R352 WeakPolarHBondContact O-CB 3.29Å; R349-R352 PolarHBondContact O-N 3.33Å; R349-H353 PolarHBondContact O-CD2 3.37Å; R349-H353 PolarHBondContact O-N 3.28Å
350	V	98.3	Very high	96.7	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-57.4	-46.2	176.4	175.6	0	0	0	0	111.1	A305 V306 A309 L346 L347 R352 H353 L354 L419	A305-V350 HydrophobicContact CB-CG1 4.11Å; V306-V350 HydrophobicContact CG2-CG1 4.07Å; V306-V350 HydrophobicContact CG2-CG2 3.87Å; A309-V350 HydrophobicContact CB-CG2 3.63Å; L346-V350 HydrophobicContact CD1-CG2 3.79Å; L346-V350 HydrophobicContact CG-CG2 3.84Å; L346-V350 PolarHBondContact O-N 2.91Å; L346-V350 VanDerWaalsContact O-N 3.13Å; L347-V350 PolarHBondContact O-N 3.29Å; V350-R352 VanDerWaalsContact C-N 3.29Å; V350-R352 PolarHBondContact O-N 3.44Å; V350-H353 PolarHBondContact O-N 3.49Å; V350-L354 HydrophobicContact CG1-CD1 3.83Å; V350-L354 HydrophobicContact CG1-CG 4.46Å; V350-L354 WeakPolarHBondContact O-CG 3.29Å; V350-L354 PolarHBondContact O-N 2.98Å; V350-L419 HydrophobicContact CG1-CD1 4.43Å
351	M	98.1	Very high	96.8	Very high	4 Å²	4	53.2 Å²	53.2	2%	0.02	29%	0.294	C	S	.	.	H	α-helix	trans	-61.1	-38	179	-68.4	-46.7	-53.9	0	0	111.9	L347 R349 L354 Q355 I360 H363 L419	L347-M351 WeakPolarHBondContact O-CB 3.41Å; L347-M351 WeakPolarHBondContact O-CG 3.29Å; L347-M351 PolarHBondContact O-N 3.34Å; R349-M351 VanDerWaalsContact C-N 3.33Å; R349-M351 PolarHBondContact O-N 3.08Å; M351-L354 PolarHBondContact O-N 3.01Å; M351-L354 HydrophobicContact SD-CD1 4.4Å; M351-Q355 VanDerWaalsContact O-CB 3.31Å; M351-Q355 WeakPolarHBondContact O-CB 3.28Å; M351-Q355 WeakPolarHBondContact O-CG 3.33Å; M351-Q355 PolarHBondContact O-N 3.4Å; M351-Q355 PolarHBondContact O-OE1 3.5Å; M351-I360 HydrophobicContact CE-CD1 3.65Å; M351-I360 HydrophobicContact CE-CG1 3.73Å; M351-I360 HydrophobicContact CE-CG2 4Å; M351-H363 HydrophobicContact CE-CB 3.65Å; M351-L419 HydrophobicContact SD-CD1 4.07Å
352	R	97.4	Very high	97	Very high	149 Å²	149	52.7 Å²	52.7	56%	0.562	28%	0.279	S	S	*	.	H	α-helix	trans	-61.2	-48.7	175.3	-172.1	-177.9	-60.7	148.6	2.8	111.5	P348 R349 V350 L354 Q355 D356	P348-R352 PolarHBondContact O-N 2.93Å; R349-R352 WeakPolarHBondContact O-CB 3.29Å; R349-R352 PolarHBondContact O-N 3.33Å; V350-R352 VanDerWaalsContact C-N 3.29Å; V350-R352 PolarHBondContact O-N 3.44Å; R352-L354 VanDerWaalsContact C-N 3.33Å; R352-L354 PolarHBondContact O-N 3.36Å; R352-Q355 WeakPolarHBondContact O-CB 3.25Å; R352-Q355 PolarHBondContact O-N 3.02Å; R352-Q355 VanDerWaalsContact O-N 3.16Å; R352-D356 PolarHBondContact O-N 3.12Å
353	H	96.6	Very high	97	Very high	52 Å²	52	50.6 Å²	50.6	24%	0.241	27%	0.269	C	S	.	.	H	α-helix	trans	-58.3	-44.4	177.1	-70.2	-74.6	0	0	0	112.1	A305 Q308 R349 V350 Q355 D356 Q357	A305-H353 HydrophobicContact CB-CB 4.17Å; Q308-H353 PolarHBondContact OE1-ND1 3.4Å; R349-H353 PolarHBondContact O-CD2 3.37Å; R349-H353 PolarHBondContact O-N 3.28Å; V350-H353 PolarHBondContact O-N 3.49Å; H353-Q355 VanDerWaalsContact C-N 3.34Å; H353-Q355 PolarHBondContact O-N 3.46Å; H353-D356 PolarHBondContact O-N 3.27Å; H353-Q357 WeakPolarHBondContact O-CG 3.44Å; H353-Q357 PolarHBondContact O-N 3.06Å
354	L	97.7	Very high	97	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-67.7	-33.7	178.1	-65.5	167.3	0	0	0	112.6	A305 V350 M351 R352 G358 L359 I360 F392 L419	A305-L354 HydrophobicContact CB-CD1 4.4Å; A305-L354 HydrophobicContact CB-CD2 3.66Å; A305-L354 HydrophobicContact CB-CG 3.73Å; V350-L354 HydrophobicContact CG1-CD1 3.83Å; V350-L354 HydrophobicContact CG1-CG 4.46Å; V350-L354 WeakPolarHBondContact O-CG 3.29Å; V350-L354 PolarHBondContact O-N 2.98Å; M351-L354 PolarHBondContact O-N 3.01Å; M351-L354 HydrophobicContact SD-CD1 4.4Å; R352-L354 VanDerWaalsContact C-N 3.33Å; R352-L354 PolarHBondContact O-N 3.36Å; L354-G358 PolarHBondContact O-N 2.98Å; L354-L359 HydrophobicContact CD2-CD1 4.13Å; L354-L359 WeakPolarHBondContact O-CB 3.24Å; L354-L359 PolarHBondContact O-N 3.12Å; L354-I360 HydrophobicContact CB-CD1 3.8Å; L354-I360 HydrophobicContact CB-CG1 3.63Å; L354-I360 HydrophobicContact CD1-CD1 4.2Å; L354-F392 HydrophobicContact CD1-CE1 4.05Å; L354-F392 HydrophobicContact CD1-CZ 3.66Å; L354-F392 HydrophobicContact CD2-CE1 4.03Å; L354-F392 HydrophobicContact CD2-CZ 4.48Å; L354-L419 HydrophobicContact CD1-CD1 4.46Å
355	Q	97.3	Very high	97	Very high	87 Å²	87	52 Å²	52	41%	0.407	26%	0.263	S	S	.	.	H	α-helix	trans	-69.3	-42.8	174.7	-77.6	169.4	-34.9	0	0	112	M351 R352 H353 Q357 G358 I360 H363	M351-Q355 VanDerWaalsContact O-CB 3.31Å; M351-Q355 WeakPolarHBondContact O-CB 3.28Å; M351-Q355 WeakPolarHBondContact O-CG 3.33Å; M351-Q355 PolarHBondContact O-N 3.4Å; M351-Q355 PolarHBondContact O-OE1 3.5Å; R352-Q355 WeakPolarHBondContact O-CB 3.25Å; R352-Q355 PolarHBondContact O-N 3.02Å; R352-Q355 VanDerWaalsContact O-N 3.16Å; H353-Q355 VanDerWaalsContact C-N 3.34Å; H353-Q355 PolarHBondContact O-N 3.46Å; Q355-Q357 PolarHBondContact O-N 3.5Å; Q355-G358 WeakPolarHBondContact O-CA 3.4Å; Q355-G358 PolarHBondContact O-N 2.86Å; Q355-I360 HydrophobicContact CG-CB 3.95Å; Q355-I360 HydrophobicContact CG-CG1 4.04Å; Q355-I360 HydrophobicContact CG-CG2 4.37Å; Q355-H363 PolarHBondContact NE2-CD2 2.99Å; Q355-H363 PolarHBondContact NE2-NE2 2.87Å; Q355-H363 VanDerWaalsContact NE2-NE2 3.11Å
356	D	96.3	Very high	96.9	Very high	128 Å²	128	53.2 Å²	53.2	68%	0.684	26%	0.258	S	S	*	.	H	α-helix	trans	-62.2	-29.9	178.3	-67.5	-19.1	0	0	0	111.6	R352 H353 G358	R352-D356 PolarHBondContact O-N 3.12Å; H353-D356 PolarHBondContact O-N 3.27Å; D356-G358 VanDerWaalsContact C-N 3.3Å
357	Q	94.2	Very high	96.6	Very high	82 Å²	82	59.4 Å²	59.4	38%	0.383	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-3.8	172.3	-65.6	-179.3	-0.5	0	0	114	H353 Q355 L359	H353-Q357 WeakPolarHBondContact O-CG 3.44Å; H353-Q357 PolarHBondContact O-N 3.06Å; Q355-Q357 PolarHBondContact O-N 3.5Å; Q357-L359 VanDerWaalsContact C-N 3.29Å; Q357-L359 HydrophobicContact CB-CD1 4.12Å; Q357-L359 HydrophobicContact CB-CG 3.89Å; Q357-L359 PolarHBondContact O-N 3.33Å; Q357-L359 VanDerWaalsContact OE1-CD1 3.23Å
358	G	95.9	Very high	95.9	Very high	38 Å²	38	63 Å²	63	39%	0.392	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	22.5	-177.9	0	0	0	0	0	114.4	L354 Q355 D356	L354-G358 PolarHBondContact O-N 2.98Å; Q355-G358 WeakPolarHBondContact O-CA 3.4Å; Q355-G358 PolarHBondContact O-N 2.86Å; D356-G358 VanDerWaalsContact C-N 3.3Å
359	L	96.8	Very high	94.9	Very high	26 Å²	26	68.9 Å²	68.9	14%	0.136	33%	0.327	C	S	.	.			trans	-88.5	-8.7	-176.5	-62.5	-178.8	0	0	0	113.8	A301 L354 Q357 F392 R393	A301-L359 HydrophobicContact CB-CD1 4.2Å; L354-L359 HydrophobicContact CD2-CD1 4.13Å; L354-L359 WeakPolarHBondContact O-CB 3.24Å; L354-L359 PolarHBondContact O-N 3.12Å; Q357-L359 VanDerWaalsContact C-N 3.29Å; Q357-L359 HydrophobicContact CB-CD1 4.12Å; Q357-L359 HydrophobicContact CB-CG 3.89Å; Q357-L359 PolarHBondContact O-N 3.33Å; Q357-L359 VanDerWaalsContact OE1-CD1 3.23Å; L359-F392 CarbonylContact O-C 3.42Å; L359-F392 WeakPolarHBondContact O-CA 3.32Å; L359-R393 PolarHBondContact O-N 3.48Å
360	I	98.1	Very high	92.9	Very high	26 Å²	26	74.7 Å²	74.7	13%	0.133	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	118.3	-175.1	-57.1	-58.1	0	0	0	111	M351 L354 Q355 H363 F392	M351-I360 HydrophobicContact CE-CD1 3.65Å; M351-I360 HydrophobicContact CE-CG1 3.73Å; M351-I360 HydrophobicContact CE-CG2 4Å; L354-I360 HydrophobicContact CB-CD1 3.8Å; L354-I360 HydrophobicContact CB-CG1 3.63Å; L354-I360 HydrophobicContact CD1-CD1 4.2Å; Q355-I360 HydrophobicContact CG-CB 3.95Å; Q355-I360 HydrophobicContact CG-CG1 4.04Å; Q355-I360 HydrophobicContact CG-CG2 4.37Å; I360-H363 HydrophobicContact CG2-CB 4.13Å; I360-F392 HydrophobicContact CD1-CD1 4.32Å; I360-F392 HydrophobicContact CD1-CD2 3.79Å; I360-F392 HydrophobicContact CD1-CE1 4.13Å; I360-F392 HydrophobicContact CD1-CE2 3.55Å; I360-F392 HydrophobicContact CD1-CG 4.18Å; I360-F392 HydrophobicContact CD1-CZ 3.76Å
361	L	98.1	Very high	91.1	Very high	61 Å²	61	76.9 Å²	76.9	32%	0.319	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-33	174.7	-61.2	171.3	0	0	0	111.8	I391 R393 W412 A414	L361-I391 HydrophobicContact CB-CB 4.27Å; L361-I391 HydrophobicContact CB-CG2 4.09Å; L361-I391 WeakPolarHBondContact CB-O 2.97Å; L361-I391 HydrophobicContact CD1-CG2 3.99Å; L361-I391 PolarHBondContact N-O 2.89Å; L361-R393 HydrophobicContact CD1-CB 4.02Å; L361-R393 HydrophobicContact CD2-CB 4.03Å; L361-R393 HydrophobicContact CG-CB 3.86Å; L361-W412 HydrophobicContact CD1-CE3 4.2Å; L361-W412 HydrophobicContact CD1-CH2 3.9Å; L361-W412 HydrophobicContact CD1-CZ3 3.41Å; L361-W412 VanDerWaalsContact CD1-CZ3 3.41Å; L361-W412 HydrophobicContact CD2-CH2 4.38Å; L361-A414 HydrophobicContact CD1-CB 3.94Å
362	Y	98.3	Very high	89.3	Confident	32 Å²	32	79 Å²	79	13%	0.125	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	144.6	177	171.5	-89.2	0	0	0	108.9	F244 Q275 A278 Q364 C390 I391	F244-Y362 AromaticContact CE1-CD1 3.67Å; F244-Y362 HydrophobicContact CE1-CD1 3.67Å; F244-Y362 AromaticContact CE1-CE1 3.45Å; F244-Y362 HydrophobicContact CE1-CE1 3.45Å; F244-Y362 VanDerWaalsContact CE1-CE1 3.45Å; F244-Y362 HydrophobicContact CZ-CD1 4.31Å; F244-Y362 AromaticContact CZ-CE1 3.83Å; F244-Y362 HydrophobicContact CZ-CE1 3.83Å; Q275-Y362 WeakPolarHBondContact CA-OH 3.24Å; Q275-Y362 HydrophobicContact CB-CE2 4.36Å; Q275-Y362 WeakPolarHBondContact CB-OH 3.48Å; Q275-Y362 HydrophobicContact CG-CE1 4.21Å; Q275-Y362 VanDerWaalsContact CG-OH 3.31Å; Q275-Y362 WeakPolarHBondContact CG-OH 3.39Å; Q275-Y362 PolarHBondContact NE2-OH 3.37Å; A278-Y362 HydrophobicContact CB-CD2 3.56Å; A278-Y362 HydrophobicContact CB-CE2 4.25Å; A278-Y362 HydrophobicContact CB-CG 3.81Å; Y362-Q364 HydrophobicContact CE1-CB 4.06Å; Y362-Q364 WeakPolarHBondContact OH-CB 3.4Å; Y362-C390 CarbonylContact O-C 3.59Å; Y362-C390 VanDerWaalsContact O-CA 3.27Å; Y362-C390 WeakPolarHBondContact O-CA 3.24Å; Y362-I391 HydrophobicContact CD1-CD1 4.45Å; Y362-I391 HydrophobicContact CD1-CG1 4.26Å; Y362-I391 HydrophobicContact CG-CD1 4.37Å; Y362-I391 HydrophobicContact CG-CG1 4.5Å; Y362-I391 PolarHBondContact N-O 3.06Å; Y362-I391 PolarHBondContact O-N 3.47Å
363	H	97.4	Very high	87.6	Confident	66 Å²	66	75.4 Å²	75.4	31%	0.306	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	151.1	160.3	77.4	95.4	0	0	0	111.7	M351 Q355 I360 F389 C390	M351-H363 HydrophobicContact CE-CB 3.65Å; Q355-H363 PolarHBondContact NE2-CD2 2.99Å; Q355-H363 PolarHBondContact NE2-NE2 2.87Å; Q355-H363 VanDerWaalsContact NE2-NE2 3.11Å; I360-H363 HydrophobicContact CG2-CB 4.13Å; H363-F389 CarbonylContact C-O 3.09Å; H363-F389 VanDerWaalsContact CA-O 3.27Å; H363-F389 WeakPolarHBondContact CA-O 3.33Å; H363-C390 HydrophobicContact CB-CB 4.44Å
364	Q	96.3	Very high	85.9	Confident	74 Å²	74	76.5 Å²	76.5	35%	0.346	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	109.3	167.7	-175.6	178.9	25.1	0	0	108.9	Y362 S388 F389	Y362-Q364 HydrophobicContact CE1-CB 4.06Å; Y362-Q364 WeakPolarHBondContact OH-CB 3.4Å; Q364-S388 WeakPolarHBondContact O-CA 3.38Å; Q364-F389 PolarHBondContact N-O 3.44Å; Q364-F389 PolarHBondContact O-N 2.81Å
365	H	95.3	Very high	84.4	Confident	47 Å²	47	84.3 Å²	84.3	22%	0.218	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	139.6	177	175.8	-112.9	0	0	0	111.1	H367 E386 R387	H365-H367 AromaticContact CE1-CD2 3.72Å; H365-H367 AromaticContact CE1-CE1 3.33Å; H365-H367 PolarHBondContact CE1-CE1 3.17Å; H365-H367 AromaticContact CE1-CG 3.67Å; H365-H367 AromaticContact CE1-ND1 3.43Å; H365-H367 PolarHBondContact CE1-ND1 3.1Å; H365-H367 AromaticContact CE1-NE2 3.52Å; H365-H367 AromaticContact ND1-CE1 3.3Å; H365-H367 PolarHBondContact ND1-CE1 3.2Å; H365-H367 VanDerWaalsContact ND1-CE1 3.3Å; H365-H367 AromaticContact ND1-ND1 3.45Å; H365-H367 PolarHBondContact ND1-ND1 3.08Å; H365-H367 AromaticContact ND1-NE2 3.93Å; H365-E386 IonicContact CD2-OE1 3.52Å; H365-E386 IonicContact CE1-OE1 3.36Å; H365-E386 IonicContact NE2-OE1 2.77Å; H365-E386 PolarHBondContact NE2-OE1 3.13Å; H365-R387 CarbonylContact C-O 3.6Å; H365-R387 WeakPolarHBondContact CA-O 3.48Å
366	Q	92.7	Very high	82.9	Confident	64 Å²	64	81.3 Å²	81.3	30%	0.299	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	121.3	172.5	-61.3	-170.3	-4.7	0	0	108.2	E386 R387	Q366-E386 WeakPolarHBondContact O-CA 3.47Å; Q366-R387 PolarHBondContact N-O 3.04Å; Q366-R387 PolarHBondContact O-N 3.21Å
367	H	89.7	Confident	81.3	Confident	134 Å²	134	75.3 Å²	75.3	62%	0.62	37%	0.365	S	S	*	.			trans	-68.2	150.5	175.9	-66.4	71.5	0	0	0	110.4	H365 R369	H365-H367 AromaticContact CE1-CD2 3.72Å; H365-H367 AromaticContact CE1-CE1 3.33Å; H365-H367 PolarHBondContact CE1-CE1 3.17Å; H365-H367 AromaticContact CE1-CG 3.67Å; H365-H367 AromaticContact CE1-ND1 3.43Å; H365-H367 PolarHBondContact CE1-ND1 3.1Å; H365-H367 AromaticContact CE1-NE2 3.52Å; H365-H367 AromaticContact ND1-CE1 3.3Å; H365-H367 PolarHBondContact ND1-CE1 3.2Å; H365-H367 VanDerWaalsContact ND1-CE1 3.3Å; H365-H367 AromaticContact ND1-ND1 3.45Å; H365-H367 PolarHBondContact ND1-ND1 3.08Å; H365-H367 AromaticContact ND1-NE2 3.93Å; H367-R369 PolarHBondContact O-N 3Å
368	S	84.3	Confident	79.7	Confident	76 Å²	76	77.3 Å²	77.3	53%	0.531	37%	0.374	S	S	.	.			trans	-58.5	127.2	168.5	57.8	0	0	0	0	109.5	W370 A384	S368-W370 PolarHBondContact O-N 3.09Å; S368-A384 CarbonylContact C-O 3.56Å; S368-A384 VanDerWaalsContact CA-O 3.25Å; S368-A384 WeakPolarHBondContact CA-O 3.13Å
369	R	75.9	Confident	78.1	Confident	178 Å²	178	78 Å²	78	67%	0.672	37%	0.367	S	S	*	.			trans	-88.1	108.8	172.9	-63.1	-176.6	179.2	-162	-1.3	108	H367 E371 A384	H367-R369 PolarHBondContact O-N 3Å; R369-E371 PolarHBondContact O-N 2.85Å; R369-A384 HydrophobicContact CB-CB 4.19Å; R369-A384 PolarHBondContact N-O 3.39Å
370	W	55.3	Low	75.9	Confident	244 Å²	244	82 Å²	82	92%	0.924	40%	0.397	S	S	*	.			trans	-71.1	114.1	171.6	-165.8	81.9	0	0	0	108.7	S368	S368-W370 PolarHBondContact O-N 3.09Å
371	E	61.2	Low	74	Confident	47 Å²	47	87.3 Å²	87.3	22%	0.22	42%	0.421	C	S	.	.			trans	-128.2	154.9	175.9	-72.9	-171.1	-155.9	0	0	109.8	R369 R375 L376 Q379	R369-E371 PolarHBondContact O-N 2.85Å; E371-R375 HydrophobicContact CB-CB 4.39Å; E371-L376 HydrophobicContact CB-CD2 3.98Å; E371-L376 HydrophobicContact CB-CG 3.91Å; E371-L376 WeakPolarHBondContact O-CD1 3.12Å; E371-Q379 PolarHBondContact OE1-NE2 3.11Å; E371-Q379 PolarHBondContact OE2-NE2 3Å
372	S	60.2	Low	72	Confident	47 Å²	47	89.4 Å²	89.4	33%	0.329	43%	0.431	S	S	.	.			trans	-60	145.7	177	68.9	0	0	0	0	110.3	T374 R375 L376	S372-T374 PolarHBondContact O-N 3.01Å; S372-T374 VanDerWaalsContact O-N 3.11Å; S372-R375 WeakPolarHBondContact O-CA 3.49Å; S372-R375 PolarHBondContact O-N 3.38Å; S372-R375 WeakPolarHBondContact OG-CG 3.35Å; S372-R375 PolarHBondContact OG-N 3.49Å; S372-L376 PolarHBondContact O-N 3.36Å
373	P	61.4	Low	70.7	Confident	74 Å²	74	88.2 Å²	88.2	48%	0.481	43%	0.426	S	S	.	.	H	α-helix	trans	-52.6	-39.2	-178.4	-27.1	33.7	0	0	0	112.8	R375 L376 A377 F469	P373-R375 PolarHBondContact O-N 3.09Å; P373-L376 PolarHBondContact O-N 3.29Å; P373-A377 PolarHBondContact O-N 3.25Å; P373-F469 HydrophobicContact CB-CD2 4.19Å; P373-F469 HydrophobicContact CB-CE2 3.34Å; P373-F469 HydrophobicContact CB-CZ 3.87Å; P373-F469 WeakPolarHBondContact O-CZ 3.37Å
374	T	61.7	Low	70.1	Confident	76 Å²	76	85.3 Å²	85.3	47%	0.466	41%	0.414	S	S	.	.	H	α-helix	trans	-64.2	-36.9	177	-28.4	0	0	0	0	113	S372 Q378	S372-T374 PolarHBondContact O-N 3.01Å; S372-T374 VanDerWaalsContact O-N 3.11Å; T374-Q378 WeakPolarHBondContact O-CG 3.4Å; T374-Q378 PolarHBondContact O-N 3.38Å
375	R	66.6	Low	69.9	Low	164 Å²	164	82.1 Å²	82.1	62%	0.619	40%	0.399	S	S	*	.	H	α-helix	trans	-72.1	-43	175.7	-77.6	-174.1	178.4	-155.5	1.5	111.1	E371 S372 P373 A377 Q378 Q379	E371-R375 HydrophobicContact CB-CB 4.39Å; S372-R375 WeakPolarHBondContact O-CA 3.49Å; S372-R375 PolarHBondContact O-N 3.38Å; S372-R375 WeakPolarHBondContact OG-CG 3.35Å; S372-R375 PolarHBondContact OG-N 3.49Å; P373-R375 PolarHBondContact O-N 3.09Å; R375-A377 VanDerWaalsContact C-N 3.27Å; R375-A377 PolarHBondContact O-N 3.24Å; R375-Q378 PolarHBondContact O-N 2.79Å; R375-Q379 WeakPolarHBondContact O-CG 3.45Å; R375-Q379 PolarHBondContact O-N 3.09Å; R375-Q379 VanDerWaalsContact O-N 3.16Å
376	L	66	Low	69.9	Low	23 Å²	23	80.4 Å²	80.4	12%	0.12	39%	0.391	C	S	.	.	H	α-helix	trans	-55	-44.3	174.1	-71.2	169.1	0	0	0	111	E371 S372 P373 Q378 Q379 A384 N457	E371-L376 HydrophobicContact CB-CD2 3.98Å; E371-L376 HydrophobicContact CB-CG 3.91Å; E371-L376 WeakPolarHBondContact O-CD1 3.12Å; S372-L376 PolarHBondContact O-N 3.36Å; P373-L376 PolarHBondContact O-N 3.29Å; L376-Q378 PolarHBondContact O-N 3.43Å; L376-Q379 PolarHBondContact O-N 3.33Å; L376-A384 HydrophobicContact CD2-CB 4.18Å; L376-N457 PolarHBondContact O-ND2 3.33Å
377	A	61.4	Low	70	Confident	3 Å²	3	78.7 Å²	78.7	3%	0.025	38%	0.382	C	S	.	.	H	α-helix	trans	-63	-24.8	177.3	0	0	0	0	0	114.2	P373 R375 W455 F462 F469	P373-A377 PolarHBondContact O-N 3.25Å; R375-A377 VanDerWaalsContact C-N 3.27Å; R375-A377 PolarHBondContact O-N 3.24Å; A377-W455 HydrophobicContact CB-CE3 3.93Å; A377-F462 HydrophobicContact CB-CB 3.87Å; A377-F462 HydrophobicContact CB-CD1 3.91Å; A377-F462 HydrophobicContact CB-CG 3.86Å; A377-F469 HydrophobicContact CB-CZ 4.08Å
378	Q	61.4	Low	70.4	Confident	123 Å²	123	72.3 Å²	72.3	58%	0.575	35%	0.352	S	S	*	.	H	α-helix	trans	-92.3	-12.6	-179.8	-70.2	174.9	-7.2	0	0	113.5	T374 R375 L376 W455	T374-Q378 WeakPolarHBondContact O-CG 3.4Å; T374-Q378 PolarHBondContact O-N 3.38Å; R375-Q378 PolarHBondContact O-N 2.79Å; L376-Q378 PolarHBondContact O-N 3.43Å; Q378-W455 HydrophobicContact CG-CE3 4.33Å; Q378-W455 HydrophobicContact CG-CH2 4.4Å; Q378-W455 HydrophobicContact CG-CZ3 3.65Å
379	Q	62.3	Low	71	Confident	52 Å²	52	70.5 Å²	70.5	24%	0.243	34%	0.335	C	S	.	.			trans	-69.9	140.6	-177.4	-73.2	-165.7	-16.5	0	0	113.1	E371 R375 L376	E371-Q379 PolarHBondContact OE1-NE2 3.11Å; E371-Q379 PolarHBondContact OE2-NE2 3Å; R375-Q379 WeakPolarHBondContact O-CG 3.45Å; R375-Q379 PolarHBondContact O-N 3.09Å; R375-Q379 VanDerWaalsContact O-N 3.16Å; L376-Q379 PolarHBondContact O-N 3.33Å
380	S	51.3	Low	72.1	Confident	110 Å²	110	62 Å²	62	77%	0.769	30%	0.303	S	S	*	.			trans	-96.4	-9.8	173.1	60.4	0	0	0	0	113.7
381	H	57.8	Low	74.1	Confident	139 Å²	139	50.4 Å²	50.4	64%	0.644	26%	0.259	S	S	*	.	S	Bend	trans	-71.8	152.6	177.5	-73.8	-74.5	0	0	0	111.7	D383	H381-D383 PolarHBondContact O-N 3.3Å
382	M	55.4	Low	75.9	Confident	105 Å²	105	48.2 Å²	48.2	52%	0.517	25%	0.249	S	C	.	.	S	Bend	trans	-54	-48.4	-173.4	-86.4	-84.2	-70.9	0	0	112.5	S458	M382-S458 VanDerWaalsContact O-CB 3.29Å; M382-S458 WeakPolarHBondContact O-CB 3.2Å; M382-S458 PolarHBondContact O-OG 2.7Å
383	D	71.4	Confident	77.7	Confident	6 Å²	6	51 Å²	51	3%	0.032	25%	0.252	C	S	.	.			trans	-171.4	168.8	169.5	55.4	72.5	0	0	0	110.8	H381 F385 R387 W434 H459	H381-D383 PolarHBondContact O-N 3.3Å; D383-F385 HydrophobicContact CB-CD2 3.57Å; D383-F385 HydrophobicContact CB-CE2 4.05Å; D383-F385 HydrophobicContact CB-CG 4.36Å; D383-F385 PolarHBondContact OD1-N 2.92Å; D383-R387 VanDerWaalsContact O-CZ 3.24Å; D383-R387 PolarHBondContact O-NH1 3.12Å; D383-R387 PolarHBondContact O-NH2 3.08Å; D383-R387 WeakPolarHBondContact OD1-CD 3.5Å; D383-R387 IonicContact OD1-CZ 3.19Å; D383-R387 IonicContact OD1-NE 2.71Å; D383-R387 PolarHBondContact OD1-NE 3.3Å; D383-R387 IonicContact OD1-NH1 2.86Å; D383-R387 PolarHBondContact OD1-NH1 3.17Å; D383-R387 IonicContact OD2-NH1 3.05Å; D383-W434 VanDerWaalsContact OD2-CE2 3.3Å; D383-W434 WeakPolarHBondContact OD2-CZ2 3.46Å; D383-W434 PolarHBondContact OD2-NE1 3.43Å; D383-H459 WeakPolarHBondContact CA-NE2 3.49Å
384	A	83.9	Confident	79.3	Confident	6 Å²	6	47.9 Å²	47.9	5%	0.05	23%	0.232	C	C	.	.			trans	-112.9	17	176.9	0	0	0	0	0	112.4	S368 R369 L376 H459	S368-A384 CarbonylContact C-O 3.56Å; S368-A384 VanDerWaalsContact CA-O 3.25Å; S368-A384 WeakPolarHBondContact CA-O 3.13Å; R369-A384 HydrophobicContact CB-CB 4.19Å; R369-A384 PolarHBondContact N-O 3.39Å; L376-A384 HydrophobicContact CD2-CB 4.18Å; A384-H459 PolarHBondContact N-CE1 3.42Å; A384-H459 PolarHBondContact N-NE2 2.96Å
385	F	92.2	Very high	80.8	Confident	7 Å²	7	48.2 Å²	48.2	3%	0.031	24%	0.235	C	C	.	.	S	Bend	trans	-67.9	160	179	-69.2	-54.4	0	0	0	111.9	D383 R387 V420 V421 A422 P423 Q426 A430 S458 H459	D383-F385 HydrophobicContact CB-CD2 3.57Å; D383-F385 HydrophobicContact CB-CE2 4.05Å; D383-F385 HydrophobicContact CB-CG 4.36Å; D383-F385 PolarHBondContact OD1-N 2.92Å; F385-R387 HydrophobicContact CB-CG 4.48Å; F385-R387 PolarHBondContact O-N 3.4Å; F385-R387 PolarHBondContact O-NE 3.1Å; F385-V420 HydrophobicContact CB-CG1 3.88Å; F385-V420 HydrophobicContact CD2-CG1 4.24Å; F385-V420 HydrophobicContact CG-CG1 4.37Å; F385-V421 WeakPolarHBondContact CB-O 3.41Å; F385-A422 HydrophobicContact CD1-CB 4.02Å; F385-A422 HydrophobicContact CE1-CB 3.8Å; F385-A422 HydrophobicContact CE2-CB 4.34Å; F385-A422 HydrophobicContact CG-CB 4.38Å; F385-A422 HydrophobicContact CZ-CB 3.96Å; F385-P423 HydrophobicContact CE1-CG 4.47Å; F385-Q426 HydrophobicContact CE1-CB 4.22Å; F385-Q426 HydrophobicContact CZ-CB 4.05Å; F385-A430 HydrophobicContact CD2-CB 4.28Å; F385-A430 HydrophobicContact CE2-CB 3.51Å; F385-A430 HydrophobicContact CZ-CB 3.87Å; F385-S458 VanDerWaalsContact CE2-O 3.27Å; F385-S458 WeakPolarHBondContact CE2-O 3.34Å; F385-S458 WeakPolarHBondContact CZ-O 3.1Å; F385-H459 AromaticContact CD1-CE1 3.7Å; F385-H459 AromaticContact CD1-ND1 3.77Å; F385-H459 AromaticContact CD2-CE1 3.65Å; F385-H459 AromaticContact CE1-CE1 3.6Å; F385-H459 AromaticContact CE1-ND1 3.18Å; F385-H459 WeakPolarHBondContact CE1-ND1 3.43Å; F385-H459 AromaticContact CE2-CE1 3.54Å; F385-H459 AromaticContact CE2-ND1 3.44Å; F385-H459 WeakPolarHBondContact CE2-ND1 3.48Å; F385-H459 AromaticContact CG-CE1 3.72Å; F385-H459 AromaticContact CZ-CE1 3.53Å; F385-H459 AromaticContact CZ-ND1 3Å; F385-H459 WeakPolarHBondContact CZ-ND1 3.43Å
386	E	95.2	Very high	81.8	Confident	10 Å²	10	42.3 Å²	42.3	5%	0.047	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	127.8	169.3	-169.1	-172.4	-163.1	0	0	108.9	G345 L346 L347 P348 H365 Q366 V421	G345-E386 PolarHBondContact N-OE2 3.27Å; L346-E386 PolarHBondContact N-OE2 2.98Å; L347-E386 HydrophobicContact CB-CG 4.33Å; L347-E386 HydrophobicContact CD1-CG 3.94Å; L347-E386 HydrophobicContact CG-CG 4.14Å; P348-E386 WeakPolarHBondContact CD-OE1 3.38Å; H365-E386 IonicContact CD2-OE1 3.52Å; H365-E386 IonicContact CE1-OE1 3.36Å; H365-E386 IonicContact NE2-OE1 2.77Å; H365-E386 PolarHBondContact NE2-OE1 3.13Å; Q366-E386 WeakPolarHBondContact O-CA 3.47Å; E386-V421 HydrophobicContact CB-CB 4.31Å; E386-V421 PolarHBondContact O-N 3.47Å
387	R	95.8	Very high	82.1	Confident	28 Å²	28	45.3 Å²	45.3	11%	0.106	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	152.6	-172.7	-67.1	165.6	-67.9	-172.5	7.4	113	L347 H365 Q366 D383 F385 L419 V420 W434	L347-R387 VanDerWaalsContact CD1-CA 3.41Å; H365-R387 CarbonylContact C-O 3.6Å; H365-R387 WeakPolarHBondContact CA-O 3.48Å; Q366-R387 PolarHBondContact N-O 3.04Å; Q366-R387 PolarHBondContact O-N 3.21Å; D383-R387 VanDerWaalsContact O-CZ 3.24Å; D383-R387 PolarHBondContact O-NH1 3.12Å; D383-R387 PolarHBondContact O-NH2 3.08Å; D383-R387 WeakPolarHBondContact OD1-CD 3.5Å; D383-R387 IonicContact OD1-CZ 3.19Å; D383-R387 IonicContact OD1-NE 2.71Å; D383-R387 PolarHBondContact OD1-NE 3.3Å; D383-R387 IonicContact OD1-NH1 2.86Å; D383-R387 PolarHBondContact OD1-NH1 3.17Å; D383-R387 IonicContact OD2-NH1 3.05Å; F385-R387 HydrophobicContact CB-CG 4.48Å; F385-R387 PolarHBondContact O-N 3.4Å; F385-R387 PolarHBondContact O-NE 3.1Å; R387-L419 CarbonylContact C-O 3.5Å; R387-L419 WeakPolarHBondContact CA-O 3.42Å; R387-V420 HydrophobicContact CG-CB 4.26Å; R387-V420 HydrophobicContact CG-CG1 3.96Å; R387-V420 HydrophobicContact CG-CG2 4.05Å; R387-W434 HydrophobicContact CG-CZ2 4.42Å
388	S	97.3	Very high	82.1	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	121	169.4	-72.2	0	0	0	0	110	Q364 L419	Q364-S388 WeakPolarHBondContact O-CA 3.38Å; S388-L419 PolarHBondContact N-O 3.49Å; S388-L419 PolarHBondContact O-N 3.19Å
389	F	97.3	Very high	81.8	Confident	38 Å²	38	49.3 Å²	49.3	17%	0.167	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	111.5	170.4	-57.2	-60.5	0	0	0	108.7	F244 H363 Q364 D418	F244-F389 HydrophobicContact CZ-CB 4.18Å; H363-F389 CarbonylContact C-O 3.09Å; H363-F389 VanDerWaalsContact CA-O 3.27Å; H363-F389 WeakPolarHBondContact CA-O 3.33Å; Q364-F389 PolarHBondContact N-O 3.44Å; Q364-F389 PolarHBondContact O-N 2.81Å; F389-D418 HydrophobicContact CD1-CB 4.44Å; F389-D418 WeakPolarHBondContact CD1-OD1 3.46Å; F389-D418 WeakPolarHBondContact CD1-OD2 3.42Å
390	C	98.3	Very high	81.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	156	-169.8	-56.8	0	0	0	0	113.1	Y362 H363 F392 R416 V417	Y362-C390 CarbonylContact O-C 3.59Å; Y362-C390 VanDerWaalsContact O-CA 3.27Å; Y362-C390 WeakPolarHBondContact O-CA 3.24Å; H363-C390 HydrophobicContact CB-CB 4.44Å; C390-F392 HydrophobicContact CB-CD2 3.64Å; C390-F392 HydrophobicContact CB-CE2 3.45Å; C390-F392 VanDerWaalsContact CB-CE2 3.45Å; C390-R416 WeakPolarHBondContact O-CA 3.28Å; C390-R416 WeakPolarHBondContact O-CD 3.4Å; C390-R416 PolarHBondContact O-NH1 2.99Å; C390-V417 WeakPolarHBondContact CA-O 3.27Å; C390-V417 VanDerWaalsContact CB-O 3.29Å; C390-V417 WeakPolarHBondContact CB-O 3.49Å; C390-V417 PolarHBondContact N-O 2.93Å; C390-V417 PolarHBondContact O-N 3.37Å
391	I	98.6	Very high	81	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	117.4	157.5	-57	174.8	0	0	0	106.4	F244 A278 L286 L361 Y362 A414 V415	F244-I391 HydrophobicContact CD1-CD1 3.95Å; F244-I391 HydrophobicContact CD1-CG1 4.3Å; F244-I391 HydrophobicContact CE1-CD1 4.22Å; F244-I391 HydrophobicContact CE1-CG1 4.24Å; A278-I391 HydrophobicContact CB-CD1 3.93Å; L286-I391 HydrophobicContact CD1-CD1 4.03Å; L286-I391 HydrophobicContact CD1-CG1 4.49Å; L286-I391 HydrophobicContact CD2-CG2 4.32Å; L361-I391 HydrophobicContact CB-CB 4.27Å; L361-I391 HydrophobicContact CB-CG2 4.09Å; L361-I391 WeakPolarHBondContact CB-O 2.97Å; L361-I391 HydrophobicContact CD1-CG2 3.99Å; L361-I391 PolarHBondContact N-O 2.89Å; Y362-I391 HydrophobicContact CD1-CD1 4.45Å; Y362-I391 HydrophobicContact CD1-CG1 4.26Å; Y362-I391 HydrophobicContact CG-CD1 4.37Å; Y362-I391 HydrophobicContact CG-CG1 4.5Å; Y362-I391 PolarHBondContact N-O 3.06Å; Y362-I391 PolarHBondContact O-N 3.47Å; I391-A414 HydrophobicContact CG2-CB 3.75Å; I391-V415 CarbonylContact C-O 3.44Å; I391-V415 WeakPolarHBondContact CA-O 3.42Å
392	F	98.4	Very high	80.4	Confident	2 Å²	2	48 Å²	48	1%	0.009	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	144.9	177.7	-83.5	-127.4	0	0	0	110.5	L298 V302 L354 L359 I360 C390 A414 V415 V417	L298-F392 HydrophobicContact CD2-CB 3.88Å; L298-F392 HydrophobicContact CD2-CD1 3.62Å; L298-F392 HydrophobicContact CD2-CE1 4.41Å; L298-F392 HydrophobicContact CD2-CG 3.99Å; V302-F392 HydrophobicContact CG2-CE1 4.06Å; V302-F392 HydrophobicContact CG2-CZ 4.08Å; L354-F392 HydrophobicContact CD1-CE1 4.05Å; L354-F392 HydrophobicContact CD1-CZ 3.66Å; L354-F392 HydrophobicContact CD2-CE1 4.03Å; L354-F392 HydrophobicContact CD2-CZ 4.48Å; L359-F392 CarbonylContact O-C 3.42Å; L359-F392 WeakPolarHBondContact O-CA 3.32Å; I360-F392 HydrophobicContact CD1-CD1 4.32Å; I360-F392 HydrophobicContact CD1-CD2 3.79Å; I360-F392 HydrophobicContact CD1-CE1 4.13Å; I360-F392 HydrophobicContact CD1-CE2 3.55Å; I360-F392 HydrophobicContact CD1-CG 4.18Å; I360-F392 HydrophobicContact CD1-CZ 3.76Å; C390-F392 HydrophobicContact CB-CD2 3.64Å; C390-F392 HydrophobicContact CB-CE2 3.45Å; C390-F392 VanDerWaalsContact CB-CE2 3.45Å; F392-A414 CarbonylContact O-C 3.54Å; F392-A414 VanDerWaalsContact O-CA 3.29Å; F392-A414 WeakPolarHBondContact O-CA 3.39Å; F392-V415 PolarHBondContact N-O 3.26Å; F392-V415 PolarHBondContact O-N 3.47Å; F392-V417 HydrophobicContact CB-CG2 4.11Å; F392-V417 HydrophobicContact CD1-CG2 4.39Å; F392-V417 HydrophobicContact CD2-CB 3.58Å; F392-V417 HydrophobicContact CD2-CG1 4.34Å; F392-V417 HydrophobicContact CD2-CG2 3.57Å; F392-V417 HydrophobicContact CE2-CB 3.61Å; F392-V417 HydrophobicContact CE2-CG1 3.91Å; F392-V417 HydrophobicContact CE2-CG2 4.01Å; F392-V417 HydrophobicContact CG-CB 4.3Å; F392-V417 HydrophobicContact CG-CG2 3.78Å; F392-V417 HydrophobicContact CZ-CB 4.33Å; F392-V417 HydrophobicContact CZ-CG1 4.2Å
393	R	97.7	Very high	80	Confident	104 Å²	104	46 Å²	46	39%	0.392	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	99.6	163.2	179	178.4	-174.4	-174.3	-2.6	107.6	L359 L361 P395 W412	L359-R393 PolarHBondContact O-N 3.48Å; L361-R393 HydrophobicContact CD1-CB 4.02Å; L361-R393 HydrophobicContact CD2-CB 4.03Å; L361-R393 HydrophobicContact CG-CB 3.86Å; R393-P395 WeakPolarHBondContact O-CD 3.42Å; R393-W412 HydrophobicContact CB-CE3 4.31Å; R393-W412 HydrophobicContact CG-CB 3.86Å; R393-W412 HydrophobicContact CG-CD2 3.63Å; R393-W412 HydrophobicContact CG-CE3 3.69Å; R393-W412 HydrophobicContact CG-CG 3.71Å; R393-W412 HydrophobicContact CG-CZ3 4.47Å
394	L	96.3	Very high	78.6	Confident	10 Å²	10	50 Å²	50	5%	0.052	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	113	178.8	179.4	62.5	0	0	0	110	D294 A297 L298 W412 K413 V415	D294-L394 HydrophobicContact CB-CD2 3.58Å; A297-L394 HydrophobicContact CB-CD1 3.89Å; L298-L394 HydrophobicContact CD1-CD2 4.37Å; L298-L394 HydrophobicContact CD2-CB 4.48Å; L298-L394 HydrophobicContact CD2-CD1 4.06Å; L298-L394 HydrophobicContact CG-CD1 4.09Å; L298-L394 HydrophobicContact CG-CD2 4.27Å; L394-W412 CarbonylContact O-C 3.58Å; L394-W412 WeakPolarHBondContact O-CA 3.06Å; L394-W412 VanDerWaalsContact O-CB 3.28Å; L394-W412 WeakPolarHBondContact O-CB 3.41Å; L394-K413 HydrophobicContact CB-CG 4.41Å; L394-K413 PolarHBondContact N-O 3.01Å; L394-K413 PolarHBondContact O-N 3.46Å; L394-V415 HydrophobicContact CB-CG2 3.97Å; L394-V415 HydrophobicContact CD2-CG2 3.9Å
395	P	93	Very high	76.7	Confident	82 Å²	82	53.7 Å²	53.7	53%	0.532	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	142.7	173.8	-24.7	35.7	0	0	0	111.5	R393 S411	R393-P395 WeakPolarHBondContact O-CD 3.42Å; P395-S411 WeakPolarHBondContact CA-O 3.22Å
396	Q	86.2	Confident	74.3	Confident	41 Å²	41	60.5 Å²	60.5	19%	0.192	41%	0.414	C	S	.	.			trans	-112.7	140.5	175.9	-65.7	-66.6	-80	0	0	109.1	S411 K413	Q396-S411 PolarHBondContact N-O 2.89Å; Q396-K413 HydrophobicContact CG-CB 4.33Å; Q396-K413 HydrophobicContact CG-CD 4.47Å; Q396-K413 HydrophobicContact CG-CG 4.17Å
397	P	73.4	Confident	72	Confident	86 Å²	86	68.6 Å²	68.6	56%	0.558	45%	0.445	S	S	*	.			trans	-62	139.4	177.3	25.2	-32.2	0	0	0	110.1	G399 A400	P397-G399 PolarHBondContact O-N 3.26Å; P397-G399 VanDerWaalsContact O-N 3.09Å; P397-A400 HydrophobicContact CG-CB 4.43Å; P397-A400 PolarHBondContact O-N 2.84Å
398	P	60.2	Low	69.8	Low	141 Å²	141	73.2 Å²	73.2	92%	0.916	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	116.5	175.2	20.1	-26.1	0	0	0	109.6
399	G	55.9	Low	67.8	Low	68 Å²	68	76.6 Å²	76.6	70%	0.701	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	113.3	4.6	176.2	0	0	0	0	0	116.8	P397 A401	P397-G399 PolarHBondContact O-N 3.26Å; P397-G399 VanDerWaalsContact O-N 3.09Å; G399-A401 PolarHBondContact O-N 2.84Å
400	A	51	Low	66.2	Low	41 Å²	41	77.5 Å²	77.5	34%	0.339	52%	0.516	S	S	.	.			trans	-71.9	70	169.9	0	0	0	0	0	111.1	P397 V402 C409	P397-A400 HydrophobicContact CG-CB 4.43Å; P397-A400 PolarHBondContact O-N 2.84Å; A400-V402 PolarHBondContact O-N 3.3Å; A400-C409 PolarHBondContact O-SG 3.48Å
401	A	45.2	Very low	65.5	Low	89 Å²	89	81.5 Å²	81.5	74%	0.736	54%	0.543	S	S	*	.			trans	-79.6	97.1	171.3	0	0	0	0	0	108.3	G399 G403	G399-A401 PolarHBondContact O-N 2.84Å; A401-G403 PolarHBondContact O-N 3.2Å
402	V	46.3	Very low	65.3	Low	143 Å²	143	84.5 Å²	84.5	87%	0.867	56%	0.555	S	S	*	*			trans	-81.9	105.9	165.7	-178.1	0	0	0	0	107.4	A400	A400-V402 PolarHBondContact O-N 3.3Å
403	G	46.9	Very low	65.1	Low	65 Å²	65	85.8 Å²	85.8	67%	0.67	56%	0.56	S	S	*	*	S	Bend	trans	65.7	87.2	162.4	0	0	0	0	0	116.5	A401 S405	A401-G403 PolarHBondContact O-N 3.2Å; G403-S405 PolarHBondContact O-N 3.49Å
404	G	42.3	Very low	65.1	Low	89 Å²	89	81 Å²	81	92%	0.918	54%	0.542	S	S	*	.	S	Bend	trans	60.1	1.1	146.9	0	0	0	0	0	120
405	S	43.5	Very low	65.2	Low	83 Å²	83	80.6 Å²	80.6	58%	0.58	54%	0.541	S	S	*	.			trans	-92.2	119.6	179.6	-170.3	0	0	0	0	111.1	G403 R407	G403-S405 PolarHBondContact O-N 3.49Å; S405-R407 PolarHBondContact O-N 2.75Å
406	T	40.8	Very low	65.5	Low	150 Å²	150	77.7 Å²	77.7	92%	0.92	52%	0.519	S	S	*	.			trans	-72.9	42.4	175.8	41.3	0	0	0	0	113.4
407	R	46.7	Very low	66.1	Low	181 Å²	181	75.7 Å²	75.7	68%	0.683	51%	0.51	S	S	*	.	S	Bend	trans	-109.1	142.7	171.6	-75.9	-175.3	176	176.5	-1	110.2	S405 C409	S405-R407 PolarHBondContact O-N 2.75Å; R407-C409 PolarHBondContact O-N 2.86Å; R407-C409 VanDerWaalsContact O-N 3.11Å
408	P	51.2	Low	67.3	Low	125 Å²	125	72.2 Å²	72.2	81%	0.812	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-53.4	123.2	174.4	-16	25.9	0	0	0	108.6	A410	P408-A410 PolarHBondContact O-N 3.46Å; P408-A410 VanDerWaalsContact O-N 3.13Å
409	C	54.3	Low	69.1	Low	71 Å²	71	65.5 Å²	65.5	48%	0.48	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-58.7	120.4	171.4	-168.2	0	0	0	0	106.5	A400 R407 S411	A400-C409 PolarHBondContact O-SG 3.48Å; R407-C409 PolarHBondContact O-N 2.86Å; R407-C409 VanDerWaalsContact O-N 3.11Å; C409-S411 PolarHBondContact O-N 3.2Å
410	A	63.5	Low	71.1	Confident	57 Å²	57	62.3 Å²	62.3	47%	0.471	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-57.1	134.7	175.5	0	0	0	0	0	107.7	P408 W412	P408-A410 PolarHBondContact O-N 3.46Å; P408-A410 VanDerWaalsContact O-N 3.13Å; A410-W412 WeakPolarHBondContact CB-O 3.48Å; A410-W412 PolarHBondContact O-N 2.72Å
411	S	84.5	Confident	73.3	Confident	83 Å²	83	60.6 Å²	60.6	58%	0.58	40%	0.395	S	S	*	.	S	Bend	trans	-65.4	-1.5	-177.6	54.1	0	0	0	0	113.8	P395 Q396 C409	P395-S411 WeakPolarHBondContact CA-O 3.22Å; Q396-S411 PolarHBondContact N-O 2.89Å; C409-S411 PolarHBondContact O-N 3.2Å
412	W	93.5	Very high	75.8	Confident	64 Å²	64	56.3 Å²	56.3	24%	0.242	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	164.2	178.8	61.1	-84.1	0	0	0	109.5	L361 R393 L394 A410 A414	L361-W412 HydrophobicContact CD1-CE3 4.2Å; L361-W412 HydrophobicContact CD1-CH2 3.9Å; L361-W412 HydrophobicContact CD1-CZ3 3.41Å; L361-W412 VanDerWaalsContact CD1-CZ3 3.41Å; L361-W412 HydrophobicContact CD2-CH2 4.38Å; R393-W412 HydrophobicContact CB-CE3 4.31Å; R393-W412 HydrophobicContact CG-CB 3.86Å; R393-W412 HydrophobicContact CG-CD2 3.63Å; R393-W412 HydrophobicContact CG-CE3 3.69Å; R393-W412 HydrophobicContact CG-CG 3.71Å; R393-W412 HydrophobicContact CG-CZ3 4.47Å; L394-W412 CarbonylContact O-C 3.58Å; L394-W412 WeakPolarHBondContact O-CA 3.06Å; L394-W412 VanDerWaalsContact O-CB 3.28Å; L394-W412 WeakPolarHBondContact O-CB 3.41Å; A410-W412 WeakPolarHBondContact CB-O 3.48Å; A410-W412 PolarHBondContact O-N 2.72Å; W412-A414 HydrophobicContact CZ3-CB 4.09Å
413	K	95.4	Very high	78.2	Confident	29 Å²	29	50.6 Å²	50.6	13%	0.126	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	149.2	168	70.2	-179.4	-179.7	-171.4	0	111.3	D285 D294 L394 Q396 V415	D285-K413 WeakPolarHBondContact OD2-CA 3.39Å; D294-K413 WeakPolarHBondContact OD1-CE 3.29Å; D294-K413 IonicContact OD1-NZ 3.45Å; D294-K413 PolarHBondContact OD1-NZ 2.91Å; D294-K413 WeakPolarHBondContact OD2-CE 3.35Å; D294-K413 IonicContact OD2-NZ 3.67Å; D294-K413 PolarHBondContact OD2-NZ 3.09Å; L394-K413 HydrophobicContact CB-CG 4.41Å; L394-K413 PolarHBondContact N-O 3.01Å; L394-K413 PolarHBondContact O-N 3.46Å; Q396-K413 HydrophobicContact CG-CB 4.33Å; Q396-K413 HydrophobicContact CG-CD 4.47Å; Q396-K413 HydrophobicContact CG-CG 4.17Å; K413-V415 HydrophobicContact CD-CG2 4.35Å; K413-V415 HydrophobicContact CG-CG2 3.93Å
414	A	97.9	Very high	80.5	Confident	2 Å²	2	50.4 Å²	50.4	2%	0.017	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	130.2	172.5	0	0	0	0	0	110.6	H282 D285 L286 L361 I391 F392 W412	H282-A414 HydrophobicContact CB-CB 3.75Å; D285-A414 HydrophobicContact CB-CB 3.73Å; D285-A414 PolarHBondContact OD2-N 3.01Å; L286-A414 HydrophobicContact CD2-CB 4.18Å; L361-A414 HydrophobicContact CD1-CB 3.94Å; I391-A414 HydrophobicContact CG2-CB 3.75Å; F392-A414 CarbonylContact O-C 3.54Å; F392-A414 VanDerWaalsContact O-CA 3.29Å; F392-A414 WeakPolarHBondContact O-CA 3.39Å; W412-A414 HydrophobicContact CZ3-CB 4.09Å
415	V	98.3	Very high	83.1	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.012	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	133.9	176	-176.1	0	0	0	0	110.3	V290 L298 V331 I391 F392 L394 K413 V417	V290-V415 HydrophobicContact CG1-CG1 4.09Å; V290-V415 HydrophobicContact CG2-CG1 3.66Å; L298-V415 HydrophobicContact CD1-CB 4.01Å; L298-V415 HydrophobicContact CD1-CG1 3.55Å; L298-V415 HydrophobicContact CD1-CG2 4.44Å; V331-V415 HydrophobicContact CG2-CG1 4.31Å; I391-V415 CarbonylContact C-O 3.44Å; I391-V415 WeakPolarHBondContact CA-O 3.42Å; F392-V415 PolarHBondContact N-O 3.26Å; F392-V415 PolarHBondContact O-N 3.47Å; L394-V415 HydrophobicContact CB-CG2 3.97Å; L394-V415 HydrophobicContact CD2-CG2 3.9Å; K413-V415 HydrophobicContact CD-CG2 4.35Å; K413-V415 HydrophobicContact CG-CG2 3.93Å; V415-V417 HydrophobicContact CG1-CG2 4.44Å
416	R	98.4	Very high	85.5	Confident	21 Å²	21	46.9 Å²	46.9	8%	0.079	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	129.9	172.8	-84.4	-80.6	-60.8	126.6	4.7	110	F244 L286 D330 V331 C390 D418	F244-R416 VanDerWaalsContact CD2-NE 3.26Å; L286-R416 HydrophobicContact CD1-CG 4.04Å; L286-R416 HydrophobicContact CD2-CB 4.39Å; L286-R416 HydrophobicContact CD2-CG 3.68Å; L286-R416 HydrophobicContact CG-CG 4.41Å; D330-R416 CarbonylContact C-O 3.55Å; D330-R416 VanDerWaalsContact CA-O 3.29Å; D330-R416 WeakPolarHBondContact CA-O 3.29Å; D330-R416 HydrophobicContact CB-CB 3.63Å; V331-R416 PolarHBondContact N-O 3.49Å; C390-R416 WeakPolarHBondContact O-CA 3.28Å; C390-R416 WeakPolarHBondContact O-CD 3.4Å; C390-R416 PolarHBondContact O-NH1 2.99Å; R416-D418 IonicContact CZ-OD1 3.9Å; R416-D418 IonicContact NH1-OD1 2.73Å; R416-D418 PolarHBondContact NH1-OD1 3.42Å; R416-D418 IonicContact NH2-OD1 3.74Å; R416-D418 PolarHBondContact NH2-OD1 3.39Å; R416-D418 IonicContact NH2-OD2 2.75Å; R416-D418 PolarHBondContact NH2-OD2 2.73Å
417	V	98.6	Very high	88.2	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	132.6	177.5	-176.7	0	0	0	0	109	L298 V331 F333 C390 F392 V415 L419	L298-V417 HydrophobicContact CD1-CG2 3.93Å; L298-V417 HydrophobicContact CD2-CG2 4.04Å; L298-V417 HydrophobicContact CG-CG2 4.49Å; V331-V417 HydrophobicContact CB-CG2 4.48Å; V331-V417 CarbonylContact O-C 3.58Å; V331-V417 VanDerWaalsContact O-CA 3.26Å; V331-V417 WeakPolarHBondContact O-CA 3.32Å; F333-V417 HydrophobicContact CD2-CG1 3.76Å; F333-V417 HydrophobicContact CE2-CG1 3.96Å; C390-V417 WeakPolarHBondContact CA-O 3.27Å; C390-V417 VanDerWaalsContact CB-O 3.29Å; C390-V417 WeakPolarHBondContact CB-O 3.49Å; C390-V417 PolarHBondContact N-O 2.93Å; C390-V417 PolarHBondContact O-N 3.37Å; F392-V417 HydrophobicContact CB-CG2 4.11Å; F392-V417 HydrophobicContact CD1-CG2 4.39Å; F392-V417 HydrophobicContact CD2-CB 3.58Å; F392-V417 HydrophobicContact CD2-CG1 4.34Å; F392-V417 HydrophobicContact CD2-CG2 3.57Å; F392-V417 HydrophobicContact CE2-CB 3.61Å; F392-V417 HydrophobicContact CE2-CG1 3.91Å; F392-V417 HydrophobicContact CE2-CG2 4.01Å; F392-V417 HydrophobicContact CG-CB 4.3Å; F392-V417 HydrophobicContact CG-CG2 3.78Å; F392-V417 HydrophobicContact CZ-CB 4.33Å; F392-V417 HydrophobicContact CZ-CG1 4.2Å; V415-V417 HydrophobicContact CG1-CG2 4.44Å; V417-L419 HydrophobicContact CG1-CD2 3.81Å; V417-L419 HydrophobicContact CG1-CG 4.41Å
418	D	98.4	Very high	90.7	Very high	12 Å²	12	32.8 Å²	32.8	6%	0.064	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	122.2	176.5	-72.1	-7.5	0	0	0	109.6	V331 F333 F389 R416 W434	V331-D418 PolarHBondContact O-N 3.01Å; F333-D418 PolarHBondContact N-O 3.04Å; F389-D418 HydrophobicContact CD1-CB 4.44Å; F389-D418 WeakPolarHBondContact CD1-OD1 3.46Å; F389-D418 WeakPolarHBondContact CD1-OD2 3.42Å; R416-D418 IonicContact CZ-OD1 3.9Å; R416-D418 IonicContact NH1-OD1 2.73Å; R416-D418 PolarHBondContact NH1-OD1 3.42Å; R416-D418 IonicContact NH2-OD1 3.74Å; R416-D418 PolarHBondContact NH2-OD1 3.39Å; R416-D418 IonicContact NH2-OD2 2.75Å; R416-D418 PolarHBondContact NH2-OD2 2.73Å; D418-W434 HydrophobicContact CB-CZ3 4.07Å
419	L	98.6	Very high	92.9	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	131.7	178.5	-54.4	-177.9	0	0	0	109	V302 F333 I335 L347 V350 M351 L354 R387 S388 V417	V302-L419 HydrophobicContact CG1-CD2 3.97Å; V302-L419 HydrophobicContact CG2-CD2 4.11Å; F333-L419 HydrophobicContact CB-CD2 3.91Å; F333-L419 HydrophobicContact CD2-CD2 3.85Å; F333-L419 HydrophobicContact CG-CD2 4.35Å; I335-L419 HydrophobicContact CD1-CB 4.39Å; L347-L419 HydrophobicContact CD1-CB 4.49Å; L347-L419 HydrophobicContact CD2-CB 3.9Å; L347-L419 HydrophobicContact CD2-CD1 4.35Å; V350-L419 HydrophobicContact CG1-CD1 4.43Å; M351-L419 HydrophobicContact SD-CD1 4.07Å; L354-L419 HydrophobicContact CD1-CD1 4.46Å; R387-L419 CarbonylContact C-O 3.5Å; R387-L419 WeakPolarHBondContact CA-O 3.42Å; S388-L419 PolarHBondContact N-O 3.49Å; S388-L419 PolarHBondContact O-N 3.19Å; V417-L419 HydrophobicContact CG1-CD2 3.81Å; V417-L419 HydrophobicContact CG1-CG 4.41Å
420	V	98.1	Very high	94.9	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	133.2	-178.6	-173.8	0	0	0	0	108.2	F333 L334 I335 F385 R387 W434	F333-V420 PolarHBondContact O-N 3.46Å; L334-V420 CarbonylContact C-O 3.55Å; L334-V420 HydrophobicContact CD1-CB 3.88Å; L334-V420 HydrophobicContact CD1-CG1 3.77Å; I335-V420 PolarHBondContact N-O 2.93Å; F385-V420 HydrophobicContact CB-CG1 3.88Å; F385-V420 HydrophobicContact CD2-CG1 4.24Å; F385-V420 HydrophobicContact CG-CG1 4.37Å; R387-V420 HydrophobicContact CG-CB 4.26Å; R387-V420 HydrophobicContact CG-CG1 3.96Å; R387-V420 HydrophobicContact CG-CG2 4.05Å; V420-W434 HydrophobicContact CB-CZ2 4.34Å; V420-W434 HydrophobicContact CG1-CZ2 4.21Å; V420-W434 HydrophobicContact CG2-CD2 3.61Å; V420-W434 HydrophobicContact CG2-CE3 3.65Å; V420-W434 HydrophobicContact CG2-CH2 3.24Å; V420-W434 HydrophobicContact CG2-CZ2 3.21Å; V420-W434 HydrophobicContact CG2-CZ3 3.46Å; V420-W434 VanDerWaalsContact CG2-CZ3 3.46Å
421	V	97.9	Very high	96.6	Very high	5 Å²	5	21.9 Å²	21.9	3%	0.03	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	124.7	175	-176.5	0	0	0	0	109.4	I335 E343 L346 L347 F385 E386	I335-V421 HydrophobicContact CB-CG2 4.13Å; I335-V421 HydrophobicContact CD1-CG2 4.43Å; I335-V421 WeakPolarHBondContact O-CA 3.05Å; E343-V421 HydrophobicContact CB-CG1 3.56Å; E343-V421 HydrophobicContact CG-CG1 3.67Å; E343-V421 WeakPolarHBondContact O-CG1 3.25Å; L346-V421 HydrophobicContact CB-CG2 4.35Å; L346-V421 HydrophobicContact CD2-CG2 4.36Å; L347-V421 HydrophobicContact CD1-CG2 4.16Å; L347-V421 HydrophobicContact CD2-CG2 3.5Å; L347-V421 HydrophobicContact CG-CG2 3.51Å; F385-V421 WeakPolarHBondContact CB-O 3.41Å; E386-V421 HydrophobicContact CB-CB 4.31Å; E386-V421 PolarHBondContact O-N 3.47Å
422	A	96.4	Very high	97.3	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.09	C	C	.	.			trans	-124.2	141.4	176.9	0	0	0	0	0	111.1	L334 I335 T336 F385 A430	L334-A422 HydrophobicContact CD1-CB 3.97Å; I335-A422 PolarHBondContact O-N 3.33Å; T336-A422 VanDerWaalsContact CB-O 3.24Å; T336-A422 WeakPolarHBondContact CB-O 3.37Å; T336-A422 PolarHBondContact OG1-O 3.47Å; F385-A422 HydrophobicContact CD1-CB 4.02Å; F385-A422 HydrophobicContact CE1-CB 3.8Å; F385-A422 HydrophobicContact CE2-CB 4.34Å; F385-A422 HydrophobicContact CG-CB 4.38Å; F385-A422 HydrophobicContact CZ-CB 3.96Å; A422-A430 HydrophobicContact CB-CB 3.71Å
423	P	96	Very high	97.4	Very high	22 Å²	22	15.2 Å²	15.2	14%	0.143	8%	0.081	C	C	.	.			trans	-58.3	147.2	168.2	22.6	-29.7	0	0	0	110.7	E340 E343 F385 S425 Q426 F427	E340-P423 VanDerWaalsContact OE1-CB 3.28Å; E340-P423 WeakPolarHBondContact OE1-CB 3.24Å; E343-P423 WeakPolarHBondContact OE1-CA 3.23Å; E343-P423 WeakPolarHBondContact OE1-CB 3.31Å; F385-P423 HydrophobicContact CE1-CG 4.47Å; P423-S425 PolarHBondContact O-N 3.1Å; P423-Q426 HydrophobicContact CG-CB 4Å; P423-Q426 HydrophobicContact CG-CG 3.91Å; P423-Q426 CarbonylContact O-C 3.5Å; P423-Q426 PolarHBondContact O-N 3.35Å; P423-F427 PolarHBondContact O-N 3.13Å
424	I	97.2	Very high	97.5	Very high	61 Å²	61	15 Å²	15	31%	0.313	8%	0.079	S	C	.	.	G	3₁₀ helix	trans	-61.1	-33.4	-175.1	-173.5	64.2	0	0	0	111.8	T336 H337 E340 Q426 F427	T336-I424 HydrophobicContact CG2-CD1 3.9Å; T336-I424 WeakPolarHBondContact OG1-CA 3.46Å; T336-I424 PolarHBondContact OG1-N 2.9Å; H337-I424 WeakPolarHBondContact O-CB 3.3Å; E340-I424 HydrophobicContact CB-CG2 4.17Å; E340-I424 WeakPolarHBondContact OE2-CG2 3.38Å; E340-I424 PolarHBondContact OE2-N 3.32Å; I424-Q426 PolarHBondContact O-N 2.82Å; I424-F427 HydrophobicContact CD1-CB 4.2Å; I424-F427 WeakPolarHBondContact O-CB 3.41Å; I424-F427 PolarHBondContact O-N 3.3Å
425	S	95.1	Very high	97.6	Very high	47 Å²	47	15 Å²	15	33%	0.329	8%	0.079	S	C	.	.	G	3₁₀ helix	trans	-61	-27.3	174.3	67.8	0	0	0	0	114.3	E340 P423	E340-S425 WeakPolarHBondContact OE1-CB 3.31Å; E340-S425 PolarHBondContact OE1-OG 3.13Å; E340-S425 WeakPolarHBondContact OE2-CB 3.23Å; E340-S425 PolarHBondContact OE2-N 3.36Å; E340-S425 PolarHBondContact OE2-OG 2.77Å; P423-S425 PolarHBondContact O-N 3.1Å
426	Q	95.6	Very high	97.5	Very high	51 Å²	51	15.2 Å²	15.2	24%	0.238	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-106.9	-4.7	179.7	-56.9	-174.6	-3.3	0	0	112.9	F385 P423 I424 F429 A430 H459	F385-Q426 HydrophobicContact CE1-CB 4.22Å; F385-Q426 HydrophobicContact CZ-CB 4.05Å; P423-Q426 HydrophobicContact CG-CB 4Å; P423-Q426 HydrophobicContact CG-CG 3.91Å; P423-Q426 CarbonylContact O-C 3.5Å; P423-Q426 PolarHBondContact O-N 3.35Å; I424-Q426 PolarHBondContact O-N 2.82Å; Q426-F429 PolarHBondContact O-N 3.01Å; Q426-A430 PolarHBondContact O-N 3.3Å; Q426-H459 WeakPolarHBondContact CG-O 3.25Å; Q426-H459 PolarHBondContact OE1-ND1 2.91Å
427	F	97.5	Very high	97.5	Very high	30 Å²	30	14.6 Å²	14.6	13%	0.132	8%	0.081	C	C	.	.	H	α-helix	trans	-54.2	-42.7	-174.4	179.8	-93.9	0	0	0	113.5	T316 L334 T336 P423 I424 F429 A430 L431	T316-F427 HydrophobicContact CG2-CZ 4.46Å; L334-F427 HydrophobicContact CB-CE2 4.37Å; L334-F427 HydrophobicContact CD2-CD2 3.59Å; L334-F427 HydrophobicContact CD2-CE2 3.41Å; L334-F427 VanDerWaalsContact CD2-CE2 3.41Å; L334-F427 HydrophobicContact CD2-CG 4.38Å; L334-F427 HydrophobicContact CD2-CZ 4.03Å; L334-F427 HydrophobicContact CG-CD2 3.91Å; L334-F427 HydrophobicContact CG-CE2 3.6Å; T336-F427 HydrophobicContact CG2-CD2 3.41Å; T336-F427 VanDerWaalsContact CG2-CD2 3.41Å; T336-F427 HydrophobicContact CG2-CE2 3.6Å; T336-F427 HydrophobicContact CG2-CG 3.99Å; T336-F427 HydrophobicContact CG2-CZ 4.36Å; P423-F427 PolarHBondContact O-N 3.13Å; I424-F427 HydrophobicContact CD1-CB 4.2Å; I424-F427 WeakPolarHBondContact O-CB 3.41Å; I424-F427 PolarHBondContact O-N 3.3Å; F427-F429 VanDerWaalsContact C-N 3.31Å; F427-F429 PolarHBondContact O-N 3.47Å; F427-A430 PolarHBondContact O-N 3.22Å; F427-L431 HydrophobicContact CE1-CB 4.4Å; F427-L431 HydrophobicContact CE1-CD2 3.97Å; F427-L431 HydrophobicContact CZ-CD2 4.47Å; F427-L431 VanDerWaalsContact O-CB 3.25Å; F427-L431 WeakPolarHBondContact O-CB 3.44Å; F427-L431 PolarHBondContact O-N 2.59Å
428	P	98.3	Very high	97.4	Very high	5 Å²	5	22.6 Å²	22.6	3%	0.032	12%	0.116	C	C	.	.	H	α-helix	trans	-62.4	-35.4	177.8	-25	36.4	0	0	0	113.8	L432 V472 I478	P428-L432 VanDerWaalsContact O-CB 3.28Å; P428-L432 WeakPolarHBondContact O-CB 3.49Å; P428-L432 PolarHBondContact O-N 3.21Å; P428-V472 HydrophobicContact CB-CG2 3.89Å; P428-V472 HydrophobicContact CG-CG2 4.1Å; P428-I478 HydrophobicContact CB-CD1 4.19Å
429	F	97.4	Very high	97.4	Very high	7 Å²	7	22.8 Å²	22.8	3%	0.031	12%	0.116	C	C	.	.	H	α-helix	trans	-72.2	-41.1	176.4	-59.5	-72.8	0	0	0	111.7	Q426 F427 L432 G433 L456 S458 L461 V472 I478	Q426-F429 PolarHBondContact O-N 3.01Å; F427-F429 VanDerWaalsContact C-N 3.31Å; F427-F429 PolarHBondContact O-N 3.47Å; F429-L432 PolarHBondContact O-N 2.69Å; F429-G433 PolarHBondContact O-N 3.42Å; F429-L456 HydrophobicContact CD1-CD1 3.98Å; F429-L456 HydrophobicContact CE1-CD1 4.23Å; F429-S458 CarbonylContact C-O 3.54Å; F429-S458 VanDerWaalsContact C-O 3.25Å; F429-S458 VanDerWaalsContact CB-O 3.32Å; F429-S458 WeakPolarHBondContact CB-O 3.27Å; F429-L461 HydrophobicContact CE1-CB 3.67Å; F429-L461 HydrophobicContact CZ-CB 4.06Å; F429-V472 HydrophobicContact CD2-CG2 3.9Å; F429-V472 HydrophobicContact CE1-CG1 4.44Å; F429-V472 HydrophobicContact CE1-CG2 3.92Å; F429-V472 HydrophobicContact CE2-CG2 3.24Å; F429-V472 HydrophobicContact CG-CG2 4.5Å; F429-V472 HydrophobicContact CZ-CB 4.22Å; F429-V472 HydrophobicContact CZ-CG1 3.9Å; F429-V472 HydrophobicContact CZ-CG2 3.25Å; F429-I478 HydrophobicContact CD1-CD1 3.47Å; F429-I478 VanDerWaalsContact CD1-CD1 3.47Å; F429-I478 HydrophobicContact CD1-CG1 4Å; F429-I478 HydrophobicContact CE1-CD1 3.77Å; F429-I478 HydrophobicContact CE1-CG1 3.73Å; F429-I478 HydrophobicContact CE1-CG2 4.38Å; F429-I478 HydrophobicContact CG-CD1 4.14Å; F429-I478 HydrophobicContact CZ-CG1 4.48Å
430	A	97	Very high	97.4	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-62.8	-46.8	175.7	0	0	0	0	0	110.4	L334 F385 A422 Q426 F427 L432 G433 W434 S458	L334-A430 HydrophobicContact CD1-CB 3.91Å; L334-A430 HydrophobicContact CD2-CB 3.83Å; F385-A430 HydrophobicContact CD2-CB 4.28Å; F385-A430 HydrophobicContact CE2-CB 3.51Å; F385-A430 HydrophobicContact CZ-CB 3.87Å; A422-A430 HydrophobicContact CB-CB 3.71Å; Q426-A430 PolarHBondContact O-N 3.3Å; F427-A430 PolarHBondContact O-N 3.22Å; A430-L432 PolarHBondContact O-N 3.32Å; A430-G433 PolarHBondContact O-N 2.73Å; A430-W434 WeakPolarHBondContact O-CB 3.38Å; A430-W434 VanDerWaalsContact O-CD1 3.3Å; A430-W434 PolarHBondContact O-N 3.32Å; A430-S458 WeakPolarHBondContact CA-O 3.42Å; A430-S458 PolarHBondContact N-O 3.19Å; A430-S458 VanDerWaalsContact N-O 3.09Å
431	L	98.6	Very high	97.4	Very high	18 Å²	18	23.2 Å²	23.2	9%	0.094	12%	0.118	C	C	.	.	H	α-helix	trans	-59.3	-48.4	177.4	-177.5	61	0	0	0	110.7	T316 L334 F427 G433 T435 E475	T316-L431 HydrophobicContact CG2-CD1 3.83Å; L334-L431 HydrophobicContact CD2-CB 3.79Å; L334-L431 HydrophobicContact CD2-CD1 4.28Å; L334-L431 VanDerWaalsContact CD2-N 3.35Å; F427-L431 HydrophobicContact CE1-CB 4.4Å; F427-L431 HydrophobicContact CE1-CD2 3.97Å; F427-L431 HydrophobicContact CZ-CD2 4.47Å; F427-L431 VanDerWaalsContact O-CB 3.25Å; F427-L431 WeakPolarHBondContact O-CB 3.44Å; F427-L431 PolarHBondContact O-N 2.59Å; L431-G433 PolarHBondContact O-N 3.42Å; L431-T435 WeakPolarHBondContact O-CB 3.41Å; L431-T435 PolarHBondContact O-N 2.99Å; L431-T435 PolarHBondContact O-OG1 3.02Å; L431-E475 HydrophobicContact CD2-CG 4.36Å
432	L	98.4	Very high	97.3	Very high	2 Å²	2	27 Å²	27	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-57.2	-50.6	176.1	177.3	61.2	0	0	0	111.5	P428 F429 A430 T435 Q441 L444 E475 I478 F479	P428-L432 VanDerWaalsContact O-CB 3.28Å; P428-L432 WeakPolarHBondContact O-CB 3.49Å; P428-L432 PolarHBondContact O-N 3.21Å; F429-L432 PolarHBondContact O-N 2.69Å; A430-L432 PolarHBondContact O-N 3.32Å; L432-T435 PolarHBondContact O-N 3.14Å; L432-Q441 PolarHBondContact O-NE2 3.48Å; L432-L444 HydrophobicContact CD1-CD2 4.16Å; L432-L444 HydrophobicContact CD2-CD2 3.79Å; L432-L444 HydrophobicContact CG-CD2 4.2Å; L432-E475 WeakPolarHBondContact CA-OE1 3.45Å; L432-E475 HydrophobicContact CB-CG 4.33Å; L432-I478 HydrophobicContact CB-CD1 4.31Å; L432-I478 HydrophobicContact CD2-CB 4.3Å; L432-I478 HydrophobicContact CD2-CD1 3.68Å; L432-I478 HydrophobicContact CD2-CG2 3.8Å; L432-F479 HydrophobicContact CD1-CE2 4.03Å
433	G	96.9	Very high	97.4	Very high	4 Å²	4	27.1 Å²	27.1	4%	0.041	13%	0.133	C	C	.	.	H	α-helix	trans	-59.8	-51.3	-178.9	0	0	0	0	0	113	F429 A430 L431 T435 G436	F429-G433 PolarHBondContact O-N 3.42Å; A430-G433 PolarHBondContact O-N 2.73Å; L431-G433 PolarHBondContact O-N 3.42Å; G433-T435 VanDerWaalsContact C-N 3.32Å; G433-T435 PolarHBondContact O-N 2.87Å; G433-G436 PolarHBondContact O-N 3.08Å
434	W	97.6	Very high	97.5	Very high	26 Å²	26	26.1 Å²	26.1	10%	0.098	13%	0.126	C	C	.	.	H	α-helix	trans	-73.8	-22.9	-178.2	-78.6	78.1	0	0	0	113	T318 G319 D332 D383 R387 D418 V420 A430 G436	T318-W434 HydrophobicContact CG2-CB 4.18Å; T318-W434 WeakPolarHBondContact OG1-CB 3.38Å; T318-W434 PolarHBondContact OG1-O 3.33Å; T318-W434 VanDerWaalsContact OG1-O 3.04Å; G319-W434 VanDerWaalsContact CA-O 3.29Å; G319-W434 WeakPolarHBondContact CA-O 3.47Å; G319-W434 PolarHBondContact N-O 3.48Å; G319-W434 VanDerWaalsContact N-O 3.14Å; D332-W434 HydrophobicContact CB-CE3 4.25Å; D383-W434 VanDerWaalsContact OD2-CE2 3.3Å; D383-W434 WeakPolarHBondContact OD2-CZ2 3.46Å; D383-W434 PolarHBondContact OD2-NE1 3.43Å; R387-W434 HydrophobicContact CG-CZ2 4.42Å; D418-W434 HydrophobicContact CB-CZ3 4.07Å; V420-W434 HydrophobicContact CB-CZ2 4.34Å; V420-W434 HydrophobicContact CG1-CZ2 4.21Å; V420-W434 HydrophobicContact CG2-CD2 3.61Å; V420-W434 HydrophobicContact CG2-CE3 3.65Å; V420-W434 HydrophobicContact CG2-CH2 3.24Å; V420-W434 HydrophobicContact CG2-CZ2 3.21Å; V420-W434 HydrophobicContact CG2-CZ3 3.46Å; V420-W434 VanDerWaalsContact CG2-CZ3 3.46Å; A430-W434 WeakPolarHBondContact O-CB 3.38Å; A430-W434 VanDerWaalsContact O-CD1 3.3Å; A430-W434 PolarHBondContact O-N 3.32Å; W434-G436 VanDerWaalsContact C-N 3.28Å; W434-G436 PolarHBondContact O-N 3.36Å
435	T	98.5	Very high	97.5	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-67	-30.9	174.1	-64.5	0	0	0	0	111.9	T318 R322 R323 L431 L432 G433 P489	T318-T435 PolarHBondContact OG1-N 3.26Å; R322-T435 WeakPolarHBondContact CD-OG1 3.45Å; R322-T435 HydrophobicContact CG-CG2 4.4Å; R322-T435 PolarHBondContact NH1-OG1 3.14Å; R323-T435 WeakPolarHBondContact CD-O 3.19Å; R323-T435 HydrophobicContact CG-CG2 3.83Å; R323-T435 WeakPolarHBondContact CG-O 3.32Å; R323-T435 PolarHBondContact NH1-O 2.98Å; L431-T435 WeakPolarHBondContact O-CB 3.41Å; L431-T435 PolarHBondContact O-N 2.99Å; L431-T435 PolarHBondContact O-OG1 3.02Å; L432-T435 PolarHBondContact O-N 3.14Å; G433-T435 VanDerWaalsContact C-N 3.32Å; G433-T435 PolarHBondContact O-N 2.87Å; T435-P489 HydrophobicContact CG2-CB 3.93Å; T435-P489 HydrophobicContact CG2-CG 4.44Å
436	G	96.9	Very high	97.6	Very high	7 Å²	7	26.4 Å²	26.4	7%	0.072	12%	0.116	C	C	.	.			trans	67.5	-155.4	-179.3	0	0	0	0	0	114.1	G433 W434	G433-G436 PolarHBondContact O-N 3.08Å; W434-G436 VanDerWaalsContact C-N 3.28Å; W434-G436 PolarHBondContact O-N 3.36Å
437	S	97.8	Very high	97.8	Very high	9 Å²	9	24.4 Å²	24.4	6%	0.063	11%	0.106	C	C	.	.			cis	-62.4	167.6	-5.1	84.3	0	0	0	0	112.9	L439 F440 Q441 R492 A494	S437-L439 VanDerWaalsContact C-N 3.27Å; S437-L439 PolarHBondContact O-N 3.24Å; S437-L439 PolarHBondContact OG-N 2.91Å; S437-F440 WeakPolarHBondContact O-CB 3.38Å; S437-F440 PolarHBondContact O-N 2.95Å; S437-F440 PolarHBondContact OG-N 3.21Å; S437-F440 VanDerWaalsContact OG-N 3.12Å; S437-Q441 WeakPolarHBondContact O-CG 3.39Å; S437-Q441 PolarHBondContact O-N 2.79Å; S437-R492 VanDerWaalsContact CB-O 3.3Å; S437-R492 WeakPolarHBondContact CB-O 3.34Å; S437-R492 PolarHBondContact N-O 2.83Å; S437-R492 VanDerWaalsContact N-O 3.1Å; S437-A494 PolarHBondContact OG-O 3.41Å
438	K	96.8	Very high	97.8	Very high	168 Å²	168	23 Å²	23	73%	0.73	10%	0.1	S	C	*	.	H	α-helix	trans	-54.4	-44.2	176	-179.3	179.7	179.2	-179.4	0	111.6	R442	K438-R442 VanDerWaalsContact O-CG 3.29Å; K438-R442 WeakPolarHBondContact O-CG 3.45Å; K438-R442 PolarHBondContact O-N 3.24Å; K438-R442 VanDerWaalsContact O-N 3.15Å
439	L	98.1	Very high	97.7	Very high	15 Å²	15	28.6 Å²	28.6	8%	0.079	12%	0.121	C	C	.	.	H	α-helix	trans	-71.5	-40	178.6	-177.5	64.1	0	0	0	111.6	L177 C180 R181 S184 S437 Q441 R442 E443 A494	L177-L439 HydrophobicContact CD1-CD1 4Å; C180-L439 HydrophobicContact CB-CD1 4.28Å; C180-L439 HydrophobicContact CB-CD2 4.22Å; C180-L439 WeakPolarHBondContact O-CD2 3.49Å; R181-L439 HydrophobicContact CG-CD1 4.29Å; S184-L439 WeakPolarHBondContact OG-CD2 3.21Å; S437-L439 VanDerWaalsContact C-N 3.27Å; S437-L439 PolarHBondContact O-N 3.24Å; S437-L439 PolarHBondContact OG-N 2.91Å; L439-Q441 VanDerWaalsContact C-N 3.34Å; L439-Q441 PolarHBondContact O-N 3.15Å; L439-R442 PolarHBondContact O-N 3.13Å; L439-E443 HydrophobicContact CD1-CG 4.07Å; L439-E443 HydrophobicContact CG-CG 4.33Å; L439-E443 WeakPolarHBondContact O-CB 3.44Å; L439-E443 WeakPolarHBondContact O-CG 3.31Å; L439-E443 PolarHBondContact O-N 3.3Å; L439-A494 HydrophobicContact CB-CB 4.47Å; L439-A494 HydrophobicContact CD2-CB 4.4Å
440	F	98.6	Very high	97.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-54.9	-49.7	175.3	-174.2	-89.9	0	0	0	111.3	C143 S437 R442 E443 L444 F479 L487 R492 A494	C143-F440 HydrophobicContact CB-CE2 4.17Å; C143-F440 HydrophobicContact CB-CZ 4.09Å; S437-F440 WeakPolarHBondContact O-CB 3.38Å; S437-F440 PolarHBondContact O-N 2.95Å; S437-F440 PolarHBondContact OG-N 3.21Å; S437-F440 VanDerWaalsContact OG-N 3.12Å; F440-R442 PolarHBondContact O-N 3.32Å; F440-E443 PolarHBondContact O-N 2.89Å; F440-L444 HydrophobicContact CE1-CD2 4.11Å; F440-L444 VanDerWaalsContact O-CB 3.3Å; F440-L444 WeakPolarHBondContact O-CB 3.4Å; F440-L444 PolarHBondContact O-N 2.91Å; F440-F479 HydrophobicContact CE1-CZ 4.2Å; F440-F479 HydrophobicContact CZ-CE1 4.18Å; F440-F479 AromaticContact CZ-CZ 3.81Å; F440-F479 HydrophobicContact CZ-CZ 3.81Å; F440-L487 HydrophobicContact CE2-CD1 3.81Å; F440-L487 HydrophobicContact CZ-CD1 4.29Å; F440-R492 HydrophobicContact CB-CB 4.5Å; F440-R492 HydrophobicContact CD1-CB 4.2Å; F440-R492 HydrophobicContact CD1-CG 4.3Å; F440-R492 HydrophobicContact CD2-CB 3.83Å; F440-R492 HydrophobicContact CD2-CG 4.09Å; F440-R492 HydrophobicContact CE1-CB 4.42Å; F440-R492 HydrophobicContact CE1-CG 4.02Å; F440-R492 HydrophobicContact CE2-CB 4.05Å; F440-R492 HydrophobicContact CE2-CG 3.76Å; F440-R492 HydrophobicContact CG-CB 3.91Å; F440-R492 HydrophobicContact CG-CG 4.35Å; F440-R492 HydrophobicContact CZ-CB 4.36Å; F440-R492 HydrophobicContact CZ-CG 3.75Å; F440-A494 HydrophobicContact CB-CB 4.21Å
441	Q	98.1	Very high	97.6	Very high	11 Å²	11	40.5 Å²	40.5	5%	0.051	17%	0.174	C	C	.	.	H	α-helix	trans	-64.1	-41	178.7	-69.5	-59	-41.8	0	0	112.6	L432 S437 L439 E443 L444 R445	L432-Q441 PolarHBondContact O-NE2 3.48Å; S437-Q441 WeakPolarHBondContact O-CG 3.39Å; S437-Q441 PolarHBondContact O-N 2.79Å; L439-Q441 VanDerWaalsContact C-N 3.34Å; L439-Q441 PolarHBondContact O-N 3.15Å; Q441-E443 VanDerWaalsContact C-N 3.35Å; Q441-E443 PolarHBondContact O-N 3.32Å; Q441-L444 PolarHBondContact O-N 3.22Å; Q441-R445 WeakPolarHBondContact O-CB 3.29Å; Q441-R445 VanDerWaalsContact O-CG 3.25Å; Q441-R445 WeakPolarHBondContact O-CG 3.3Å; Q441-R445 PolarHBondContact O-N 3.48Å
442	R	96.9	Very high	97.6	Very high	85 Å²	85	43.9 Å²	43.9	32%	0.321	19%	0.188	S	C	.	.	H	α-helix	trans	-59.6	-46.2	174.7	-73.8	176.7	79.2	171.4	11.5	111.5	K438 L439 F440 R446	K438-R442 VanDerWaalsContact O-CG 3.29Å; K438-R442 WeakPolarHBondContact O-CG 3.45Å; K438-R442 PolarHBondContact O-N 3.24Å; K438-R442 VanDerWaalsContact O-N 3.15Å; L439-R442 PolarHBondContact O-N 3.13Å; F440-R442 PolarHBondContact O-N 3.32Å; R442-R446 VanDerWaalsContact O-CB 3.27Å; R442-R446 WeakPolarHBondContact O-CB 3.26Å; R442-R446 PolarHBondContact O-N 2.9Å
443	E	98.3	Very high	97.4	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-73.7	-32.8	-178.6	-70.2	-67.4	109.4	0	0	112.5	A142 R181 L439 F440 Q441 R446 F447	A142-E443 HydrophobicContact CB-CB 3.79Å; A142-E443 HydrophobicContact CB-CG 3.89Å; R181-E443 IonicContact CZ-OE1 3.61Å; R181-E443 IonicContact NE-OE1 3.02Å; R181-E443 PolarHBondContact NE-OE1 3.24Å; R181-E443 IonicContact NE-OE2 3.32Å; R181-E443 IonicContact NH2-OE1 3.88Å; R181-E443 PolarHBondContact NH2-OE1 2.83Å; L439-E443 HydrophobicContact CD1-CG 4.07Å; L439-E443 HydrophobicContact CG-CG 4.33Å; L439-E443 WeakPolarHBondContact O-CB 3.44Å; L439-E443 WeakPolarHBondContact O-CG 3.31Å; L439-E443 PolarHBondContact O-N 3.3Å; F440-E443 PolarHBondContact O-N 2.89Å; Q441-E443 VanDerWaalsContact C-N 3.35Å; Q441-E443 PolarHBondContact O-N 3.32Å; E443-R446 PolarHBondContact O-N 3.23Å; E443-R446 IonicContact OE1-CZ 2.75Å; E443-R446 IonicContact OE1-NE 3.02Å; E443-R446 PolarHBondContact OE1-NE 2.88Å; E443-R446 IonicContact OE1-NH2 3.7Å; E443-R446 IonicContact OE2-CZ 3.33Å; E443-R446 IonicContact OE2-NE 3.14Å; E443-R446 PolarHBondContact OE2-NE 3.45Å; E443-R446 IonicContact OE2-NH2 2.74Å; E443-R446 PolarHBondContact OE2-NH2 3.39Å; E443-F447 VanDerWaalsContact O-CB 3.27Å; E443-F447 WeakPolarHBondContact O-CB 3.31Å; E443-F447 PolarHBondContact O-N 3.34Å
444	L	98.4	Very high	97.4	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-64.8	-47.4	173.4	-176.7	64.8	0	0	0	111.6	C143 L432 F440 Q441 R446 F447 S448 L456 L482 L484	C143-L444 HydrophobicContact CB-CB 3.97Å; C143-L444 HydrophobicContact CB-CD1 3.57Å; C143-L444 HydrophobicContact CB-CG 4.36Å; L432-L444 HydrophobicContact CD1-CD2 4.16Å; L432-L444 HydrophobicContact CD2-CD2 3.79Å; L432-L444 HydrophobicContact CG-CD2 4.2Å; F440-L444 HydrophobicContact CE1-CD2 4.11Å; F440-L444 VanDerWaalsContact O-CB 3.3Å; F440-L444 WeakPolarHBondContact O-CB 3.4Å; F440-L444 PolarHBondContact O-N 2.91Å; Q441-L444 PolarHBondContact O-N 3.22Å; L444-R446 VanDerWaalsContact C-N 3.32Å; L444-R446 PolarHBondContact O-N 2.84Å; L444-F447 PolarHBondContact O-N 3.29Å; L444-S448 WeakPolarHBondContact O-CB 3.42Å; L444-S448 PolarHBondContact O-N 3.17Å; L444-L456 HydrophobicContact CD2-CD2 3.61Å; L444-L456 HydrophobicContact CG-CD2 3.61Å; L444-L482 HydrophobicContact CD1-CD1 3.7Å; L444-L482 HydrophobicContact CG-CD1 4.31Å; L444-L484 HydrophobicContact CD1-CD1 3.53Å
445	R	97.5	Very high	97.3	Very high	54 Å²	54	47 Å²	47	20%	0.204	21%	0.21	C	C	.	.	H	α-helix	trans	-65.4	-37.5	176	-64.8	174.5	-168.4	-176	-1.3	111.5	Q441 R449 L456 S458	Q441-R445 WeakPolarHBondContact O-CB 3.29Å; Q441-R445 VanDerWaalsContact O-CG 3.25Å; Q441-R445 WeakPolarHBondContact O-CG 3.3Å; Q441-R445 PolarHBondContact O-N 3.48Å; R445-R449 WeakPolarHBondContact O-CB 3.36Å; R445-R449 PolarHBondContact O-N 3.04Å; R445-L456 HydrophobicContact CG-CB 4.39Å; R445-L456 HydrophobicContact CG-CD2 4.3Å; R445-L456 HydrophobicContact CG-CG 4.4Å; R445-L456 WeakPolarHBondContact CG-O 3.36Å; R445-S458 PolarHBondContact NH2-OG 3.31Å
446	R	97.1	Very high	97.1	Very high	60 Å²	60	47.8 Å²	47.8	23%	0.226	21%	0.213	C	C	.	.	H	α-helix	trans	-62.1	-47.3	173.6	-169.6	178.4	71.7	83.4	-3.9	111.1	Y141 R181 R442 E443 L444 R449 K450	Y141-R446 HydrophobicContact CE1-CB 4.26Å; Y141-R446 HydrophobicContact CE1-CG 3.99Å; Y141-R446 PolarHBondContact OH-NH1 3.44Å; R181-R446 VanDerWaalsContact NH2-CD 3.26Å; R442-R446 VanDerWaalsContact O-CB 3.27Å; R442-R446 WeakPolarHBondContact O-CB 3.26Å; R442-R446 PolarHBondContact O-N 2.9Å; E443-R446 PolarHBondContact O-N 3.23Å; E443-R446 IonicContact OE1-CZ 2.75Å; E443-R446 IonicContact OE1-NE 3.02Å; E443-R446 PolarHBondContact OE1-NE 2.88Å; E443-R446 IonicContact OE1-NH2 3.7Å; E443-R446 IonicContact OE2-CZ 3.33Å; E443-R446 IonicContact OE2-NE 3.14Å; E443-R446 PolarHBondContact OE2-NE 3.45Å; E443-R446 IonicContact OE2-NH2 2.74Å; E443-R446 PolarHBondContact OE2-NH2 3.39Å; L444-R446 VanDerWaalsContact C-N 3.32Å; L444-R446 PolarHBondContact O-N 2.84Å; R446-R449 PolarHBondContact O-N 2.75Å; R446-K450 HydrophobicContact CG-CG 4.26Å; R446-K450 VanDerWaalsContact O-CB 3.24Å; R446-K450 WeakPolarHBondContact O-CB 3.46Å; R446-K450 VanDerWaalsContact O-CG 3.29Å; R446-K450 WeakPolarHBondContact O-CG 3.44Å; R446-K450 PolarHBondContact O-N 3.02Å
447	F	98.4	Very high	96.9	Very high	9 Å²	9	48 Å²	48	4%	0.039	21%	0.213	C	C	.	.	H	α-helix	trans	-60.2	-52.7	176.9	177	-92.9	0	0	0	111.1	Y141 C143 Q144 E443 L444 R449 K450 E451 K452 L482 L484	Y141-F447 HydrophobicContact CD1-CB 3.55Å; Y141-F447 HydrophobicContact CD1-CD2 4.13Å; Y141-F447 HydrophobicContact CD1-CG 4.35Å; Y141-F447 AromaticContact CD2-CD2 3.8Å; Y141-F447 HydrophobicContact CD2-CD2 3.8Å; Y141-F447 VanDerWaalsContact CE1-CA 3.46Å; Y141-F447 HydrophobicContact CE1-CB 3.81Å; Y141-F447 HydrophobicContact CE1-CD2 4.34Å; Y141-F447 HydrophobicContact CE2-CD2 4.08Å; Y141-F447 HydrophobicContact CG-CB 4.04Å; Y141-F447 AromaticContact CG-CD2 3.84Å; Y141-F447 HydrophobicContact CG-CD2 3.84Å; Y141-F447 HydrophobicContact CG-CG 4.42Å; C143-F447 VanDerWaalsContact SG-CB 3.56Å; Q144-F447 HydrophobicContact CG-CE2 4.34Å; E443-F447 VanDerWaalsContact O-CB 3.27Å; E443-F447 WeakPolarHBondContact O-CB 3.31Å; E443-F447 PolarHBondContact O-N 3.34Å; L444-F447 PolarHBondContact O-N 3.29Å; F447-R449 VanDerWaalsContact C-N 3.28Å; F447-R449 PolarHBondContact O-N 3.33Å; F447-K450 PolarHBondContact O-N 3.05Å; F447-E451 HydrophobicContact CD2-CB 3.88Å; F447-E451 HydrophobicContact CD2-CG 3.47Å; F447-E451 VanDerWaalsContact CD2-CG 3.47Å; F447-E451 HydrophobicContact CE2-CB 3.7Å; F447-E451 HydrophobicContact CE2-CG 3.62Å; F447-E451 HydrophobicContact CG-CB 4.36Å; F447-E451 HydrophobicContact CG-CG 4.2Å; F447-E451 HydrophobicContact CZ-CB 4.04Å; F447-E451 HydrophobicContact CZ-CG 4.45Å; F447-E451 WeakPolarHBondContact O-CB 3.3Å; F447-E451 PolarHBondContact O-N 3.35Å; F447-K452 HydrophobicContact CD1-CG 4.44Å; F447-K452 HydrophobicContact CE1-CD 4.47Å; F447-K452 HydrophobicContact CE1-CG 3.87Å; F447-K452 HydrophobicContact CZ-CG 4.45Å; F447-L482 HydrophobicContact CE1-CB 4.45Å; F447-L482 WeakPolarHBondContact CE1-O 3.37Å; F447-L484 HydrophobicContact CD1-CD1 3.83Å; F447-L484 HydrophobicContact CD1-CD2 4.13Å; F447-L484 HydrophobicContact CD1-CG 4.15Å; F447-L484 HydrophobicContact CE1-CD1 3.84Å; F447-L484 HydrophobicContact CE1-CD2 3.58Å; F447-L484 HydrophobicContact CE1-CG 3.63Å; F447-L484 HydrophobicContact CE2-CD2 4.14Å; F447-L484 HydrophobicContact CZ-CD2 3.59Å; F447-L484 HydrophobicContact CZ-CG 4.12Å
448	S	98.1	Very high	96.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-49.9	-50	177.1	179.5	0	0	0	0	111.4	L444 K452 G453 L454 L482	L444-S448 WeakPolarHBondContact O-CB 3.42Å; L444-S448 PolarHBondContact O-N 3.17Å; S448-K452 CarbonylContact O-C 3.57Å; S448-K452 WeakPolarHBondContact O-CA 3.39Å; S448-K452 VanDerWaalsContact O-CB 3.31Å; S448-K452 WeakPolarHBondContact O-CB 3.43Å; S448-K452 PolarHBondContact O-N 3.06Å; S448-G453 PolarHBondContact O-N 3.45Å; S448-G453 VanDerWaalsContact O-N 3.09Å; S448-L454 CarbonylContact C-O 3.58Å; S448-L454 PolarHBondContact O-N 3.06Å; S448-L454 PolarHBondContact OG-O 3.22Å; S448-L482 WeakPolarHBondContact OG-CD2 3.41Å
449	R	95.7	Very high	96.3	Very high	124 Å²	124	40.1 Å²	40.1	47%	0.468	18%	0.178	S	C	.	.	H	α-helix	trans	-72	-40.8	-177.7	-174.7	175.8	-71.2	-104.2	-0.8	113.2	R445 R446 F447 G453 L454	R445-R449 WeakPolarHBondContact O-CB 3.36Å; R445-R449 PolarHBondContact O-N 3.04Å; R446-R449 PolarHBondContact O-N 2.75Å; F447-R449 VanDerWaalsContact C-N 3.28Å; F447-R449 PolarHBondContact O-N 3.33Å; R449-G453 PolarHBondContact O-N 2.92Å; R449-L454 VanDerWaalsContact CA-O 3.31Å; R449-L454 WeakPolarHBondContact CA-O 3.21Å; R449-L454 PolarHBondContact N-O 3.29Å
450	K	96.4	Very high	96.1	Very high	150 Å²	150	39.5 Å²	39.5	65%	0.652	18%	0.175	S	C	*	.	H	α-helix	trans	-87.1	-38.9	-170.8	-68.2	-65.2	-175.5	178.5	0	113.6	R446 F447	R446-K450 HydrophobicContact CG-CG 4.26Å; R446-K450 VanDerWaalsContact O-CB 3.24Å; R446-K450 WeakPolarHBondContact O-CB 3.46Å; R446-K450 VanDerWaalsContact O-CG 3.29Å; R446-K450 WeakPolarHBondContact O-CG 3.44Å; R446-K450 PolarHBondContact O-N 3.02Å; F447-K450 PolarHBondContact O-N 3.05Å
451	E	97.3	Very high	96	Very high	106 Å²	106	39.5 Å²	39.5	50%	0.495	18%	0.175	S	C	.	.	H	α-helix	trans	-100.1	-22.5	-174.2	-52.5	-57.6	149.2	0	0	112.5	Y141 F447	Y141-E451 HydrophobicContact CE2-CG 3.81Å; Y141-E451 WeakPolarHBondContact CE2-OE1 3.47Å; Y141-E451 VanDerWaalsContact CZ-OE1 3.25Å; Y141-E451 PolarHBondContact OH-OE1 3.29Å; F447-E451 HydrophobicContact CD2-CB 3.88Å; F447-E451 HydrophobicContact CD2-CG 3.47Å; F447-E451 VanDerWaalsContact CD2-CG 3.47Å; F447-E451 HydrophobicContact CE2-CB 3.7Å; F447-E451 HydrophobicContact CE2-CG 3.62Å; F447-E451 HydrophobicContact CG-CB 4.36Å; F447-E451 HydrophobicContact CG-CG 4.2Å; F447-E451 HydrophobicContact CZ-CB 4.04Å; F447-E451 HydrophobicContact CZ-CG 4.45Å; F447-E451 WeakPolarHBondContact O-CB 3.3Å; F447-E451 PolarHBondContact O-N 3.35Å
452	K	96.9	Very high	95.8	Very high	89 Å²	89	39.5 Å²	39.5	39%	0.387	18%	0.175	S	C	.	.	S	Bend	trans	-118.4	-10.2	-177.4	-55.2	-70.7	164	156	0	114.1	F447 S448 L454 L482	F447-K452 HydrophobicContact CD1-CG 4.44Å; F447-K452 HydrophobicContact CE1-CD 4.47Å; F447-K452 HydrophobicContact CE1-CG 3.87Å; F447-K452 HydrophobicContact CZ-CG 4.45Å; S448-K452 CarbonylContact O-C 3.57Å; S448-K452 WeakPolarHBondContact O-CA 3.39Å; S448-K452 VanDerWaalsContact O-CB 3.31Å; S448-K452 WeakPolarHBondContact O-CB 3.43Å; S448-K452 PolarHBondContact O-N 3.06Å; K452-L454 HydrophobicContact CB-CB 4.45Å; K452-L454 HydrophobicContact CB-CD1 4.35Å; K452-L454 HydrophobicContact CB-CG 4.08Å; K452-L454 WeakPolarHBondContact O-CG 3.13Å; K452-L454 PolarHBondContact O-N 3.47Å; K452-L454 VanDerWaalsContact O-N 3.13Å; K452-L482 WeakPolarHBondContact CD-O 3.47Å; K452-L482 WeakPolarHBondContact CE-O 3.47Å; K452-L482 HydrophobicContact CG-CD2 4.4Å; K452-L482 PolarHBondContact NZ-O 2.86Å
453	G	96	Very high	95.7	Very high	32 Å²	32	36.1 Å²	36.1	33%	0.33	16%	0.163	S	C	.	.			trans	68.7	1.5	-174	0	0	0	0	0	114.5	S448 R449 P464	S448-G453 PolarHBondContact O-N 3.45Å; S448-G453 VanDerWaalsContact O-N 3.09Å; R449-G453 PolarHBondContact O-N 2.92Å; G453-P464 VanDerWaalsContact O-CD 3.24Å; G453-P464 WeakPolarHBondContact O-CD 3.45Å; G453-P464 WeakPolarHBondContact O-CG 3.47Å
454	L	95.8	Very high	95.4	Very high	14 Å²	14	38 Å²	38	7%	0.073	18%	0.175	C	C	.	.			trans	-93.3	145.8	-174.6	-56.3	-177.7	0	0	0	111.8	S448 R449 K452 L461 D463 F470 L482	S448-L454 CarbonylContact C-O 3.58Å; S448-L454 PolarHBondContact O-N 3.06Å; S448-L454 PolarHBondContact OG-O 3.22Å; R449-L454 VanDerWaalsContact CA-O 3.31Å; R449-L454 WeakPolarHBondContact CA-O 3.21Å; R449-L454 PolarHBondContact N-O 3.29Å; K452-L454 HydrophobicContact CB-CB 4.45Å; K452-L454 HydrophobicContact CB-CD1 4.35Å; K452-L454 HydrophobicContact CB-CG 4.08Å; K452-L454 WeakPolarHBondContact O-CG 3.13Å; K452-L454 PolarHBondContact O-N 3.47Å; K452-L454 VanDerWaalsContact O-N 3.13Å; L454-L461 HydrophobicContact CB-CD1 3.66Å; L454-L461 HydrophobicContact CB-CG 4.34Å; L454-L461 HydrophobicContact CD1-CD1 4.23Å; L454-L461 HydrophobicContact CD1-CD2 4Å; L454-L461 HydrophobicContact CD1-CG 4.24Å; L454-D463 HydrophobicContact CD2-CB 3.87Å; L454-F470 HydrophobicContact CD1-CE2 3.85Å; L454-F470 HydrophobicContact CD1-CZ 3.99Å; L454-F470 HydrophobicContact CD2-CE2 3.91Å; L454-F470 HydrophobicContact CD2-CZ 4.21Å; L454-F470 HydrophobicContact CG-CE2 4.46Å; L454-L482 HydrophobicContact CD1-CD2 4.28Å
455	W	95.1	Very high	95.1	Very high	53 Å²	53	46.2 Å²	46.2	20%	0.201	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	99.3	-178.8	-58.8	-0.4	0	0	0	110.1	A377 Q378 F462 P464	A377-W455 HydrophobicContact CB-CE3 3.93Å; Q378-W455 HydrophobicContact CG-CE3 4.33Å; Q378-W455 HydrophobicContact CG-CH2 4.4Å; Q378-W455 HydrophobicContact CG-CZ3 3.65Å; W455-F462 HydrophobicContact CB-CB 4.29Å; W455-F462 HydrophobicContact CB-CD1 4.47Å; W455-F462 HydrophobicContact CD2-CD1 4.08Å; W455-F462 AromaticContact CE3-CD1 3.65Å; W455-F462 HydrophobicContact CE3-CD1 3.65Å; W455-F462 HydrophobicContact CE3-CE1 4.02Å; W455-F462 HydrophobicContact CG-CD1 4.48Å; W455-F462 HydrophobicContact CZ3-CD1 4.11Å; W455-F462 HydrophobicContact CZ3-CE1 4Å; W455-F462 PolarHBondContact N-O 3.12Å; W455-F462 PolarHBondContact O-N 2.72Å; W455-P464 HydrophobicContact CD2-CB 4.48Å; W455-P464 HydrophobicContact CH2-CB 4.24Å; W455-P464 HydrophobicContact CZ2-CB 3.74Å; W455-P464 HydrophobicContact CZ2-CG 4.29Å
456	L	94.9	Very high	94.9	Very high	15 Å²	15	50.1 Å²	50.1	8%	0.079	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	133.2	174.2	-176.7	69.3	0	0	0	111.2	F429 L444 R445 L461 I478 L482	F429-L456 HydrophobicContact CD1-CD1 3.98Å; F429-L456 HydrophobicContact CE1-CD1 4.23Å; L444-L456 HydrophobicContact CD2-CD2 3.61Å; L444-L456 HydrophobicContact CG-CD2 3.61Å; R445-L456 HydrophobicContact CG-CB 4.39Å; R445-L456 HydrophobicContact CG-CD2 4.3Å; R445-L456 HydrophobicContact CG-CG 4.4Å; R445-L456 WeakPolarHBondContact CG-O 3.36Å; L456-L461 HydrophobicContact CB-CD1 3.82Å; L456-L461 HydrophobicContact CD1-CB 4.15Å; L456-L461 HydrophobicContact CD1-CD1 4.06Å; L456-I478 HydrophobicContact CD1-CG2 4.09Å; L456-L482 HydrophobicContact CD2-CD1 4.23Å
457	N	91.9	Very high	94.6	Very high	11 Å²	11	55.2 Å²	55.2	6%	0.059	26%	0.258	C	S	.	.			trans	-140	-169.6	165	63.6	31	0	0	0	109.6	L376 H459 G460	L376-N457 PolarHBondContact O-ND2 3.33Å; N457-H459 PolarHBondContact O-N 3.42Å; N457-H459 WeakPolarHBondContact OD1-CA 3.33Å; N457-H459 WeakPolarHBondContact OD1-CB 3.1Å; N457-H459 PolarHBondContact OD1-N 3.28Å; N457-G460 PolarHBondContact N-O 3.47Å; N457-G460 PolarHBondContact OD1-N 2.88Å; N457-G460 PolarHBondContact OD1-O 2.85Å
458	S	91.9	Very high	94.3	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	27%	0.274	C	S	.	.	S	Bend	trans	-76.7	-7.4	-179.8	-51.7	0	0	0	0	114	M382 F385 F429 A430 R445	M382-S458 VanDerWaalsContact O-CB 3.29Å; M382-S458 WeakPolarHBondContact O-CB 3.2Å; M382-S458 PolarHBondContact O-OG 2.7Å; F385-S458 VanDerWaalsContact CE2-O 3.27Å; F385-S458 WeakPolarHBondContact CE2-O 3.34Å; F385-S458 WeakPolarHBondContact CZ-O 3.1Å; F429-S458 CarbonylContact C-O 3.54Å; F429-S458 VanDerWaalsContact C-O 3.25Å; F429-S458 VanDerWaalsContact CB-O 3.32Å; F429-S458 WeakPolarHBondContact CB-O 3.27Å; A430-S458 WeakPolarHBondContact CA-O 3.42Å; A430-S458 PolarHBondContact N-O 3.19Å; A430-S458 VanDerWaalsContact N-O 3.09Å; R445-S458 PolarHBondContact NH2-OG 3.31Å
459	H	91.9	Very high	94.1	Very high	13 Å²	13	61.7 Å²	61.7	6%	0.06	29%	0.291	C	S	.	.	S	Bend	trans	-100.7	-26.1	179.7	-60.6	-63.6	0	0	0	113	D383 A384 F385 Q426 N457	D383-H459 WeakPolarHBondContact CA-NE2 3.49Å; A384-H459 PolarHBondContact N-CE1 3.42Å; A384-H459 PolarHBondContact N-NE2 2.96Å; F385-H459 AromaticContact CD1-CE1 3.7Å; F385-H459 AromaticContact CD1-ND1 3.77Å; F385-H459 AromaticContact CD2-CE1 3.65Å; F385-H459 AromaticContact CE1-CE1 3.6Å; F385-H459 AromaticContact CE1-ND1 3.18Å; F385-H459 WeakPolarHBondContact CE1-ND1 3.43Å; F385-H459 AromaticContact CE2-CE1 3.54Å; F385-H459 AromaticContact CE2-ND1 3.44Å; F385-H459 WeakPolarHBondContact CE2-ND1 3.48Å; F385-H459 AromaticContact CG-CE1 3.72Å; F385-H459 AromaticContact CZ-CE1 3.53Å; F385-H459 AromaticContact CZ-ND1 3Å; F385-H459 WeakPolarHBondContact CZ-ND1 3.43Å; Q426-H459 WeakPolarHBondContact CG-O 3.25Å; Q426-H459 PolarHBondContact OE1-ND1 2.91Å; N457-H459 PolarHBondContact O-N 3.42Å; N457-H459 WeakPolarHBondContact OD1-CA 3.33Å; N457-H459 WeakPolarHBondContact OD1-CB 3.1Å; N457-H459 PolarHBondContact OD1-N 3.28Å
460	G	93.4	Very high	94	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.01	28%	0.279	C	S	.	.			trans	-179.9	172.4	-171.7	0	0	0	0	0	114.5	N457	N457-G460 PolarHBondContact N-O 3.47Å; N457-G460 PolarHBondContact OD1-N 2.88Å; N457-G460 PolarHBondContact OD1-O 2.85Å
461	L	95.2	Very high	93.8	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	122.2	165.7	-178.6	66	0	0	0	107.5	F429 L454 L456 F469 F470 H481 L482	F429-L461 HydrophobicContact CE1-CB 3.67Å; F429-L461 HydrophobicContact CZ-CB 4.06Å; L454-L461 HydrophobicContact CB-CD1 3.66Å; L454-L461 HydrophobicContact CB-CG 4.34Å; L454-L461 HydrophobicContact CD1-CD1 4.23Å; L454-L461 HydrophobicContact CD1-CD2 4Å; L454-L461 HydrophobicContact CD1-CG 4.24Å; L456-L461 HydrophobicContact CB-CD1 3.82Å; L456-L461 HydrophobicContact CD1-CB 4.15Å; L456-L461 HydrophobicContact CD1-CD1 4.06Å; L461-F469 WeakPolarHBondContact O-CA 3.21Å; L461-F470 HydrophobicContact CB-CB 4.31Å; L461-F470 HydrophobicContact CB-CD2 4.04Å; L461-F470 HydrophobicContact CD2-CB 4.36Å; L461-F470 HydrophobicContact CD2-CD2 3.71Å; L461-F470 HydrophobicContact CD2-CE2 4.17Å; L461-F470 HydrophobicContact CD2-CG 4.03Å; L461-F470 HydrophobicContact CG-CD2 3.6Å; L461-F470 HydrophobicContact CG-CE2 4.1Å; L461-F470 HydrophobicContact CG-CG 4.31Å; L461-F470 WeakPolarHBondContact O-CD2 3.5Å; L461-F470 PolarHBondContact O-N 3.45Å; L461-H481 HydrophobicContact CD2-CB 3.78Å; L461-L482 HydrophobicContact CD1-CD2 4.03Å; L461-L482 HydrophobicContact CD2-CD2 4.26Å; L461-L482 HydrophobicContact CD2-CG 4.49Å
462	F	94.4	Very high	93.8	Very high	12 Å²	12	53.2 Å²	53.2	5%	0.053	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	133.7	-177.1	176.8	-105.4	0	0	0	111.1	A377 W455 P464 K467 T468 F469	A377-F462 HydrophobicContact CB-CB 3.87Å; A377-F462 HydrophobicContact CB-CD1 3.91Å; A377-F462 HydrophobicContact CB-CG 3.86Å; W455-F462 HydrophobicContact CB-CB 4.29Å; W455-F462 HydrophobicContact CB-CD1 4.47Å; W455-F462 HydrophobicContact CD2-CD1 4.08Å; W455-F462 AromaticContact CE3-CD1 3.65Å; W455-F462 HydrophobicContact CE3-CD1 3.65Å; W455-F462 HydrophobicContact CE3-CE1 4.02Å; W455-F462 HydrophobicContact CG-CD1 4.48Å; W455-F462 HydrophobicContact CZ3-CD1 4.11Å; W455-F462 HydrophobicContact CZ3-CE1 4Å; W455-F462 PolarHBondContact N-O 3.12Å; W455-F462 PolarHBondContact O-N 2.72Å; F462-P464 HydrophobicContact CD1-CB 4.38Å; F462-P464 VanDerWaalsContact CE1-CA 3.49Å; F462-P464 HydrophobicContact CE1-CB 3.99Å; F462-P464 WeakPolarHBondContact O-CD 3.43Å; F462-K467 VanDerWaalsContact CE2-C 3.49Å; F462-K467 HydrophobicContact CZ-CB 4.34Å; F462-T468 VanDerWaalsContact CD2-O 3.26Å; F462-T468 WeakPolarHBondContact CD2-O 3.29Å; F462-F469 HydrophobicContact CB-CD1 4.17Å; F462-F469 HydrophobicContact CB-CE1 3.83Å; F462-F469 HydrophobicContact CB-CZ 4.04Å; F462-F469 HydrophobicContact CD2-CD1 4.49Å; F462-F469 AromaticContact CD2-CD2 3.79Å; F462-F469 HydrophobicContact CD2-CD2 3.79Å; F462-F469 HydrophobicContact CD2-CE1 4.27Å; F462-F469 AromaticContact CD2-CE2 3.49Å; F462-F469 HydrophobicContact CD2-CE2 3.49Å; F462-F469 VanDerWaalsContact CD2-CE2 3.49Å; F462-F469 HydrophobicContact CD2-CG 4.27Å; F462-F469 AromaticContact CD2-CZ 3.78Å; F462-F469 HydrophobicContact CD2-CZ 3.78Å; F462-F469 HydrophobicContact CE2-CD2 4.42Å; F462-F469 HydrophobicContact CE2-CE2 4.06Å; F462-F469 HydrophobicContact CG-CE1 4.47Å; F462-F469 HydrophobicContact CG-CE2 4.36Å; F462-F469 HydrophobicContact CG-CZ 4.21Å
463	D	94.9	Very high	93.7	Very high	14 Å²	14	54 Å²	54	8%	0.075	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	111	169.6	-171.9	-33	0	0	0	109.3	L454 E465 Q466 K467 T468 F470	L454-D463 HydrophobicContact CD2-CB 3.87Å; D463-E465 VanDerWaalsContact C-N 3.31Å; D463-E465 PolarHBondContact O-N 3.32Å; D463-E465 WeakPolarHBondContact OD1-CA 3.5Å; D463-E465 WeakPolarHBondContact OD1-CB 3.5Å; D463-E465 PolarHBondContact OD1-N 3.18Å; D463-Q466 HydrophobicContact CB-CB 4.15Å; D463-Q466 PolarHBondContact OD1-N 3.03Å; D463-Q466 WeakPolarHBondContact OD2-CG 3.43Å; D463-K467 WeakPolarHBondContact O-CA 3.45Å; D463-K467 PolarHBondContact O-N 3.16Å; D463-T468 PolarHBondContact N-O 3.04Å; D463-T468 PolarHBondContact O-N 2.93Å; D463-F470 HydrophobicContact CB-CE2 3.85Å; D463-F470 HydrophobicContact CB-CZ 4.28Å
464	P	92.1	Very high	93.7	Very high	40 Å²	40	54.1 Å²	54.1	26%	0.26	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-21.6	179.6	31.2	-36	0	0	0	114.1	G453 W455 F462	G453-P464 VanDerWaalsContact O-CD 3.24Å; G453-P464 WeakPolarHBondContact O-CD 3.45Å; G453-P464 WeakPolarHBondContact O-CG 3.47Å; W455-P464 HydrophobicContact CD2-CB 4.48Å; W455-P464 HydrophobicContact CH2-CB 4.24Å; W455-P464 HydrophobicContact CZ2-CB 3.74Å; W455-P464 HydrophobicContact CZ2-CG 4.29Å; F462-P464 HydrophobicContact CD1-CB 4.38Å; F462-P464 VanDerWaalsContact CE1-CA 3.49Å; F462-P464 HydrophobicContact CE1-CB 3.99Å; F462-P464 WeakPolarHBondContact O-CD 3.43Å
465	E	92.6	Very high	93.9	Very high	173 Å²	173	53.9 Å²	53.9	81%	0.808	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-48.6	178.1	-61.5	-175.4	177	0	0	110.1	D463 K467	D463-E465 VanDerWaalsContact C-N 3.31Å; D463-E465 PolarHBondContact O-N 3.32Å; D463-E465 WeakPolarHBondContact OD1-CA 3.5Å; D463-E465 WeakPolarHBondContact OD1-CB 3.5Å; D463-E465 PolarHBondContact OD1-N 3.18Å; E465-K467 VanDerWaalsContact C-N 3.34Å
466	Q	92.8	Very high	94	Very high	136 Å²	136	56.5 Å²	56.5	64%	0.636	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-16.6	178.1	-60.3	-174.3	19.4	0	0	113.1	D463 T468	D463-Q466 HydrophobicContact CB-CB 4.15Å; D463-Q466 PolarHBondContact OD1-N 3.03Å; D463-Q466 WeakPolarHBondContact OD2-CG 3.43Å; Q466-T468 VanDerWaalsContact C-N 3.27Å; Q466-T468 HydrophobicContact CB-CG2 4.45Å; Q466-T468 WeakPolarHBondContact CB-OG1 3.17Å; Q466-T468 PolarHBondContact O-N 2.78Å
467	K	91.7	Very high	94.2	Very high	168 Å²	168	56.5 Å²	56.5	73%	0.73	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	37.3	-173.8	-57.7	178.4	180	173.9	0	113	F462 D463 E465	F462-K467 VanDerWaalsContact CE2-C 3.49Å; F462-K467 HydrophobicContact CZ-CB 4.34Å; D463-K467 WeakPolarHBondContact O-CA 3.45Å; D463-K467 PolarHBondContact O-N 3.16Å; E465-K467 VanDerWaalsContact C-N 3.34Å
468	T	92.4	Very high	94.5	Very high	62 Å²	62	56 Å²	56	38%	0.38	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	156.6	-177.2	52.2	0	0	0	0	111.8	F462 D463 Q466	F462-T468 VanDerWaalsContact CD2-O 3.26Å; F462-T468 WeakPolarHBondContact CD2-O 3.29Å; D463-T468 PolarHBondContact N-O 3.04Å; D463-T468 PolarHBondContact O-N 2.93Å; Q466-T468 VanDerWaalsContact C-N 3.27Å; Q466-T468 HydrophobicContact CB-CG2 4.45Å; Q466-T468 WeakPolarHBondContact CB-OG1 3.17Å; Q466-T468 PolarHBondContact O-N 2.78Å
469	F	92.5	Very high	94.8	Very high	82 Å²	82	56 Å²	56	36%	0.36	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	141.7	169.5	-79.3	-91.9	0	0	0	110.1	P373 A377 L461 F462	P373-F469 HydrophobicContact CB-CD2 4.19Å; P373-F469 HydrophobicContact CB-CE2 3.34Å; P373-F469 HydrophobicContact CB-CZ 3.87Å; P373-F469 WeakPolarHBondContact O-CZ 3.37Å; A377-F469 HydrophobicContact CB-CZ 4.08Å; L461-F469 WeakPolarHBondContact O-CA 3.21Å; F462-F469 HydrophobicContact CB-CD1 4.17Å; F462-F469 HydrophobicContact CB-CE1 3.83Å; F462-F469 HydrophobicContact CB-CZ 4.04Å; F462-F469 HydrophobicContact CD2-CD1 4.49Å; F462-F469 AromaticContact CD2-CD2 3.79Å; F462-F469 HydrophobicContact CD2-CD2 3.79Å; F462-F469 HydrophobicContact CD2-CE1 4.27Å; F462-F469 AromaticContact CD2-CE2 3.49Å; F462-F469 HydrophobicContact CD2-CE2 3.49Å; F462-F469 VanDerWaalsContact CD2-CE2 3.49Å; F462-F469 HydrophobicContact CD2-CG 4.27Å; F462-F469 AromaticContact CD2-CZ 3.78Å; F462-F469 HydrophobicContact CD2-CZ 3.78Å; F462-F469 HydrophobicContact CE2-CD2 4.42Å; F462-F469 HydrophobicContact CE2-CE2 4.06Å; F462-F469 HydrophobicContact CG-CE1 4.47Å; F462-F469 HydrophobicContact CG-CE2 4.36Å; F462-F469 HydrophobicContact CG-CZ 4.21Å
470	F	93.5	Very high	95.1	Very high	49 Å²	49	63.5 Å²	63.5	22%	0.215	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-76.3	130.4	170.3	-67.3	-93.8	0	0	0	109.8	L454 L461 D463 H481	L454-F470 HydrophobicContact CD1-CE2 3.85Å; L454-F470 HydrophobicContact CD1-CZ 3.99Å; L454-F470 HydrophobicContact CD2-CE2 3.91Å; L454-F470 HydrophobicContact CD2-CZ 4.21Å; L454-F470 HydrophobicContact CG-CE2 4.46Å; L461-F470 HydrophobicContact CB-CB 4.31Å; L461-F470 HydrophobicContact CB-CD2 4.04Å; L461-F470 HydrophobicContact CD2-CB 4.36Å; L461-F470 HydrophobicContact CD2-CD2 3.71Å; L461-F470 HydrophobicContact CD2-CE2 4.17Å; L461-F470 HydrophobicContact CD2-CG 4.03Å; L461-F470 HydrophobicContact CG-CD2 3.6Å; L461-F470 HydrophobicContact CG-CE2 4.1Å; L461-F470 HydrophobicContact CG-CG 4.31Å; L461-F470 WeakPolarHBondContact O-CD2 3.5Å; L461-F470 PolarHBondContact O-N 3.45Å; D463-F470 HydrophobicContact CB-CE2 3.85Å; D463-F470 HydrophobicContact CB-CZ 4.28Å; F470-H481 HydrophobicContact CD1-CB 4.39Å; F470-H481 AromaticContact CD1-CE1 3.6Å; F470-H481 AromaticContact CD1-CG 3.73Å; F470-H481 AromaticContact CD1-ND1 3.42Å; F470-H481 WeakPolarHBondContact CD1-ND1 3.48Å; F470-H481 AromaticContact CD1-NE2 3.98Å; F470-H481 AromaticContact CE1-ND1 3.73Å
471	H	93.7	Very high	95.3	Very high	148 Å²	148	67 Å²	67	69%	0.685	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-84.5	128.3	168.5	-177	-79	0	0	0	109.4
472	V	95.3	Very high	95.4	Very high	5 Å²	5	67 Å²	67	3%	0.03	32%	0.321	C	S	.	.			trans	-135.3	152.2	-180	-60.4	0	0	0	0	110.1	P428 F429 D477 I478	P428-V472 HydrophobicContact CB-CG2 3.89Å; P428-V472 HydrophobicContact CG-CG2 4.1Å; F429-V472 HydrophobicContact CD2-CG2 3.9Å; F429-V472 HydrophobicContact CE1-CG1 4.44Å; F429-V472 HydrophobicContact CE1-CG2 3.92Å; F429-V472 HydrophobicContact CE2-CG2 3.24Å; F429-V472 HydrophobicContact CG-CG2 4.5Å; F429-V472 HydrophobicContact CZ-CB 4.22Å; F429-V472 HydrophobicContact CZ-CG1 3.9Å; F429-V472 HydrophobicContact CZ-CG2 3.25Å; V472-D477 HydrophobicContact CB-CB 3.79Å; V472-D477 HydrophobicContact CG1-CB 3.8Å; V472-I478 HydrophobicContact CB-CG1 4.27Å; V472-I478 HydrophobicContact CG1-CG1 4.07Å; V472-I478 HydrophobicContact CG2-CD1 4.4Å; V472-I478 HydrophobicContact CG2-CG1 4.04Å
473	T	94.9	Very high	95.5	Very high	106 Å²	106	68.9 Å²	68.9	65%	0.65	34%	0.344	S	S	*	.	S	Bend	trans	-117.4	-13.1	178.4	59.1	0	0	0	0	112.6	D477	T473-D477 PolarHBondContact N-OD2 3.4Å; T473-D477 PolarHBondContact OG1-OD2 3.32Å
474	S	97.9	Very high	95.7	Very high	35 Å²	35	69.1 Å²	69.1	25%	0.245	35%	0.345	C	S	.	.	S	Bend	trans	-147.5	164.9	-178.2	76.1	0	0	0	0	111.8	E476 D477	S474-E476 PolarHBondContact O-N 3.17Å; S474-E476 PolarHBondContact OG-N 3.46Å; S474-D477 PolarHBondContact N-OD2 3.29Å; S474-D477 PolarHBondContact O-N 2.94Å; S474-D477 PolarHBondContact OG-N 3.33Å; S474-D477 VanDerWaalsContact OG-N 3.16Å; S474-D477 PolarHBondContact OG-OD1 2.93Å
475	E	98.4	Very high	95.9	Very high	9 Å²	9	74.6 Å²	74.6	4%	0.042	37%	0.367	C	S	.	.	H	α-helix	trans	-61.1	-36.7	169.5	-64.8	-177.1	128.4	0	0	111	R322 L431 L432 D477 I478 F479 Y486 R492	R322-E475 IonicContact CZ-OE1 2.94Å; R322-E475 IonicContact CZ-OE2 3.8Å; R322-E475 VanDerWaalsContact NH1-CD 3.33Å; R322-E475 IonicContact NH1-OE1 3.63Å; R322-E475 PolarHBondContact NH1-OE1 3.05Å; R322-E475 IonicContact NH1-OE2 3.98Å; R322-E475 PolarHBondContact NH1-OE2 3.28Å; R322-E475 VanDerWaalsContact NH1-OE2 3.16Å; R322-E475 IonicContact NH2-OE1 3.21Å; R322-E475 IonicContact NH2-OE2 2.75Å; R322-E475 PolarHBondContact NH2-OE2 2.76Å; L431-E475 HydrophobicContact CD2-CG 4.36Å; L432-E475 WeakPolarHBondContact CA-OE1 3.45Å; L432-E475 HydrophobicContact CB-CG 4.33Å; E475-D477 VanDerWaalsContact C-N 3.26Å; E475-D477 PolarHBondContact O-N 3.22Å; E475-I478 WeakPolarHBondContact O-CB 3.5Å; E475-I478 PolarHBondContact O-N 2.83Å; E475-F479 WeakPolarHBondContact O-CD2 3.47Å; E475-F479 PolarHBondContact O-N 3.09Å; E475-Y486 HydrophobicContact CB-CE2 3.92Å; E475-Y486 PolarHBondContact OE2-OH 2.94Å; E475-R492 VanDerWaalsContact CD-NH1 3.33Å; E475-R492 IonicContact OE1-CZ 3.92Å; E475-R492 IonicContact OE1-NH1 3.2Å; E475-R492 PolarHBondContact OE1-NH1 3.17Å; E475-R492 IonicContact OE1-NH2 3.48Å; E475-R492 IonicContact OE2-CZ 2.75Å; E475-R492 IonicContact OE2-NH1 2.98Å; E475-R492 PolarHBondContact OE2-NH1 3.02Å; E475-R492 IonicContact OE2-NH2 3.99Å; E475-R492 PolarHBondContact OE2-NH2 3.14Å
476	E	98.5	Very high	96.2	Very high	107 Å²	107	70 Å²	70	50%	0.5	34%	0.343	S	S	.	.	H	α-helix	trans	-58.2	-38.5	179.8	-65	175.9	-151.5	0	0	112	S474 I478 F479 R480 Y486	S474-E476 PolarHBondContact O-N 3.17Å; S474-E476 PolarHBondContact OG-N 3.46Å; E476-I478 VanDerWaalsContact C-N 3.29Å; E476-I478 PolarHBondContact O-N 2.75Å; E476-F479 PolarHBondContact O-N 3.13Å; E476-R480 WeakPolarHBondContact O-CG 3.32Å; E476-R480 PolarHBondContact O-N 3.06Å; E476-Y486 HydrophobicContact CB-CD2 4.21Å; E476-Y486 HydrophobicContact CB-CE2 4.48Å; E476-Y486 HydrophobicContact CG-CD1 4.08Å; E476-Y486 HydrophobicContact CG-CD2 3.61Å; E476-Y486 HydrophobicContact CG-CE1 4.14Å; E476-Y486 HydrophobicContact CG-CE2 3.66Å; E476-Y486 HydrophobicContact CG-CG 3.81Å
477	D	98.1	Very high	96.5	Very high	15 Å²	15	64 Å²	64	8%	0.08	32%	0.315	C	S	.	.	H	α-helix	trans	-59.4	-41.2	175.4	-57.9	-3.8	0	0	0	111.3	V472 T473 S474 E475 R480 H481	V472-D477 HydrophobicContact CB-CB 3.79Å; V472-D477 HydrophobicContact CG1-CB 3.8Å; T473-D477 PolarHBondContact N-OD2 3.4Å; T473-D477 PolarHBondContact OG1-OD2 3.32Å; S474-D477 PolarHBondContact N-OD2 3.29Å; S474-D477 PolarHBondContact O-N 2.94Å; S474-D477 PolarHBondContact OG-N 3.33Å; S474-D477 VanDerWaalsContact OG-N 3.16Å; S474-D477 PolarHBondContact OG-OD1 2.93Å; E475-D477 VanDerWaalsContact C-N 3.26Å; E475-D477 PolarHBondContact O-N 3.22Å; D477-R480 PolarHBondContact O-N 3.18Å; D477-R480 IonicContact OD1-CZ 3.76Å; D477-R480 IonicContact OD1-NE 2.72Å; D477-R480 IonicContact OD1-NH2 3.83Å; D477-R480 PolarHBondContact OD1-NH2 3.03Å; D477-H481 PolarHBondContact O-CD2 2.95Å; D477-H481 PolarHBondContact O-N 3.49Å
478	I	98.3	Very high	96.8	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-63.4	-45.3	178.4	-53.9	170.6	0	0	0	110	P428 F429 L432 L456 V472 E475 E476 R480 H481 L482	P428-I478 HydrophobicContact CB-CD1 4.19Å; F429-I478 HydrophobicContact CD1-CD1 3.47Å; F429-I478 VanDerWaalsContact CD1-CD1 3.47Å; F429-I478 HydrophobicContact CD1-CG1 4Å; F429-I478 HydrophobicContact CE1-CD1 3.77Å; F429-I478 HydrophobicContact CE1-CG1 3.73Å; F429-I478 HydrophobicContact CE1-CG2 4.38Å; F429-I478 HydrophobicContact CG-CD1 4.14Å; F429-I478 HydrophobicContact CZ-CG1 4.48Å; L432-I478 HydrophobicContact CB-CD1 4.31Å; L432-I478 HydrophobicContact CD2-CB 4.3Å; L432-I478 HydrophobicContact CD2-CD1 3.68Å; L432-I478 HydrophobicContact CD2-CG2 3.8Å; L456-I478 HydrophobicContact CD1-CG2 4.09Å; V472-I478 HydrophobicContact CB-CG1 4.27Å; V472-I478 HydrophobicContact CG1-CG1 4.07Å; V472-I478 HydrophobicContact CG2-CD1 4.4Å; V472-I478 HydrophobicContact CG2-CG1 4.04Å; E475-I478 WeakPolarHBondContact O-CB 3.5Å; E475-I478 PolarHBondContact O-N 2.83Å; E476-I478 VanDerWaalsContact C-N 3.29Å; E476-I478 PolarHBondContact O-N 2.75Å; I478-R480 VanDerWaalsContact C-N 3.34Å; I478-R480 PolarHBondContact O-N 3.2Å; I478-H481 PolarHBondContact O-N 3.36Å; I478-L482 HydrophobicContact CG2-CD1 4.16Å; I478-L482 WeakPolarHBondContact O-CG 3.39Å; I478-L482 PolarHBondContact O-N 3.42Å
479	F	98.5	Very high	97.1	Very high	2 Å²	2	55.7 Å²	55.7	1%	0.009	28%	0.28	C	S	.	.	H	α-helix	trans	-63.3	-40.4	176.2	-79.8	-104	0	0	0	111.6	L432 F440 E475 E476 L482 G483 L484 E485 Y486 L487	L432-F479 HydrophobicContact CD1-CE2 4.03Å; F440-F479 HydrophobicContact CE1-CZ 4.2Å; F440-F479 HydrophobicContact CZ-CE1 4.18Å; F440-F479 AromaticContact CZ-CZ 3.81Å; F440-F479 HydrophobicContact CZ-CZ 3.81Å; E475-F479 WeakPolarHBondContact O-CD2 3.47Å; E475-F479 PolarHBondContact O-N 3.09Å; E476-F479 PolarHBondContact O-N 3.13Å; F479-L482 CarbonylContact O-C 3.51Å; F479-L482 PolarHBondContact O-N 3.22Å; F479-G483 PolarHBondContact O-N 3.28Å; F479-L484 HydrophobicContact CB-CB 4.44Å; F479-L484 HydrophobicContact CD1-CB 3.79Å; F479-L484 HydrophobicContact CD1-CD1 4.39Å; F479-L484 PolarHBondContact O-N 3.05Å; F479-E485 WeakPolarHBondContact CD1-O 3.38Å; F479-Y486 HydrophobicContact CB-CD2 4.33Å; F479-Y486 AromaticContact CD2-CD2 3.68Å; F479-Y486 HydrophobicContact CD2-CD2 3.68Å; F479-Y486 HydrophobicContact CD2-CE2 4.13Å; F479-Y486 HydrophobicContact CE2-CD2 4.01Å; F479-Y486 HydrophobicContact CE2-CE2 4.15Å; F479-Y486 AromaticContact CG-CD2 3.95Å; F479-Y486 HydrophobicContact CG-CD2 3.95Å; F479-L487 HydrophobicContact CE1-CB 4.16Å; F479-L487 HydrophobicContact CE1-CG 4.45Å; F479-L487 HydrophobicContact CZ-CB 4.37Å
480	R	98.1	Very high	97.4	Very high	170 Å²	170	56.2 Å²	56.2	64%	0.642	28%	0.283	S	S	*	.	H	α-helix	trans	-60.7	-46.9	174.8	-72.7	-172.5	-65.2	133.7	-11.2	112.1	E476 D477 I478 L482 G483	E476-R480 WeakPolarHBondContact O-CG 3.32Å; E476-R480 PolarHBondContact O-N 3.06Å; D477-R480 PolarHBondContact O-N 3.18Å; D477-R480 IonicContact OD1-CZ 3.76Å; D477-R480 IonicContact OD1-NE 2.72Å; D477-R480 IonicContact OD1-NH2 3.83Å; D477-R480 PolarHBondContact OD1-NH2 3.03Å; I478-R480 VanDerWaalsContact C-N 3.34Å; I478-R480 PolarHBondContact O-N 3.2Å; R480-L482 VanDerWaalsContact C-N 3.25Å; R480-L482 PolarHBondContact O-N 2.93Å; R480-G483 PolarHBondContact O-N 3.23Å
481	H	97.5	Very high	97.6	Very high	74 Å²	74	56.9 Å²	56.9	34%	0.343	29%	0.287	S	S	.	.	H	α-helix	trans	-62.1	-33.2	176.1	-73.7	-55.4	0	0	0	113	L461 F470 D477 I478 G483	L461-H481 HydrophobicContact CD2-CB 3.78Å; F470-H481 HydrophobicContact CD1-CB 4.39Å; F470-H481 AromaticContact CD1-CE1 3.6Å; F470-H481 AromaticContact CD1-CG 3.73Å; F470-H481 AromaticContact CD1-ND1 3.42Å; F470-H481 WeakPolarHBondContact CD1-ND1 3.48Å; F470-H481 AromaticContact CD1-NE2 3.98Å; F470-H481 AromaticContact CE1-ND1 3.73Å; D477-H481 PolarHBondContact O-CD2 2.95Å; D477-H481 PolarHBondContact O-N 3.49Å; I478-H481 PolarHBondContact O-N 3.36Å; H481-G483 VanDerWaalsContact C-N 3.29Å
482	L	97.7	Very high	97.8	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-4.9	174.8	-64.6	176.1	0	0	0	113.3	L444 F447 S448 K452 L454 L456 L461 I478 F479 R480 L484	L444-L482 HydrophobicContact CD1-CD1 3.7Å; L444-L482 HydrophobicContact CG-CD1 4.31Å; F447-L482 HydrophobicContact CE1-CB 4.45Å; F447-L482 WeakPolarHBondContact CE1-O 3.37Å; S448-L482 WeakPolarHBondContact OG-CD2 3.41Å; K452-L482 WeakPolarHBondContact CD-O 3.47Å; K452-L482 WeakPolarHBondContact CE-O 3.47Å; K452-L482 HydrophobicContact CG-CD2 4.4Å; K452-L482 PolarHBondContact NZ-O 2.86Å; L454-L482 HydrophobicContact CD1-CD2 4.28Å; L456-L482 HydrophobicContact CD2-CD1 4.23Å; L461-L482 HydrophobicContact CD1-CD2 4.03Å; L461-L482 HydrophobicContact CD2-CD2 4.26Å; L461-L482 HydrophobicContact CD2-CG 4.49Å; I478-L482 HydrophobicContact CG2-CD1 4.16Å; I478-L482 WeakPolarHBondContact O-CG 3.39Å; I478-L482 PolarHBondContact O-N 3.42Å; F479-L482 CarbonylContact O-C 3.51Å; F479-L482 PolarHBondContact O-N 3.22Å; R480-L482 VanDerWaalsContact C-N 3.25Å; R480-L482 PolarHBondContact O-N 2.93Å; L482-L484 VanDerWaalsContact C-N 3.29Å; L482-L484 HydrophobicContact CB-CD1 3.99Å; L482-L484 HydrophobicContact CB-CG 4.13Å; L482-L484 HydrophobicContact CD1-CD1 4.3Å; L482-L484 PolarHBondContact O-N 3.12Å
483	G	97.3	Very high	98	Very high	51 Å²	51	50.2 Å²	50.2	53%	0.526	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	41.7	-174.6	0	0	0	0	0	112.5	F479 R480 H481	F479-G483 PolarHBondContact O-N 3.28Å; R480-G483 PolarHBondContact O-N 3.23Å; H481-G483 VanDerWaalsContact C-N 3.29Å
484	L	97.8	Very high	98.1	Very high	19 Å²	19	45.8 Å²	45.8	10%	0.099	23%	0.23	C	C	.	.			trans	-110.4	147.8	175.5	-70.3	172.3	0	0	0	109.9	C143 Q144 L444 F447 F479 L482	C143-L484 HydrophobicContact CB-CD1 4.12Å; Q144-L484 HydrophobicContact CG-CD2 3.54Å; L444-L484 HydrophobicContact CD1-CD1 3.53Å; F447-L484 HydrophobicContact CD1-CD1 3.83Å; F447-L484 HydrophobicContact CD1-CD2 4.13Å; F447-L484 HydrophobicContact CD1-CG 4.15Å; F447-L484 HydrophobicContact CE1-CD1 3.84Å; F447-L484 HydrophobicContact CE1-CD2 3.58Å; F447-L484 HydrophobicContact CE1-CG 3.63Å; F447-L484 HydrophobicContact CE2-CD2 4.14Å; F447-L484 HydrophobicContact CZ-CD2 3.59Å; F447-L484 HydrophobicContact CZ-CG 4.12Å; F479-L484 HydrophobicContact CB-CB 4.44Å; F479-L484 HydrophobicContact CD1-CB 3.79Å; F479-L484 HydrophobicContact CD1-CD1 4.39Å; F479-L484 PolarHBondContact O-N 3.05Å; L482-L484 VanDerWaalsContact C-N 3.29Å; L482-L484 HydrophobicContact CB-CD1 3.99Å; L482-L484 HydrophobicContact CB-CG 4.13Å; L482-L484 HydrophobicContact CD1-CD1 4.3Å; L482-L484 PolarHBondContact O-N 3.12Å
485	E	97.2	Very high	98.1	Very high	155 Å²	155	46.3 Å²	46.3	72%	0.724	23%	0.229	S	C	*	.	P	Polyproline II helix	trans	-64.4	135.4	164.7	-174.1	178.2	175.5	0	0	109.3	F479 L487	F479-E485 WeakPolarHBondContact CD1-O 3.38Å; E485-L487 PolarHBondContact O-N 3.28Å
486	Y	98.4	Very high	98.1	Very high	75 Å²	75	48.3 Å²	48.3	29%	0.294	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-67	125.3	179.6	178.7	-106.4	0	0	0	110.6	E475 E476 F479 P488 R492	E475-Y486 HydrophobicContact CB-CE2 3.92Å; E475-Y486 PolarHBondContact OE2-OH 2.94Å; E476-Y486 HydrophobicContact CB-CD2 4.21Å; E476-Y486 HydrophobicContact CB-CE2 4.48Å; E476-Y486 HydrophobicContact CG-CD1 4.08Å; E476-Y486 HydrophobicContact CG-CD2 3.61Å; E476-Y486 HydrophobicContact CG-CE1 4.14Å; E476-Y486 HydrophobicContact CG-CE2 3.66Å; E476-Y486 HydrophobicContact CG-CG 3.81Å; F479-Y486 HydrophobicContact CB-CD2 4.33Å; F479-Y486 AromaticContact CD2-CD2 3.68Å; F479-Y486 HydrophobicContact CD2-CD2 3.68Å; F479-Y486 HydrophobicContact CD2-CE2 4.13Å; F479-Y486 HydrophobicContact CE2-CD2 4.01Å; F479-Y486 HydrophobicContact CE2-CE2 4.15Å; F479-Y486 AromaticContact CG-CD2 3.95Å; F479-Y486 HydrophobicContact CG-CD2 3.95Å; Y486-P488 HydrophobicContact CE1-CB 4.2Å; Y486-R492 PolarHBondContact OH-NH2 2.88Å
487	L	98.4	Very high	98	Very high	11 Å²	11	45 Å²	45	6%	0.058	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-103.5	120.7	171.8	-66.9	174	0	0	0	108.8	C143 R145 P146 F440 F479 E485 Q491 R492	C143-L487 WeakPolarHBondContact O-CD1 3.48Å; R145-L487 WeakPolarHBondContact O-CD1 3.34Å; P146-L487 HydrophobicContact CB-CD2 4Å; F440-L487 HydrophobicContact CE2-CD1 3.81Å; F440-L487 HydrophobicContact CZ-CD1 4.29Å; F479-L487 HydrophobicContact CE1-CB 4.16Å; F479-L487 HydrophobicContact CE1-CG 4.45Å; F479-L487 HydrophobicContact CZ-CB 4.37Å; E485-L487 PolarHBondContact O-N 3.28Å; L487-Q491 HydrophobicContact CB-CB 4.5Å; L487-Q491 HydrophobicContact CD2-CB 4.41Å; L487-R492 HydrophobicContact CB-CG 4.37Å; L487-R492 VanDerWaalsContact O-CZ 3.22Å; L487-R492 PolarHBondContact O-NE 3.24Å; L487-R492 PolarHBondContact O-NH2 2.77Å
488	P	98.4	Very high	98	Very high	47 Å²	47	46.8 Å²	46.8	31%	0.305	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-66.2	157.9	174	30.7	-35.9	0	0	0	110.4	Y486 E490 Q491 R492	Y486-P488 HydrophobicContact CE1-CB 4.2Å; P488-E490 PolarHBondContact O-N 3.27Å; P488-E490 VanDerWaalsContact O-N 3.1Å; P488-Q491 HydrophobicContact CG-CB 4.21Å; P488-Q491 HydrophobicContact CG-CG 3.76Å; P488-Q491 PolarHBondContact O-N 3.13Å; P488-R492 WeakPolarHBondContact O-CG 3.48Å
489	P	98.7	Very high	98	Very high	9 Å²	9	49.7 Å²	49.7	6%	0.058	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-50.2	-38	-174.8	-30.4	38.3	0	0	0	115	R322 R323 T435 Q491 R492	R322-P489 HydrophobicContact CG-CB 4.12Å; R322-P489 HydrophobicContact CG-CG 4.3Å; R322-P489 WeakPolarHBondContact O-CB 3.41Å; R323-P489 WeakPolarHBondContact CB-O 3.3Å; R323-P489 WeakPolarHBondContact CG-O 3.24Å; T435-P489 HydrophobicContact CG2-CB 3.93Å; T435-P489 HydrophobicContact CG2-CG 4.44Å; P489-Q491 PolarHBondContact O-N 2.72Å; P489-R492 WeakPolarHBondContact O-CB 3.46Å; P489-R492 PolarHBondContact O-N 2.82Å
490	E	98.4	Very high	98	Very high	92 Å²	92	52.9 Å²	52.9	43%	0.43	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-65.2	-20.8	-179.4	-59.6	75	-164.2	0	0	112.9	P488 N493	P488-E490 PolarHBondContact O-N 3.27Å; P488-E490 VanDerWaalsContact O-N 3.1Å; E490-N493 PolarHBondContact O-ND2 3.17Å
491	Q	98.4	Very high	98	Very high	63 Å²	63	44.5 Å²	44.5	29%	0.294	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-97.9	9.5	177.6	-60.9	-62.5	-19.3	0	0	112.8	P146 T147 L487 P488 P489	P146-Q491 HydrophobicContact CB-CB 4.09Å; P146-Q491 HydrophobicContact CB-CG 4.25Å; T147-Q491 PolarHBondContact N-O 2.71Å; T147-Q491 CarbonylContact O-C 3.5Å; T147-Q491 WeakPolarHBondContact O-CA 3.29Å; L487-Q491 HydrophobicContact CB-CB 4.5Å; L487-Q491 HydrophobicContact CD2-CB 4.41Å; P488-Q491 HydrophobicContact CG-CB 4.21Å; P488-Q491 HydrophobicContact CG-CG 3.76Å; P488-Q491 PolarHBondContact O-N 3.13Å; P489-Q491 PolarHBondContact O-N 2.72Å
492	R	98.6	Very high	98	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-104.4	24.5	179.3	-52.8	180	-166.5	162	7.1	112.4	S437 F440 E475 Y486 L487 P488 P489 A494	S437-R492 VanDerWaalsContact CB-O 3.3Å; S437-R492 WeakPolarHBondContact CB-O 3.34Å; S437-R492 PolarHBondContact N-O 2.83Å; S437-R492 VanDerWaalsContact N-O 3.1Å; F440-R492 HydrophobicContact CB-CB 4.5Å; F440-R492 HydrophobicContact CD1-CB 4.2Å; F440-R492 HydrophobicContact CD1-CG 4.3Å; F440-R492 HydrophobicContact CD2-CB 3.83Å; F440-R492 HydrophobicContact CD2-CG 4.09Å; F440-R492 HydrophobicContact CE1-CB 4.42Å; F440-R492 HydrophobicContact CE1-CG 4.02Å; F440-R492 HydrophobicContact CE2-CB 4.05Å; F440-R492 HydrophobicContact CE2-CG 3.76Å; F440-R492 HydrophobicContact CG-CB 3.91Å; F440-R492 HydrophobicContact CG-CG 4.35Å; F440-R492 HydrophobicContact CZ-CB 4.36Å; F440-R492 HydrophobicContact CZ-CG 3.75Å; E475-R492 VanDerWaalsContact CD-NH1 3.33Å; E475-R492 IonicContact OE1-CZ 3.92Å; E475-R492 IonicContact OE1-NH1 3.2Å; E475-R492 PolarHBondContact OE1-NH1 3.17Å; E475-R492 IonicContact OE1-NH2 3.48Å; E475-R492 IonicContact OE2-CZ 2.75Å; E475-R492 IonicContact OE2-NH1 2.98Å; E475-R492 PolarHBondContact OE2-NH1 3.02Å; E475-R492 IonicContact OE2-NH2 3.99Å; E475-R492 PolarHBondContact OE2-NH2 3.14Å; Y486-R492 PolarHBondContact OH-NH2 2.88Å; L487-R492 HydrophobicContact CB-CG 4.37Å; L487-R492 VanDerWaalsContact O-CZ 3.22Å; L487-R492 PolarHBondContact O-NE 3.24Å; L487-R492 PolarHBondContact O-NH2 2.77Å; P488-R492 WeakPolarHBondContact O-CG 3.48Å; P489-R492 WeakPolarHBondContact O-CB 3.46Å; P489-R492 PolarHBondContact O-N 2.82Å; R492-A494 PolarHBondContact O-N 3.47Å; R492-A494 VanDerWaalsContact O-N 3.12Å
493	N	98.5	Very high	98.1	Very high	14 Å²	14	45.7 Å²	45.7	8%	0.075	25%	0.247	C	C	.	.			trans	-85.4	39.5	-178.5	-71.3	-64.2	0	0	0	113.4	T147 R323 E490	T147-N493 VanDerWaalsContact CG2-O 3.26Å; T147-N493 WeakPolarHBondContact CG2-O 3.37Å; T147-N493 WeakPolarHBondContact O-CB 3.37Å; T147-N493 PolarHBondContact O-N 2.87Å; T147-N493 VanDerWaalsContact O-N 3.08Å; R323-N493 WeakPolarHBondContact CB-OD1 3.27Å; R323-N493 PolarHBondContact NE-OD1 3Å; R323-N493 PolarHBondContact O-ND2 3.36Å; E490-N493 PolarHBondContact O-ND2 3.17Å
494	A	96.5	Very high	98.1	Very high	12 Å²	12	45.2 Å²	45.2	10%	0.099	22%	0.222	C	C	.	.			trans	-60.4	0	177.6	0	0	0	0	0	112.8	A142 S184 K187 S437 L439 F440 R492	A142-A494 HydrophobicContact CB-CB 3.72Å; S184-A494 WeakPolarHBondContact CB-OXT 3.42Å; K187-A494 PolarHBondContact NZ-OXT 2.99Å; S437-A494 PolarHBondContact OG-O 3.41Å; L439-A494 HydrophobicContact CB-CB 4.47Å; L439-A494 HydrophobicContact CD2-CB 4.4Å; F440-A494 HydrophobicContact CB-CB 4.21Å; R492-A494 PolarHBondContact O-N 3.47Å; R492-A494 VanDerWaalsContact O-N 3.12Å

Retrieved 494 of 494 residues in 428.1 ms (Link to these results)

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