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Succinate dehydrogenase [ubiquinone] iron-sulfur subunit, mitochondrial

Iron-sulfur protein (IP) subunit of succinate dehydrogenase (SDH) that is involved in complex II of the mitochondrial electron transport chain and is responsible for transferring electrons from succinate to ubiquinone (coenzyme Q). Iron-sulfur protein (IP) subunit of the succinate dehydrogenase complex (mitochondrial respiratory chain complex II), responsible for transferring electrons from succinate to ubiquinone (coenzyme Q). SDH also oxidizes malate to the non-canonical enol form of oxaloacetate, enol-oxaloacetate. Enol-oxaloacetate, which is a potent inhibitor of the succinate dehydrogenase activity, is further isomerized into keto-oxaloacetate.

AlphaFold DB , UniProt , Accession A0A096MXT4, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 280 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.8	Very low	35.9	Very low	252 Å²	252	138.1 Å²	138.1	100%	1.241	83%	0.833	S	S	*	*				0	115.7	0	-75.1	179.7	147.4	0	0	106.6
2	A	36.9	Very low	36.3	Very low	101 Å²	101	147.4 Å²	147.4	84%	0.835	84%	0.842	S	S	*	*			cis	-142.1	142.4	11.5	0	0	0	0	0	108.6
3	A	33.4	Very low	36.6	Very low	92 Å²	92	148.8 Å²	148.8	76%	0.76	84%	0.844	S	S	*	*			trans	-77.1	171	158	0	0	0	0	0	109.5
4	V	34.6	Very low	36.8	Very low	138 Å²	138	145.6 Å²	145.6	84%	0.836	83%	0.832	S	S	*	*			trans	130.6	131.5	160.3	168.2	0	0	0	0	109.5
5	V	34.8	Very low	37.1	Very low	103 Å²	103	142.9 Å²	142.9	62%	0.624	84%	0.835	S	S	*	*			cis	-165.4	135.9	-8	139.7	0	0	0	0	103.5	L7	V5-L7 HydrophobicContact CG1-CD1 3.52Å
6	A	36.8	Very low	37.3	Very low	104 Å²	104	140.6 Å²	140.6	86%	0.86	82%	0.823	S	S	*	*			trans	-80.4	125.1	167.5	0	0	0	0	0	109
7	L	33.9	Very low	37.6	Very low	148 Å²	148	141 Å²	141	78%	0.775	83%	0.828	S	S	*	*			trans	-114.1	117.7	168	-120.4	91.4	0	0	0	110.1	V5	V5-L7 HydrophobicContact CG1-CD1 3.52Å
8	S	38.5	Very low	37.7	Very low	102 Å²	102	143.7 Å²	143.7	71%	0.713	83%	0.828	S	S	*	*			trans	-79.2	132.6	168.8	114.9	0	0	0	0	109.2
9	L	37.3	Very low	37.6	Very low	163 Å²	163	139.8 Å²	139.8	85%	0.853	82%	0.823	S	S	*	*			trans	-132.9	104.5	157.9	-82.7	164	0	0	0	109	G11	L9-G11 PolarHBondContact O-N 2.89Å
10	R	38.2	Very low	38.1	Very low	244 Å²	244	137.3 Å²	137.3	92%	0.921	83%	0.827	S	S	*	*			trans	-70.5	115.1	165.6	-77	177.4	171.7	-179.2	-2.2	108.5
11	G	33.9	Very low	38.1	Very low	72 Å²	72	134.8 Å²	134.8	74%	0.742	82%	0.821	S	S	*	*			trans	-115.6	108.8	163.9	0	0	0	0	0	109.6	L9	L9-G11 PolarHBondContact O-N 2.89Å
12	R	40.7	Very low	38.4	Very low	250 Å²	250	128.7 Å²	128.7	94%	0.943	80%	0.802	S	S	*	*			trans	-76.3	128.9	166.6	-82.3	179.4	173	-174.9	-2.5	108.3
13	L	40.7	Very low	38.5	Very low	166 Å²	166	131.5 Å²	131.5	87%	0.869	80%	0.802	S	S	*	*			trans	-128.1	146.8	165.4	-82.5	162.3	0	0	0	109.5
14	P	38.2	Very low	39	Very low	103 Å²	103	135.5 Å²	135.5	67%	0.669	81%	0.805	S	S	*	*			trans	-80	152.2	-162.2	32.7	-34.1	0	0	0	112.5	T16	P14-T16 PolarHBondContact O-N 2.64Å
15	A	42.4	Very low	39.5	Very low	106 Å²	106	133.2 Å²	133.2	88%	0.876	80%	0.801	S	S	*	*			trans	-66.8	112.5	172.2	0	0	0	0	0	110.2
16	T	39.4	Very low	40.2	Very low	105 Å²	105	133.7 Å²	133.7	64%	0.644	81%	0.809	S	S	*	*			trans	-105.5	117.2	166.6	41.8	0	0	0	0	109.1	P14 F18	P14-T16 PolarHBondContact O-N 2.64Å; T16-F18 PolarHBondContact O-N 3.11Å
17	T	43.4	Very low	40.7	Very low	148 Å²	148	140.2 Å²	140.2	91%	0.908	81%	0.811	S	S	*	*			trans	-65.7	107.5	171.1	40	0	0	0	0	109.7
18	F	38.8	Very low	41.2	Very low	189 Å²	189	136.2 Å²	136.2	83%	0.829	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-97.1	119.3	166.8	-92.9	-85.7	0	0	0	109.8	T16	T16-F18 PolarHBondContact O-N 3.11Å
19	G	36.6	Very low	41.7	Very low	71 Å²	71	135.7 Å²	135.7	73%	0.732	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-59.8	144.7	176.3	0	0	0	0	0	112.2	A21	G19-A21 PolarHBondContact O-N 2.92Å
20	G	46.1	Very low	42.1	Very low	89 Å²	89	137 Å²	137	92%	0.918	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-62.5	116.6	177.6	0	0	0	0	0	111.8
21	A	39.8	Very low	42.9	Very low	84 Å²	84	131.5 Å²	131.5	69%	0.694	80%	0.803	S	S	*	*			trans	-113.7	106.2	151.7	0	0	0	0	0	106.5	G19 L23	G19-A21 PolarHBondContact O-N 2.92Å; A21-L23 VanDerWaalsContact C-N 3.29Å; A21-L23 PolarHBondContact O-N 3.22Å
22	C	41.3	Very low	44.1	Very low	124 Å²	124	132.6 Å²	132.6	84%	0.838	81%	0.805	S	S	*	*			trans	-66.6	91.9	171.7	-168.2	0	0	0	0	107.8	Q24	C22-Q24 VanDerWaalsContact C-N 3.32Å; C22-Q24 PolarHBondContact O-N 3Å
23	L	39.7	Very low	45.2	Very low	161 Å²	161	125.4 Å²	125.4	84%	0.843	80%	0.799	S	S	*	*			trans	-67.6	95.6	165.6	-93.5	141.7	0	0	0	107.2	A21 A25	A21-L23 VanDerWaalsContact C-N 3.29Å; A21-L23 PolarHBondContact O-N 3.22Å; L23-A25 VanDerWaalsContact C-N 3.27Å; L23-A25 PolarHBondContact O-N 3.3Å
24	Q	44.5	Very low	46.7	Very low	175 Å²	175	122.2 Å²	122.2	82%	0.818	80%	0.796	S	S	*	*			trans	-61.4	95	163	-79	-179	-18.5	0	0	107.9	C22 S26	C22-Q24 VanDerWaalsContact C-N 3.32Å; C22-Q24 PolarHBondContact O-N 3Å; Q24-S26 VanDerWaalsContact C-N 3.26Å; Q24-S26 PolarHBondContact O-N 3.47Å
25	A	45.4	Very low	48.9	Very low	91 Å²	91	121 Å²	121	75%	0.752	80%	0.795	S	S	*	*			trans	-68	92.3	163	0	0	0	0	0	107.2	L23 R27	L23-A25 VanDerWaalsContact C-N 3.27Å; L23-A25 PolarHBondContact O-N 3.3Å; A25-R27 VanDerWaalsContact C-N 3.29Å; A25-R27 PolarHBondContact O-N 3.46Å
26	S	48.3	Very low	51.2	Low	112 Å²	112	119.8 Å²	119.8	78%	0.783	79%	0.785	S	S	*	*			trans	-60.7	96.8	165.1	53.4	0	0	0	0	107.6	Q24 G28	Q24-S26 VanDerWaalsContact C-N 3.26Å; Q24-S26 PolarHBondContact O-N 3.47Å; S26-G28 PolarHBondContact O-N 3Å
27	R	46.7	Very low	53.9	Low	242 Å²	242	118.8 Å²	118.8	91%	0.913	78%	0.78	S	S	*	*			trans	-64.7	88.5	164.5	-79.7	-177.2	170.3	-176.7	-2.4	107	A25 A29	A25-R27 VanDerWaalsContact C-N 3.29Å; A25-R27 PolarHBondContact O-N 3.46Å; R27-A29 PolarHBondContact O-N 2.92Å
28	G	44.3	Very low	56.5	Low	64 Å²	64	116.3 Å²	116.3	66%	0.66	75%	0.754	S	S	*	*			trans	-58	107.4	162.7	0	0	0	0	0	107.1	S26 Q30	S26-G28 PolarHBondContact O-N 3Å; G28-Q30 VanDerWaalsContact C-N 3.25Å; G28-Q30 PolarHBondContact O-N 2.6Å
29	A	50.2	Low	59.3	Low	91 Å²	91	110.3 Å²	110.3	75%	0.752	73%	0.73	S	S	*	*			trans	-62.4	96.5	165.7	0	0	0	0	0	106.4	R27 T31	R27-A29 PolarHBondContact O-N 2.92Å; A29-T31 PolarHBondContact O-N 2.93Å
30	Q	46.5	Very low	62.3	Low	190 Å²	190	106.9 Å²	106.9	89%	0.888	70%	0.695	S	S	*	*			trans	-63.8	95.5	163.7	-78.6	177.9	-14.6	0	0	106	G28 A32	G28-Q30 VanDerWaalsContact C-N 3.25Å; G28-Q30 PolarHBondContact O-N 2.6Å; Q30-A32 VanDerWaalsContact C-N 3.35Å; Q30-A32 PolarHBondContact O-N 2.87Å
31	T	54.1	Low	64.8	Low	129 Å²	129	106.8 Å²	106.8	79%	0.791	67%	0.67	S	S	*	*			trans	-55.2	106.3	158.5	41.2	0	0	0	0	106	A29 A33	A29-T31 PolarHBondContact O-N 2.93Å; T31-A33 PolarHBondContact O-N 2.91Å
32	A	59.9	Low	67.6	Low	95 Å²	95	102.8 Å²	102.8	79%	0.785	64%	0.637	S	S	*	*			trans	-52.7	112.8	173	0	0	0	0	0	107.4	Q30 A34	Q30-A32 VanDerWaalsContact C-N 3.35Å; Q30-A32 PolarHBondContact O-N 2.87Å; A32-A34 PolarHBondContact O-N 2.72Å; A32-A34 VanDerWaalsContact O-N 3.16Å
33	A	63.2	Low	70.3	Confident	98 Å²	98	97.3 Å²	97.3	81%	0.81	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-55.2	124.3	176.1	0	0	0	0	0	107.8	T31 A35	T31-A33 PolarHBondContact O-N 2.91Å; A33-A35 PolarHBondContact O-N 2.67Å
34	A	71.7	Confident	73.2	Confident	99 Å²	99	89.7 Å²	89.7	82%	0.818	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-56.5	127.2	179.9	0	0	0	0	0	109	A32 A36	A32-A34 PolarHBondContact O-N 2.72Å; A32-A34 VanDerWaalsContact O-N 3.16Å; A34-A36 PolarHBondContact O-N 3.25Å
35	A	83.8	Confident	75.7	Confident	79 Å²	79	83.1 Å²	83.1	65%	0.653	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-55.1	140.6	179.1	0	0	0	0	0	110.4	A33	A33-A35 PolarHBondContact O-N 2.67Å
36	A	91.9	Very high	78.3	Confident	79 Å²	79	79.5 Å²	79.5	65%	0.653	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-54	137.2	179.7	0	0	0	0	0	110.9	A34 N66	A34-A36 PolarHBondContact O-N 3.25Å; A36-N66 PolarHBondContact O-ND2 3.16Å
37	P	95.3	Very high	80.7	Confident	85 Å²	85	77.2 Å²	77.2	55%	0.552	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-63.2	137.9	-174.7	25.8	-34	0	0	0	111.1	I39	P37-I39 HydrophobicContact CB-CD1 3.93Å; P37-I39 HydrophobicContact CB-CG1 4.36Å
38	R	97.8	Very high	83.2	Confident	95 Å²	95	67.9 Å²	67.9	36%	0.358	44%	0.437	S	S	.	.			trans	-105.1	81.9	-179.9	-74.4	179.9	58.9	-144.5	-1.2	109.4	K40 D64 L65 N66 L121	R38-K40 PolarHBondContact O-N 2.77Å; R38-D64 PolarHBondContact N-OD1 3.24Å; R38-L65 HydrophobicContact CB-CB 4.13Å; R38-L65 WeakPolarHBondContact O-CG 3.12Å; R38-L65 PolarHBondContact O-N 2.75Å; R38-N66 WeakPolarHBondContact CD-OD1 3.38Å; R38-L121 HydrophobicContact CB-CD1 4.15Å; R38-L121 HydrophobicContact CB-CD2 4.46Å; R38-L121 HydrophobicContact CG-CD1 4.41Å
39	I	98.4	Very high	85.7	Confident	63 Å²	63	67.6 Å²	67.6	32%	0.323	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	117.4	-172.9	-53.7	-54.8	0	0	0	111.4	P37 E62 D64	P37-I39 HydrophobicContact CB-CD1 3.93Å; P37-I39 HydrophobicContact CB-CG1 4.36Å; I39-E62 HydrophobicContact CG2-CB 3.69Å; I39-E62 HydrophobicContact CG2-CG 3.98Å; I39-D64 HydrophobicContact CD1-CB 3.95Å
40	K	98.6	Very high	88	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	136.3	174.1	179.9	65.7	179.7	-164.7	0	110.7	R38 F42 E62 V63 L65 I117 D118 N120 L121 K123 S125	R38-K40 PolarHBondContact O-N 2.77Å; K40-F42 HydrophobicContact CB-CE2 4.02Å; K40-F42 HydrophobicContact CG-CD2 4.25Å; K40-F42 HydrophobicContact CG-CE2 3.6Å; K40-F42 HydrophobicContact CG-CZ 3.82Å; K40-E62 WeakPolarHBondContact O-CA 3.03Å; K40-V63 PolarHBondContact N-O 2.92Å; K40-V63 PolarHBondContact O-N 2.86Å; K40-L65 HydrophobicContact CB-CD1 3.89Å; K40-L65 HydrophobicContact CB-CD2 3.63Å; K40-L65 HydrophobicContact CB-CG 3.71Å; K40-L65 HydrophobicContact CG-CD1 4.43Å; K40-L65 HydrophobicContact CG-CD2 4.25Å; K40-I117 HydrophobicContact CG-CG2 4.22Å; K40-D118 WeakPolarHBondContact CD-O 3.31Å; K40-D118 WeakPolarHBondContact CE-O 3.35Å; K40-D118 PolarHBondContact NZ-O 3.04Å; K40-N120 PolarHBondContact NZ-O 3.49Å; K40-L121 HydrophobicContact CB-CD2 4.22Å; K40-K123 WeakPolarHBondContact CE-O 3.33Å; K40-K123 PolarHBondContact NZ-O 3.14Å; K40-S125 WeakPolarHBondContact CE-OG 2.96Å
41	K	98.9	Very high	90.3	Very high	87 Å²	87	66.6 Å²	66.6	38%	0.378	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	131.7	176.3	-66.2	-176.6	-174.3	-152.2	0	112	T60 Y61 E62 V124 S125	K41-T60 HydrophobicContact CB-CG2 4.18Å; K41-T60 HydrophobicContact CG-CG2 4.39Å; K41-Y61 CarbonylContact C-O 3.53Å; K41-Y61 WeakPolarHBondContact CA-O 3.12Å; K41-E62 WeakPolarHBondContact CE-OE1 3.38Å; K41-E62 HydrophobicContact CG-CG 4.03Å; K41-E62 IonicContact NZ-OE1 3.12Å; K41-E62 PolarHBondContact NZ-OE1 3.09Å; K41-E62 VanDerWaalsContact NZ-OE1 3.12Å; K41-V124 HydrophobicContact CB-CB 4.38Å; K41-V124 HydrophobicContact CB-CG1 4.11Å; K41-V124 HydrophobicContact CB-CG2 3.94Å; K41-V124 HydrophobicContact CD-CG2 4.38Å; K41-S125 PolarHBondContact O-N 2.9Å
42	F	98.9	Very high	92.3	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	116.3	172.3	-64.8	-91.4	0	0	0	109.4	K40 I44 T60 Y61 V63 A75 I79 I117 S125 I127	K40-F42 HydrophobicContact CB-CE2 4.02Å; K40-F42 HydrophobicContact CG-CD2 4.25Å; K40-F42 HydrophobicContact CG-CE2 3.6Å; K40-F42 HydrophobicContact CG-CZ 3.82Å; F42-I44 HydrophobicContact CB-CD1 4.3Å; F42-I44 HydrophobicContact CB-CG1 4.17Å; F42-T60 CarbonylContact O-C 3.56Å; F42-T60 VanDerWaalsContact O-CA 3.29Å; F42-T60 WeakPolarHBondContact O-CA 3.46Å; F42-Y61 PolarHBondContact N-O 2.93Å; F42-Y61 PolarHBondContact O-N 3.14Å; F42-V63 HydrophobicContact CD2-CB 4.34Å; F42-V63 HydrophobicContact CD2-CG2 4.05Å; F42-V63 HydrophobicContact CE2-CB 4.03Å; F42-V63 HydrophobicContact CE2-CG2 4.13Å; F42-A75 HydrophobicContact CE1-CB 4.11Å; F42-A75 HydrophobicContact CE2-CB 3.89Å; F42-A75 HydrophobicContact CZ-CB 3.62Å; F42-I79 HydrophobicContact CB-CD1 4.44Å; F42-I117 HydrophobicContact CE1-CG2 4.42Å; F42-I117 HydrophobicContact CZ-CD1 4.15Å; F42-I117 HydrophobicContact CZ-CG1 4.13Å; F42-I117 HydrophobicContact CZ-CG2 3.82Å; F42-S125 CarbonylContact C-O 3.58Å; F42-S125 WeakPolarHBondContact CA-O 3.35Å; F42-I127 HydrophobicContact CD1-CD1 3.96Å
43	A	98.9	Very high	93.9	Very high	9 Å²	9	64.1 Å²	64.1	7%	0.074	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	115.5	170.7	0	0	0	0	0	108.6	M58 Q59 V124 S125 K126 I127	A43-M58 HydrophobicContact CB-CE 3.86Å; A43-M58 WeakPolarHBondContact O-CE 3.37Å; A43-Q59 CarbonylContact C-O 3.59Å; A43-Q59 WeakPolarHBondContact CA-O 3.39Å; A43-V124 HydrophobicContact CB-CG1 3.65Å; A43-S125 PolarHBondContact N-O 2.9Å; A43-K126 HydrophobicContact CB-CG 4.44Å; A43-K126 CarbonylContact O-C 3.58Å; A43-K126 WeakPolarHBondContact O-CA 3.22Å; A43-I127 PolarHBondContact O-N 3.08Å
44	I	98.9	Very high	95.5	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	133.5	-171.1	-50.7	-177.7	0	0	0	109.5	F42 R46 M58 Q59 Y61 L76 I79 L87 I127 L139	F42-I44 HydrophobicContact CB-CD1 4.3Å; F42-I44 HydrophobicContact CB-CG1 4.17Å; I44-R46 PolarHBondContact O-N 3.45Å; I44-M58 WeakPolarHBondContact O-CA 3.26Å; I44-Q59 PolarHBondContact N-O 3.17Å; I44-Q59 PolarHBondContact O-N 3.01Å; I44-Y61 HydrophobicContact CB-CD2 4.41Å; I44-Y61 HydrophobicContact CB-CE2 4.18Å; I44-Y61 HydrophobicContact CD1-CD2 3.6Å; I44-Y61 HydrophobicContact CD1-CE2 3.84Å; I44-Y61 HydrophobicContact CG1-CD2 3.95Å; I44-Y61 HydrophobicContact CG1-CE2 4.18Å; I44-L76 HydrophobicContact CD1-CD2 3.67Å; I44-I79 HydrophobicContact CD1-CD1 3.87Å; I44-L87 HydrophobicContact CD1-CD2 4.05Å; I44-L87 HydrophobicContact CG2-CD1 3.99Å; I44-I127 HydrophobicContact CD1-CD1 4.44Å; I44-I127 HydrophobicContact CG1-CB 4.34Å; I44-I127 HydrophobicContact CG1-CD1 4.3Å; I44-I127 HydrophobicContact CG2-CB 4.38Å; I44-L139 HydrophobicContact CG2-CD1 3.85Å; I44-L139 HydrophobicContact CG2-CD2 3.98Å; I44-L139 HydrophobicContact CG2-CG 4.08Å
45	Y	98.9	Very high	96.7	Very high	37 Å²	37	63.6 Å²	63.6	15%	0.145	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	131.2	171.3	176.4	-79.4	0	0	0	110.8	W47 P56 I127 Y128 P129 V135 D138	Y45-W47 HydrophobicContact CE1-CB 3.77Å; Y45-P56 HydrophobicContact CE2-CB 3.6Å; Y45-P56 HydrophobicContact CE2-CG 4.37Å; Y45-P56 WeakPolarHBondContact OH-CB 3.43Å; Y45-P56 WeakPolarHBondContact OH-CG 3.33Å; Y45-I127 PolarHBondContact N-O 2.77Å; Y45-Y128 AromaticContact CD2-CD1 3.99Å; Y45-Y128 HydrophobicContact CD2-CD1 3.99Å; Y45-Y128 HydrophobicContact CD2-CE1 4.41Å; Y45-Y128 HydrophobicContact CG-CD1 4.37Å; Y45-P129 HydrophobicContact CD1-CG 3.74Å; Y45-P129 HydrophobicContact CE1-CG 4.03Å; Y45-P129 HydrophobicContact CG-CG 4.1Å; Y45-V135 HydrophobicContact CE1-CG1 4Å; Y45-V135 HydrophobicContact CE1-CG2 4.32Å; Y45-D138 VanDerWaalsContact CD1-O 3.25Å; Y45-D138 WeakPolarHBondContact CD1-O 3.36Å; Y45-D138 WeakPolarHBondContact CE1-O 3.43Å
46	R	98.9	Very high	97.4	Very high	16 Å²	16	63.4 Å²	63.4	6%	0.06	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	139.4	177.5	-57.8	-55.8	-55.1	-89.1	15	110.6	I44 P56 H57 Q59 Y61 D84 T86 D138	I44-R46 PolarHBondContact O-N 3.45Å; R46-P56 WeakPolarHBondContact O-CA 3.23Å; R46-H57 WeakPolarHBondContact CB-NE2 3.48Å; R46-H57 PolarHBondContact N-O 3.38Å; R46-H57 PolarHBondContact O-N 2.87Å; R46-Q59 HydrophobicContact CG-CB 3.62Å; R46-Y61 PolarHBondContact NH1-OH 2.82Å; R46-D84 IonicContact CZ-OD2 3.65Å; R46-D84 IonicContact NH1-OD2 2.77Å; R46-D84 PolarHBondContact NH1-OD2 3.08Å; R46-D84 IonicContact NH2-OD2 2.73Å; R46-T86 PolarHBondContact NH2-OG1 3.39Å; R46-D138 VanDerWaalsContact CA-OD1 3.32Å; R46-D138 WeakPolarHBondContact CA-OD1 3.26Å; R46-D138 IonicContact CZ-OD1 2.86Å; R46-D138 IonicContact CZ-OD2 3.27Å; R46-D138 VanDerWaalsContact NE-CG 3.28Å; R46-D138 IonicContact NE-OD1 3.68Å; R46-D138 PolarHBondContact NE-OD1 3.24Å; R46-D138 IonicContact NE-OD2 3.71Å; R46-D138 PolarHBondContact NE-OD2 3.48Å; R46-D138 IonicContact NH2-OD1 3.72Å; R46-D138 IonicContact NH2-OD2 3.61Å; R46-D138 PolarHBondContact NH2-OD2 3.11Å; R46-D138 VanDerWaalsContact NH2-OD2 3.09Å
47	W	98.8	Very high	97.7	Very high	64 Å²	64	63.6 Å²	63.6	24%	0.242	35%	0.347	C	S	.	.			trans	-161.8	130.1	168.7	179.4	67.4	0	0	0	109.5	Y45 P49 D54 P56 V135 I136 D138	Y45-W47 HydrophobicContact CE1-CB 3.77Å; W47-P49 HydrophobicContact CH2-CB 3.61Å; W47-P49 HydrophobicContact CZ2-CB 4.27Å; W47-P49 HydrophobicContact CZ3-CB 3.8Å; W47-P49 HydrophobicContact CZ3-CG 4.34Å; W47-D54 PolarHBondContact NE1-O 3.15Å; W47-P56 HydrophobicContact CG-CG 4.32Å; W47-V135 HydrophobicContact CE3-CB 4.5Å; W47-V135 HydrophobicContact CE3-CG1 4.21Å; W47-V135 WeakPolarHBondContact CZ3-O 3.26Å; W47-I136 VanDerWaalsContact CZ3-O 3.25Å; W47-I136 WeakPolarHBondContact CZ3-O 3.46Å; W47-D138 PolarHBondContact N-OD1 3Å; W47-D138 VanDerWaalsContact N-OD1 3.09Å; W47-D138 PolarHBondContact O-N 3.15Å
48	D	98.5	Very high	97.9	Very high	45 Å²	45	63 Å²	63	24%	0.241	34%	0.338	C	S	.	.			trans	-111.5	114.3	178.6	-159.6	-20.8	0	0	0	111.7	D50 K51 D54 K137	D48-D50 PolarHBondContact O-N 3.33Å; D48-D50 PolarHBondContact OD1-N 2.95Å; D48-D50 VanDerWaalsContact OD1-N 3.08Å; D48-K51 HydrophobicContact CB-CB 4.16Å; D48-K51 PolarHBondContact O-N 2.85Å; D48-D54 PolarHBondContact N-OD2 3.33Å; D48-K137 IonicContact OD1-NZ 3.09Å; D48-K137 PolarHBondContact OD1-NZ 3.26Å; D48-K137 IonicContact OD2-NZ 2.7Å; D48-K137 PolarHBondContact OD2-NZ 3.2Å
49	P	97.7	Very high	98	Very high	58 Å²	58	61.4 Å²	61.4	38%	0.377	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-25.6	176.7	29	-38.5	0	0	0	113.3	W47 K51 I136 K137	W47-P49 HydrophobicContact CH2-CB 3.61Å; W47-P49 HydrophobicContact CZ2-CB 4.27Å; W47-P49 HydrophobicContact CZ3-CB 3.8Å; W47-P49 HydrophobicContact CZ3-CG 4.34Å; P49-K51 VanDerWaalsContact C-N 3.25Å; P49-K51 PolarHBondContact O-N 2.93Å; P49-I136 VanDerWaalsContact CG-O 3.31Å; P49-I136 WeakPolarHBondContact CG-O 3.45Å; P49-K137 HydrophobicContact CG-CB 4.4Å
50	D	97.6	Very high	98	Very high	137 Å²	137	62.2 Å²	62.2	73%	0.733	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-10.1	-174.2	-58.2	-45.1	0	0	0	112.1	D48 K137	D48-D50 PolarHBondContact O-N 3.33Å; D48-D50 PolarHBondContact OD1-N 2.95Å; D48-D50 VanDerWaalsContact OD1-N 3.08Å; D50-K137 IonicContact OD2-NZ 2.77Å
51	K	96.4	Very high	98	Very high	123 Å²	123	62.5 Å²	62.5	54%	0.535	34%	0.344	S	S	.	.	S	Bend	trans	-101.7	106	-179.2	-173.7	178.3	167.4	-146.9	0	110.1	D48 P49 G53 D54	D48-K51 HydrophobicContact CB-CB 4.16Å; D48-K51 PolarHBondContact O-N 2.85Å; P49-K51 VanDerWaalsContact C-N 3.25Å; P49-K51 PolarHBondContact O-N 2.93Å; K51-G53 PolarHBondContact O-N 3.13Å; K51-D54 HydrophobicContact CB-CB 3.95Å; K51-D54 HydrophobicContact CD-CB 4.12Å; K51-D54 HydrophobicContact CG-CB 4.04Å; K51-D54 IonicContact NZ-OD1 2.85Å; K51-D54 PolarHBondContact NZ-OD1 2.67Å; K51-D54 VanDerWaalsContact O-CB 3.25Å; K51-D54 WeakPolarHBondContact O-CB 3.13Å; K51-D54 PolarHBondContact O-N 3.3Å; K51-D54 VanDerWaalsContact O-N 3.08Å
52	A	94.6	Very high	98	Very high	105 Å²	105	63.4 Å²	63.4	87%	0.868	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	127.9	-179.2	0	0	0	0	0	112.1	D54	A52-D54 VanDerWaalsContact C-N 3.26Å; A52-D54 PolarHBondContact O-N 3.41Å
53	G	94.6	Very high	98	Very high	68 Å²	68	63.5 Å²	63.5	70%	0.701	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.8	1.9	178.7	0	0	0	0	0	115.6	K51	K51-G53 PolarHBondContact O-N 3.13Å
54	D	96.5	Very high	98	Very high	27 Å²	27	64.3 Å²	64.3	14%	0.144	35%	0.353	C	S	.	.			trans	-61.1	138.9	-179.8	-158.2	53.4	0	0	0	111.4	W47 D48 K51 A52	W47-D54 PolarHBondContact NE1-O 3.15Å; D48-D54 PolarHBondContact N-OD2 3.33Å; K51-D54 HydrophobicContact CB-CB 3.95Å; K51-D54 HydrophobicContact CD-CB 4.12Å; K51-D54 HydrophobicContact CG-CB 4.04Å; K51-D54 IonicContact NZ-OD1 2.85Å; K51-D54 PolarHBondContact NZ-OD1 2.67Å; K51-D54 VanDerWaalsContact O-CB 3.25Å; K51-D54 WeakPolarHBondContact O-CB 3.13Å; K51-D54 PolarHBondContact O-N 3.3Å; K51-D54 VanDerWaalsContact O-N 3.08Å; A52-D54 VanDerWaalsContact C-N 3.26Å; A52-D54 PolarHBondContact O-N 3.41Å
55	K	97.6	Very high	97.9	Very high	158 Å²	158	65.3 Å²	65.3	69%	0.687	36%	0.358	S	S	*	.			trans	-112.1	143.2	178.8	-62.3	-61.1	-177.7	-175.7	0	109.6	H57	K55-H57 PolarHBondContact O-N 3.24Å; K55-H57 PolarHBondContact O-ND1 3.03Å; K55-H57 VanDerWaalsContact O-ND1 3.16Å
56	P	98.4	Very high	97.9	Very high	75 Å²	75	66.9 Å²	66.9	49%	0.487	37%	0.369	S	S	.	.			trans	-52.7	133.6	172.7	-29	36.9	0	0	0	112	Y45 R46 W47	Y45-P56 HydrophobicContact CE2-CB 3.6Å; Y45-P56 HydrophobicContact CE2-CG 4.37Å; Y45-P56 WeakPolarHBondContact OH-CB 3.43Å; Y45-P56 WeakPolarHBondContact OH-CG 3.33Å; R46-P56 WeakPolarHBondContact O-CA 3.23Å; W47-P56 HydrophobicContact CG-CG 4.32Å
57	H	98.6	Very high	97.8	Very high	83 Å²	83	73.5 Å²	73.5	38%	0.384	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	166.5	179	61.4	-81.9	0	0	0	111.1	R46 K55	R46-H57 WeakPolarHBondContact CB-NE2 3.48Å; R46-H57 PolarHBondContact N-O 3.38Å; R46-H57 PolarHBondContact O-N 2.87Å; K55-H57 PolarHBondContact O-N 3.24Å; K55-H57 PolarHBondContact O-ND1 3.03Å; K55-H57 VanDerWaalsContact O-ND1 3.16Å
58	M	98.8	Very high	97.8	Very high	72 Å²	72	71.6 Å²	71.6	36%	0.355	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	125.6	174.5	-63.9	-58.8	-65.9	0	0	109.3	A43 I44 Y128	A43-M58 HydrophobicContact CB-CE 3.86Å; A43-M58 WeakPolarHBondContact O-CE 3.37Å; I44-M58 WeakPolarHBondContact O-CA 3.26Å; M58-Y128 HydrophobicContact CE-CE1 3.95Å; M58-Y128 HydrophobicContact CE-CE2 4.2Å; M58-Y128 HydrophobicContact SD-CD1 4.14Å; M58-Y128 HydrophobicContact SD-CE1 3.33Å; M58-Y128 WeakPolarHBondContact SD-CE1 3.33Å; M58-Y128 VanDerWaalsContact SD-CZ 3.6Å
59	Q	98.8	Very high	97.8	Very high	63 Å²	63	70.9 Å²	70.9	29%	0.294	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	134	173	-173.2	173	-16.4	0	0	109.8	A43 I44 R46 Y61	A43-Q59 CarbonylContact C-O 3.59Å; A43-Q59 WeakPolarHBondContact CA-O 3.39Å; I44-Q59 PolarHBondContact N-O 3.17Å; I44-Q59 PolarHBondContact O-N 3.01Å; R46-Q59 HydrophobicContact CG-CB 3.62Å; Q59-Y61 HydrophobicContact CB-CE2 4.13Å; Q59-Y61 HydrophobicContact CG-CE1 4.42Å; Q59-Y61 HydrophobicContact CG-CE2 3.98Å; Q59-Y61 PolarHBondContact NE2-OH 3.43Å; Q59-Y61 VanDerWaalsContact NE2-OH 3.11Å; Q59-Y61 PolarHBondContact OE1-OH 2.82Å
60	T	98.8	Very high	97.9	Very high	79 Å²	79	71.9 Å²	71.9	49%	0.485	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	132.7	-179.9	-59.3	0	0	0	0	110.7	K41 F42	K41-T60 HydrophobicContact CB-CG2 4.18Å; K41-T60 HydrophobicContact CG-CG2 4.39Å; F42-T60 CarbonylContact O-C 3.56Å; F42-T60 VanDerWaalsContact O-CA 3.29Å; F42-T60 WeakPolarHBondContact O-CA 3.46Å
61	Y	98.9	Very high	97.9	Very high	7 Å²	7	67.5 Å²	67.5	3%	0.027	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	145.4	174.2	-59.7	-85.4	0	0	0	110.6	K41 F42 I44 R46 Q59 I79 I83 D84	K41-Y61 CarbonylContact C-O 3.53Å; K41-Y61 WeakPolarHBondContact CA-O 3.12Å; F42-Y61 PolarHBondContact N-O 2.93Å; F42-Y61 PolarHBondContact O-N 3.14Å; I44-Y61 HydrophobicContact CB-CD2 4.41Å; I44-Y61 HydrophobicContact CB-CE2 4.18Å; I44-Y61 HydrophobicContact CD1-CD2 3.6Å; I44-Y61 HydrophobicContact CD1-CE2 3.84Å; I44-Y61 HydrophobicContact CG1-CD2 3.95Å; I44-Y61 HydrophobicContact CG1-CE2 4.18Å; R46-Y61 PolarHBondContact NH1-OH 2.82Å; Q59-Y61 HydrophobicContact CB-CE2 4.13Å; Q59-Y61 HydrophobicContact CG-CE1 4.42Å; Q59-Y61 HydrophobicContact CG-CE2 3.98Å; Q59-Y61 PolarHBondContact NE2-OH 3.43Å; Q59-Y61 VanDerWaalsContact NE2-OH 3.11Å; Q59-Y61 PolarHBondContact OE1-OH 2.82Å; Y61-I79 HydrophobicContact CD1-CG2 3.47Å; Y61-I79 VanDerWaalsContact CD1-CG2 3.47Å; Y61-I79 HydrophobicContact CD2-CD1 4.23Å; Y61-I79 HydrophobicContact CD2-CG2 4.15Å; Y61-I79 HydrophobicContact CE1-CG2 3.59Å; Y61-I79 HydrophobicContact CE2-CG2 4.26Å; Y61-I79 HydrophobicContact CG-CD1 3.99Å; Y61-I79 HydrophobicContact CG-CG1 4.22Å; Y61-I79 HydrophobicContact CG-CG2 3.73Å; Y61-I83 HydrophobicContact CD1-CG2 4.04Å; Y61-I83 HydrophobicContact CE1-CG2 4.39Å; Y61-D84 HydrophobicContact CE1-CB 3.77Å; Y61-D84 PolarHBondContact OH-OD2 2.88Å
62	E	98.8	Very high	98.1	Very high	105 Å²	105	61.8 Å²	61.8	49%	0.491	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	125.3	176.4	-71.7	-170.1	178.8	0	0	109.5	I39 K40 K41	I39-E62 HydrophobicContact CG2-CB 3.69Å; I39-E62 HydrophobicContact CG2-CG 3.98Å; K40-E62 WeakPolarHBondContact O-CA 3.03Å; K41-E62 WeakPolarHBondContact CE-OE1 3.38Å; K41-E62 HydrophobicContact CG-CG 4.03Å; K41-E62 IonicContact NZ-OE1 3.12Å; K41-E62 PolarHBondContact NZ-OE1 3.09Å; K41-E62 VanDerWaalsContact NZ-OE1 3.12Å
63	V	98.7	Very high	98.3	Very high	3 Å²	3	56.9 Å²	56.9	2%	0.018	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	128.2	-177.3	178.1	0	0	0	0	109.7	K40 F42 L65 C68 K78 I79	K40-V63 PolarHBondContact N-O 2.92Å; K40-V63 PolarHBondContact O-N 2.86Å; F42-V63 HydrophobicContact CD2-CB 4.34Å; F42-V63 HydrophobicContact CD2-CG2 4.05Å; F42-V63 HydrophobicContact CE2-CB 4.03Å; F42-V63 HydrophobicContact CE2-CG2 4.13Å; V63-L65 PolarHBondContact O-N 3.46Å; V63-C68 HydrophobicContact CG1-CB 3.91Å; V63-K78 HydrophobicContact CG1-CD 3.87Å; V63-I79 HydrophobicContact CG2-CD1 3.92Å; V63-I79 HydrophobicContact CG2-CG1 3.61Å
64	D	98.5	Very high	98.5	Very high	26 Å²	26	56.1 Å²	56.1	14%	0.139	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	110.8	170.6	-178.4	11	0	0	0	110.6	R38 I39 N66 K67 C68	R38-D64 PolarHBondContact N-OD1 3.24Å; I39-D64 HydrophobicContact CD1-CB 3.95Å; D64-N66 PolarHBondContact O-N 3.4Å; D64-N66 WeakPolarHBondContact OD1-CB 3.41Å; D64-N66 PolarHBondContact OD1-N 3.02Å; D64-K67 CarbonylContact O-C 3.59Å; D64-K67 PolarHBondContact O-N 3.29Å; D64-C68 PolarHBondContact O-N 3.3Å
65	L	98.4	Very high	98.6	Very high	20 Å²	20	54.9 Å²	54.9	11%	0.105	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-66.4	-19.1	-179.5	-60.9	-170.5	0	0	0	113.3	R38 K40 V63 K67 I117 L121	R38-L65 HydrophobicContact CB-CB 4.13Å; R38-L65 WeakPolarHBondContact O-CG 3.12Å; R38-L65 PolarHBondContact O-N 2.75Å; K40-L65 HydrophobicContact CB-CD1 3.89Å; K40-L65 HydrophobicContact CB-CD2 3.63Å; K40-L65 HydrophobicContact CB-CG 3.71Å; K40-L65 HydrophobicContact CG-CD1 4.43Å; K40-L65 HydrophobicContact CG-CD2 4.25Å; V63-L65 PolarHBondContact O-N 3.46Å; L65-K67 PolarHBondContact O-N 3.14Å; L65-I117 HydrophobicContact CD1-CG2 4.25Å; L65-I117 HydrophobicContact CD2-CD1 4.1Å; L65-I117 HydrophobicContact CD2-CG2 3.92Å; L65-L121 HydrophobicContact CD1-CD2 3.83Å; L65-L121 HydrophobicContact CG-CD2 4.49Å
66	N	97.9	Very high	98.6	Very high	71 Å²	71	47.4 Å²	47.4	38%	0.38	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-70.4	-18.3	173.9	-65.1	-26.2	0	0	0	112.3	A36 R38 D64	A36-N66 PolarHBondContact O-ND2 3.16Å; R38-N66 WeakPolarHBondContact CD-OD1 3.38Å; D64-N66 PolarHBondContact O-N 3.4Å; D64-N66 WeakPolarHBondContact OD1-CB 3.41Å; D64-N66 PolarHBondContact OD1-N 3.02Å
67	K	98.2	Very high	98.7	Very high	154 Å²	154	46.5 Å²	46.5	67%	0.67	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-121.3	25	-176.5	-58.4	179.5	-174.3	177.5	0	112.1	D64 L65 K78	D64-K67 CarbonylContact O-C 3.59Å; D64-K67 PolarHBondContact O-N 3.29Å; L65-K67 PolarHBondContact O-N 3.14Å; K67-K78 WeakPolarHBondContact O-CD 3.25Å; K67-K78 VanDerWaalsContact O-CE 3.24Å; K67-K78 WeakPolarHBondContact O-CE 3.37Å; K67-K78 PolarHBondContact O-NZ 2.88Å
68	C	98.6	Very high	98.7	Very high	25 Å²	25	44 Å²	44	17%	0.169	23%	0.234	C	C	.	.	S	Bend	trans	-134.8	146	-177.8	-174.2	0	0	0	0	109.9	V63 D64 K78	V63-C68 HydrophobicContact CG1-CB 3.91Å; D64-C68 PolarHBondContact O-N 3.3Å; C68-K78 HydrophobicContact CB-CD 3.95Å
69	G	98.4	Very high	98.7	Very high	30 Å²	30	40.6 Å²	40.6	31%	0.309	22%	0.217	S	C	.	.			trans	-62.7	165	169.4	0	0	0	0	0	112.3	M71 D74 I117	G69-M71 VanDerWaalsContact C-N 3.32Å; G69-M71 PolarHBondContact O-N 3.3Å; G69-D74 WeakPolarHBondContact CA-OD2 3.37Å; G69-I117 WeakPolarHBondContact O-CD1 3.36Å
70	P	98.6	Very high	98.7	Very high	79 Å²	79	40.7 Å²	40.7	51%	0.513	22%	0.217	S	C	.	.	S	Bend	trans	-76.1	-14	-170.1	30.7	-35.6	0	0	0	114.7	D74 R116 I117	P70-D74 WeakPolarHBondContact CD-OD2 3.36Å; P70-R116 WeakPolarHBondContact O-CA 3.49Å; P70-I117 PolarHBondContact O-N 3Å
71	M	98.9	Very high	98.7	Very high	45 Å²	45	42.6 Å²	42.6	22%	0.222	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-100.7	153.4	-172.9	-55.4	-61.1	-176.1	0	0	111.9	G69 L73 D74 A75 C113 R115 R116 I117	G69-M71 VanDerWaalsContact C-N 3.32Å; G69-M71 PolarHBondContact O-N 3.3Å; M71-L73 PolarHBondContact O-N 3.02Å; M71-D74 WeakPolarHBondContact CA-OD2 3.45Å; M71-D74 WeakPolarHBondContact CB-OD2 3.48Å; M71-D74 PolarHBondContact N-OD2 3.42Å; M71-D74 VanDerWaalsContact O-CB 3.31Å; M71-D74 WeakPolarHBondContact O-CB 3.44Å; M71-D74 PolarHBondContact O-N 3.26Å; M71-A75 PolarHBondContact O-N 2.72Å; M71-C113 VanDerWaalsContact CG-O 3.26Å; M71-C113 WeakPolarHBondContact CG-O 3.24Å; M71-R115 CarbonylContact C-O 3.55Å; M71-R115 WeakPolarHBondContact CA-O 3.46Å; M71-R116 HydrophobicContact CE-CG 4.33Å; M71-R116 HydrophobicContact SD-CG 3.86Å; M71-I117 WeakPolarHBondContact O-CD1 3.47Å
72	V	98.9	Very high	98.7	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.012	25%	0.251	C	S	.	.	H	α-helix	trans	-60.6	-33.5	178.6	174.4	0	0	0	0	111.4	D74 A75 L76 I105 A112 R115 I117 I127	V72-D74 VanDerWaalsContact C-N 3.27Å; V72-D74 PolarHBondContact O-N 2.94Å; V72-A75 PolarHBondContact O-N 3.09Å; V72-L76 HydrophobicContact CG1-CD1 4.37Å; V72-L76 HydrophobicContact CG1-CG 4.37Å; V72-L76 WeakPolarHBondContact O-CG 3.39Å; V72-L76 PolarHBondContact O-N 2.7Å; V72-I105 HydrophobicContact CB-CD1 4.02Å; V72-I105 HydrophobicContact CG1-CD1 3.82Å; V72-I105 HydrophobicContact CG2-CD1 4.27Å; V72-I105 HydrophobicContact CG2-CG2 4.29Å; V72-A112 HydrophobicContact CG1-CB 4.48Å; V72-A112 PolarHBondContact N-O 2.55Å; V72-R115 HydrophobicContact CG2-CB 4.39Å; V72-R115 HydrophobicContact CG2-CG 4.11Å; V72-R115 WeakPolarHBondContact CG2-O 3.15Å; V72-R115 PolarHBondContact N-O 3.5Å; V72-I117 HydrophobicContact CG2-CG1 4.1Å; V72-I127 HydrophobicContact CG1-CD1 3.57Å
73	L	98.9	Very high	98.7	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.01	25%	0.251	C	S	.	.	H	α-helix	trans	-60.7	-36.5	173.4	-178.5	62	0	0	0	112.4	M71 A75 L76 I77 F89 R91 R94 A112 C113	M71-L73 PolarHBondContact O-N 3.02Å; L73-A75 VanDerWaalsContact C-N 3.31Å; L73-A75 PolarHBondContact O-N 3.42Å; L73-L76 PolarHBondContact O-N 3Å; L73-I77 HydrophobicContact CD1-CD1 4.06Å; L73-I77 HydrophobicContact CD1-CG1 4.13Å; L73-I77 HydrophobicContact CD2-CD1 4.35Å; L73-I77 HydrophobicContact CG-CD1 3.82Å; L73-I77 HydrophobicContact CG-CG1 4.33Å; L73-I77 WeakPolarHBondContact O-CG1 3.46Å; L73-I77 PolarHBondContact O-N 3.22Å; L73-F89 HydrophobicContact CD1-CD2 4.17Å; L73-F89 HydrophobicContact CD1-CE2 3.72Å; L73-R91 HydrophobicContact CD1-CB 3.84Å; L73-R91 HydrophobicContact CD1-CG 4.34Å; L73-R91 HydrophobicContact CD2-CB 4.2Å; L73-R94 HydrophobicContact CD2-CB 4.14Å; L73-A112 HydrophobicContact CB-CB 3.97Å; L73-A112 PolarHBondContact N-O 3.44Å; L73-C113 HydrophobicContact CB-CB 4.17Å; L73-C113 HydrophobicContact CD2-CB 3.56Å
74	D	98.9	Very high	98.7	Very high	53 Å²	53	49 Å²	49	28%	0.283	26%	0.257	S	S	.	.	H	α-helix	trans	-63.6	-42.2	177.9	-54.1	-41	0	0	0	110.2	G69 P70 M71 V72 I77 K78	G69-D74 WeakPolarHBondContact CA-OD2 3.37Å; P70-D74 WeakPolarHBondContact CD-OD2 3.36Å; M71-D74 WeakPolarHBondContact CA-OD2 3.45Å; M71-D74 WeakPolarHBondContact CB-OD2 3.48Å; M71-D74 PolarHBondContact N-OD2 3.42Å; M71-D74 VanDerWaalsContact O-CB 3.31Å; M71-D74 WeakPolarHBondContact O-CB 3.44Å; M71-D74 PolarHBondContact O-N 3.26Å; V72-D74 VanDerWaalsContact C-N 3.27Å; V72-D74 PolarHBondContact O-N 2.94Å; D74-I77 PolarHBondContact O-N 3.25Å; D74-K78 VanDerWaalsContact O-CB 3.26Å; D74-K78 WeakPolarHBondContact O-CB 3.3Å; D74-K78 PolarHBondContact O-N 2.98Å
75	A	98.9	Very high	98.7	Very high	1 Å²	1	52 Å²	52	1%	0.008	28%	0.28	C	S	.	.	H	α-helix	trans	-63.8	-43	174.4	0	0	0	0	0	112.2	F42 M71 V72 L73 K78 I79 I117	F42-A75 HydrophobicContact CE1-CB 4.11Å; F42-A75 HydrophobicContact CE2-CB 3.89Å; F42-A75 HydrophobicContact CZ-CB 3.62Å; M71-A75 PolarHBondContact O-N 2.72Å; V72-A75 PolarHBondContact O-N 3.09Å; L73-A75 VanDerWaalsContact C-N 3.31Å; L73-A75 PolarHBondContact O-N 3.42Å; A75-K78 PolarHBondContact O-N 3.36Å; A75-I79 WeakPolarHBondContact O-CB 3.43Å; A75-I79 WeakPolarHBondContact O-CD1 3.29Å; A75-I79 WeakPolarHBondContact O-CG1 3.48Å; A75-I79 PolarHBondContact O-N 3.46Å; A75-I117 HydrophobicContact CB-CD1 3.92Å
76	L	98.9	Very high	98.7	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-62.3	-43.4	177.2	-69.6	175.1	0	0	0	112.2	I44 V72 L73 K80 L87 F89 M103 A112 I127 L139	I44-L76 HydrophobicContact CD1-CD2 3.67Å; V72-L76 HydrophobicContact CG1-CD1 4.37Å; V72-L76 HydrophobicContact CG1-CG 4.37Å; V72-L76 WeakPolarHBondContact O-CG 3.39Å; V72-L76 PolarHBondContact O-N 2.7Å; L73-L76 PolarHBondContact O-N 3Å; L76-K80 WeakPolarHBondContact O-CB 3.3Å; L76-K80 PolarHBondContact O-N 3.03Å; L76-L87 HydrophobicContact CD2-CD2 4.2Å; L76-F89 HydrophobicContact CB-CD1 4.29Å; L76-F89 HydrophobicContact CB-CE1 3.79Å; L76-F89 HydrophobicContact CB-CE2 4.15Å; L76-F89 HydrophobicContact CB-CZ 3.72Å; L76-M103 HydrophobicContact CD1-CE 3.75Å; L76-M103 HydrophobicContact CD1-SD 3.74Å; L76-A112 HydrophobicContact CD1-CB 4.19Å; L76-I127 HydrophobicContact CD2-CD1 3.89Å; L76-I127 HydrophobicContact CG-CD1 4.42Å; L76-L139 HydrophobicContact CD1-CD1 4.43Å; L76-L139 HydrophobicContact CD2-CD1 4.22Å
77	I	98.9	Very high	98.8	Very high	56 Å²	56	51.2 Å²	51.2	29%	0.287	28%	0.278	S	S	.	.	H	α-helix	trans	-65.1	-43.5	176.2	-69.3	170.1	0	0	0	110.3	L73 D74 K80 N81 F89	L73-I77 HydrophobicContact CD1-CD1 4.06Å; L73-I77 HydrophobicContact CD1-CG1 4.13Å; L73-I77 HydrophobicContact CD2-CD1 4.35Å; L73-I77 HydrophobicContact CG-CD1 3.82Å; L73-I77 HydrophobicContact CG-CG1 4.33Å; L73-I77 WeakPolarHBondContact O-CG1 3.46Å; L73-I77 PolarHBondContact O-N 3.22Å; D74-I77 PolarHBondContact O-N 3.25Å; I77-K80 PolarHBondContact O-N 3.25Å; I77-N81 WeakPolarHBondContact CG2-ND2 3.49Å; I77-N81 WeakPolarHBondContact O-CB 3.35Å; I77-N81 VanDerWaalsContact O-CG 3.23Å; I77-N81 PolarHBondContact O-N 3.48Å; I77-F89 HydrophobicContact CG1-CE2 4.09Å; I77-F89 HydrophobicContact CG1-CZ 3.97Å
78	K	98.9	Very high	98.8	Very high	30 Å²	30	45.9 Å²	45.9	13%	0.13	26%	0.259	C	S	.	.	H	α-helix	trans	-60.9	-47.4	177.4	-175	170.7	-178.6	73.5	0	112	V63 K67 C68 D74 A75 K80 N81 E82	V63-K78 HydrophobicContact CG1-CD 3.87Å; K67-K78 WeakPolarHBondContact O-CD 3.25Å; K67-K78 VanDerWaalsContact O-CE 3.24Å; K67-K78 WeakPolarHBondContact O-CE 3.37Å; K67-K78 PolarHBondContact O-NZ 2.88Å; C68-K78 HydrophobicContact CB-CD 3.95Å; D74-K78 VanDerWaalsContact O-CB 3.26Å; D74-K78 WeakPolarHBondContact O-CB 3.3Å; D74-K78 PolarHBondContact O-N 2.98Å; A75-K78 PolarHBondContact O-N 3.36Å; K78-K80 VanDerWaalsContact C-N 3.3Å; K78-K80 PolarHBondContact O-N 2.94Å; K78-N81 PolarHBondContact O-N 2.87Å; K78-E82 WeakPolarHBondContact CE-OE2 3.41Å; K78-E82 IonicContact NZ-OE1 2.77Å; K78-E82 PolarHBondContact NZ-OE1 3.09Å; K78-E82 IonicContact NZ-OE2 2.65Å; K78-E82 PolarHBondContact NZ-OE2 3.09Å; K78-E82 WeakPolarHBondContact O-CB 3.23Å; K78-E82 PolarHBondContact O-N 3.44Å
79	I	98.9	Very high	98.8	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-56.2	-48.4	174.3	-68.9	161.8	0	0	0	109.8	F42 I44 Y61 V63 A75 N81 I83 D84 L87	F42-I79 HydrophobicContact CB-CD1 4.44Å; I44-I79 HydrophobicContact CD1-CD1 3.87Å; Y61-I79 HydrophobicContact CD1-CG2 3.47Å; Y61-I79 VanDerWaalsContact CD1-CG2 3.47Å; Y61-I79 HydrophobicContact CD2-CD1 4.23Å; Y61-I79 HydrophobicContact CD2-CG2 4.15Å; Y61-I79 HydrophobicContact CE1-CG2 3.59Å; Y61-I79 HydrophobicContact CE2-CG2 4.26Å; Y61-I79 HydrophobicContact CG-CD1 3.99Å; Y61-I79 HydrophobicContact CG-CG1 4.22Å; Y61-I79 HydrophobicContact CG-CG2 3.73Å; V63-I79 HydrophobicContact CG2-CD1 3.92Å; V63-I79 HydrophobicContact CG2-CG1 3.61Å; A75-I79 WeakPolarHBondContact O-CB 3.43Å; A75-I79 WeakPolarHBondContact O-CD1 3.29Å; A75-I79 WeakPolarHBondContact O-CG1 3.48Å; A75-I79 PolarHBondContact O-N 3.46Å; I79-N81 PolarHBondContact O-N 3.29Å; I79-I83 HydrophobicContact CG1-CD1 4.22Å; I79-I83 HydrophobicContact CG2-CB 4.43Å; I79-I83 CarbonylContact O-C 3.58Å; I79-I83 WeakPolarHBondContact O-CA 3.24Å; I79-I83 WeakPolarHBondContact O-CB 3.26Å; I79-I83 PolarHBondContact O-N 2.91Å; I79-D84 PolarHBondContact O-N 3.24Å; I79-L87 HydrophobicContact CB-CD2 4.09Å; I79-L87 HydrophobicContact CG2-CD2 3.61Å
80	K	98.9	Very high	98.8	Very high	64 Å²	64	49 Å²	49	28%	0.278	26%	0.258	S	S	.	.	H	α-helix	trans	-62.4	-41.8	-179.9	-171.3	179.2	179	62.3	0	113.2	L76 I77 K78 D84 S85 L87 F89	L76-K80 WeakPolarHBondContact O-CB 3.3Å; L76-K80 PolarHBondContact O-N 3.03Å; I77-K80 PolarHBondContact O-N 3.25Å; K78-K80 VanDerWaalsContact C-N 3.3Å; K78-K80 PolarHBondContact O-N 2.94Å; K80-D84 WeakPolarHBondContact CA-O 3.04Å; K80-D84 CarbonylContact O-C 3.58Å; K80-S85 PolarHBondContact NZ-O 2.81Å; K80-S85 WeakPolarHBondContact O-CA 3.33Å; K80-S85 WeakPolarHBondContact O-CB 3.28Å; K80-S85 PolarHBondContact O-N 2.81Å; K80-L87 WeakPolarHBondContact CD-O 3.39Å; K80-L87 PolarHBondContact NZ-O 3.25Å; K80-F89 HydrophobicContact CB-CE1 4.16Å; K80-F89 HydrophobicContact CB-CZ 4.48Å; K80-F89 HydrophobicContact CD-CE1 4.1Å; K80-F89 HydrophobicContact CD-CZ 4.33Å
81	N	98.9	Very high	98.9	Very high	120 Å²	120	51.9 Å²	51.9	64%	0.642	26%	0.259	S	S	*	.	H	α-helix	trans	-79.7	-33.1	-174	-70.2	-5.4	0	0	0	112.9	I77 K78 I79	I77-N81 WeakPolarHBondContact CG2-ND2 3.49Å; I77-N81 WeakPolarHBondContact O-CB 3.35Å; I77-N81 VanDerWaalsContact O-CG 3.23Å; I77-N81 PolarHBondContact O-N 3.48Å; K78-N81 PolarHBondContact O-N 2.87Å; I79-N81 PolarHBondContact O-N 3.29Å
82	E	98.8	Very high	98.8	Very high	127 Å²	127	53.6 Å²	53.6	59%	0.593	28%	0.275	S	S	*	.	H	α-helix	trans	-116.7	-17.6	-166.9	-59.5	176.4	-150.1	0	0	113.9	K78	K78-E82 WeakPolarHBondContact CE-OE2 3.41Å; K78-E82 IonicContact NZ-OE1 2.77Å; K78-E82 PolarHBondContact NZ-OE1 3.09Å; K78-E82 IonicContact NZ-OE2 2.65Å; K78-E82 PolarHBondContact NZ-OE2 3.09Å; K78-E82 WeakPolarHBondContact O-CB 3.23Å; K78-E82 PolarHBondContact O-N 3.44Å
83	I	98.6	Very high	98.8	Very high	96 Å²	96	54.4 Å²	54.4	49%	0.492	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.5	-58.7	-172	-50.5	177.4	0	0	0	111.8	Y61 I79	Y61-I83 HydrophobicContact CD1-CG2 4.04Å; Y61-I83 HydrophobicContact CE1-CG2 4.39Å; I79-I83 HydrophobicContact CG1-CD1 4.22Å; I79-I83 HydrophobicContact CG2-CB 4.43Å; I79-I83 CarbonylContact O-C 3.58Å; I79-I83 WeakPolarHBondContact O-CA 3.24Å; I79-I83 WeakPolarHBondContact O-CB 3.26Å; I79-I83 PolarHBondContact O-N 2.91Å
84	D	98.8	Very high	98.8	Very high	27 Å²	27	62.9 Å²	62.9	14%	0.144	31%	0.313	C	S	.	.			trans	-141.5	97	-177.1	-179.4	5.2	0	0	0	111.2	R46 Y61 I79 K80 T86 L87	R46-D84 IonicContact CZ-OD2 3.65Å; R46-D84 IonicContact NH1-OD2 2.77Å; R46-D84 PolarHBondContact NH1-OD2 3.08Å; R46-D84 IonicContact NH2-OD2 2.73Å; Y61-D84 HydrophobicContact CE1-CB 3.77Å; Y61-D84 PolarHBondContact OH-OD2 2.88Å; I79-D84 PolarHBondContact O-N 3.24Å; K80-D84 WeakPolarHBondContact CA-O 3.04Å; K80-D84 CarbonylContact O-C 3.58Å; D84-T86 PolarHBondContact O-N 3.2Å; D84-T86 VanDerWaalsContact O-N 3.17Å; D84-T86 WeakPolarHBondContact OD1-CA 3.37Å; D84-T86 VanDerWaalsContact OD1-CB 3.26Å; D84-T86 WeakPolarHBondContact OD1-CB 3.45Å; D84-T86 WeakPolarHBondContact OD1-CG2 3.4Å; D84-T86 PolarHBondContact OD1-N 3.02Å; D84-T86 PolarHBondContact OD1-OG1 3.42Å; D84-T86 PolarHBondContact OD2-OG1 3.27Å; D84-T86 VanDerWaalsContact OD2-OG1 3.1Å; D84-L87 WeakPolarHBondContact O-CB 3.44Å; D84-L87 PolarHBondContact O-N 2.99Å
85	S	98.6	Very high	98.8	Very high	89 Å²	89	66.2 Å²	66.2	62%	0.622	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-9.5	178.9	64.1	0	0	0	0	114.3	K80 L87	K80-S85 PolarHBondContact NZ-O 2.81Å; K80-S85 WeakPolarHBondContact O-CA 3.33Å; K80-S85 WeakPolarHBondContact O-CB 3.28Å; K80-S85 PolarHBondContact O-N 2.81Å; S85-L87 VanDerWaalsContact C-N 3.35Å
86	T	98.8	Very high	98.8	Very high	73 Å²	73	66.4 Å²	66.4	45%	0.448	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-19.8	174.7	75.9	0	0	0	0	112.7	R46 D84 T88	R46-T86 PolarHBondContact NH2-OG1 3.39Å; D84-T86 PolarHBondContact O-N 3.2Å; D84-T86 VanDerWaalsContact O-N 3.17Å; D84-T86 WeakPolarHBondContact OD1-CA 3.37Å; D84-T86 VanDerWaalsContact OD1-CB 3.26Å; D84-T86 WeakPolarHBondContact OD1-CB 3.45Å; D84-T86 WeakPolarHBondContact OD1-CG2 3.4Å; D84-T86 PolarHBondContact OD1-N 3.02Å; D84-T86 PolarHBondContact OD1-OG1 3.42Å; D84-T86 PolarHBondContact OD2-OG1 3.27Å; D84-T86 VanDerWaalsContact OD2-OG1 3.1Å; T86-T88 PolarHBondContact O-N 3.18Å; T86-T88 PolarHBondContact O-OG1 3.5Å
87	L	98.9	Very high	98.7	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	35%	0.352	C	S	.	.			trans	-57.6	121.8	177.8	175.4	61.6	0	0	0	110.8	I44 L76 I79 K80 D84 S85 F89	I44-L87 HydrophobicContact CD1-CD2 4.05Å; I44-L87 HydrophobicContact CG2-CD1 3.99Å; L76-L87 HydrophobicContact CD2-CD2 4.2Å; I79-L87 HydrophobicContact CB-CD2 4.09Å; I79-L87 HydrophobicContact CG2-CD2 3.61Å; K80-L87 WeakPolarHBondContact CD-O 3.39Å; K80-L87 PolarHBondContact NZ-O 3.25Å; D84-L87 WeakPolarHBondContact O-CB 3.44Å; D84-L87 PolarHBondContact O-N 2.99Å; S85-L87 VanDerWaalsContact C-N 3.35Å; L87-F89 HydrophobicContact CD2-CD1 4.4Å; L87-F89 HydrophobicContact CD2-CE1 4.2Å; L87-F89 HydrophobicContact CG-CD1 4.04Å; L87-F89 HydrophobicContact CG-CE1 4.15Å
88	T	98.9	Very high	98.7	Very high	42 Å²	42	70.4 Å²	70.4	26%	0.258	35%	0.353	S	S	.	.			trans	-118.2	129.7	-172.1	-57.4	0	0	0	0	112.5	T86 D138 L139 V140	T86-T88 PolarHBondContact O-N 3.18Å; T86-T88 PolarHBondContact O-OG1 3.5Å; T88-D138 PolarHBondContact N-OD2 3.45Å; T88-D138 VanDerWaalsContact O-CB 3.26Å; T88-D138 WeakPolarHBondContact O-CB 3.29Å; T88-L139 PolarHBondContact O-N 3.25Å; T88-V140 HydrophobicContact CG2-CG2 3.88Å
89	F	98.9	Very high	98.7	Very high	21 Å²	21	69.3 Å²	69.3	9%	0.092	35%	0.35	C	S	.	.			trans	-157.3	156.8	177.6	54.2	-89.6	0	0	0	110.9	L73 L76 I77 K80 L87 R91 L139	L73-F89 HydrophobicContact CD1-CD2 4.17Å; L73-F89 HydrophobicContact CD1-CE2 3.72Å; L76-F89 HydrophobicContact CB-CD1 4.29Å; L76-F89 HydrophobicContact CB-CE1 3.79Å; L76-F89 HydrophobicContact CB-CE2 4.15Å; L76-F89 HydrophobicContact CB-CZ 3.72Å; I77-F89 HydrophobicContact CG1-CE2 4.09Å; I77-F89 HydrophobicContact CG1-CZ 3.97Å; K80-F89 HydrophobicContact CB-CE1 4.16Å; K80-F89 HydrophobicContact CB-CZ 4.48Å; K80-F89 HydrophobicContact CD-CE1 4.1Å; K80-F89 HydrophobicContact CD-CZ 4.33Å; L87-F89 HydrophobicContact CD2-CD1 4.4Å; L87-F89 HydrophobicContact CD2-CE1 4.2Å; L87-F89 HydrophobicContact CG-CD1 4.04Å; L87-F89 HydrophobicContact CG-CE1 4.15Å; F89-R91 HydrophobicContact CD2-CB 4.38Å; F89-R91 HydrophobicContact CE2-CB 4.38Å; F89-R91 HydrophobicContact CE2-CG 4.26Å; F89-L139 HydrophobicContact CB-CB 4.05Å; F89-L139 HydrophobicContact CB-CD1 4.21Å
90	R	98.9	Very high	98.7	Very high	99 Å²	99	71.6 Å²	71.6	37%	0.374	37%	0.366	S	S	.	.			trans	-86.9	137.4	174.7	-68.1	-168.2	-178.1	106	-1	111.4	S100 C101 V140 P141	R90-S100 WeakPolarHBondContact CB-O 3.3Å; R90-C101 WeakPolarHBondContact O-CA 3.33Å; R90-C101 WeakPolarHBondContact O-CB 3.43Å; R90-V140 HydrophobicContact CG-CG1 4.21Å; R90-V140 HydrophobicContact CG-CG2 4.38Å; R90-V140 VanDerWaalsContact NH1-CG1 3.31Å; R90-V140 VanDerWaalsContact NH2-CG1 3.3Å; R90-P141 PolarHBondContact NH1-O 2.94Å; R90-P141 PolarHBondContact NH2-O 2.9Å
91	R	98.8	Very high	98.7	Very high	140 Å²	140	68.8 Å²	68.8	53%	0.528	36%	0.355	S	S	.	.			trans	-158.1	152.1	172.8	83.7	-60.2	174.5	-80.6	-0.7	111.4	L73 F89	L73-R91 HydrophobicContact CD1-CB 3.84Å; L73-R91 HydrophobicContact CD1-CG 4.34Å; L73-R91 HydrophobicContact CD2-CB 4.2Å; F89-R91 HydrophobicContact CD2-CB 4.38Å; F89-R91 HydrophobicContact CE2-CB 4.38Å; F89-R91 HydrophobicContact CE2-CG 4.26Å
92	S	98.7	Very high	98.7	Very high	81 Å²	81	63.6 Å²	63.6	57%	0.566	33%	0.328	S	S	*	.	S	Bend	trans	-148.1	-84.8	172.4	-176.8	0	0	0	0	112.1	R94	S92-R94 VanDerWaalsContact C-N 3.33Å; S92-R94 PolarHBondContact O-N 3.37Å; S92-R94 VanDerWaalsContact O-N 3.15Å
93	C	98.6	Very high	98.7	Very high	20 Å²	20	57.7 Å²	57.7	14%	0.135	30%	0.301	C	S	.	.	S	Bend	trans	-64.3	-21.9	-168.2	70.2	0	0	0	0	117.4	E95 I97 C98	C93-E95 HydrophobicContact CB-CG 4.21Å; C93-E95 PolarHBondContact O-N 3.18Å; C93-E95 PolarHBondContact SG-N 3.1Å; C93-I97 HydrophobicContact CB-CG2 3.7Å; C93-I97 PolarHBondContact SG-N 3.19Å; C93-I97 VanDerWaalsContact SG-N 3.42Å; C93-C98 HydrophobicContact CB-CB 3.94Å; C93-C98 PolarHBondContact SG-N 3.24Å; C93-C98 VanDerWaalsContact SG-N 3.36Å; C93-C98 PolarHBondContact SG-SG 3.43Å
94	R	98.3	Very high	98.7	Very high	179 Å²	179	53.9 Å²	53.9	68%	0.675	28%	0.281	S	S	*	.	S	Bend	trans	52.8	19	-174.2	54.4	74.1	158.6	122.6	3.2	117.9	L73 S92	L73-R94 HydrophobicContact CD2-CB 4.14Å; S92-R94 VanDerWaalsContact C-N 3.33Å; S92-R94 PolarHBondContact O-N 3.37Å; S92-R94 VanDerWaalsContact O-N 3.15Å
95	E	98.4	Very high	98.7	Very high	124 Å²	124	52.8 Å²	52.8	58%	0.579	28%	0.275	S	S	*	.	S	Bend	trans	-137.1	10.6	179.3	68.6	-151	157.9	0	0	114.3	C93 I97	C93-E95 HydrophobicContact CB-CG 4.21Å; C93-E95 PolarHBondContact O-N 3.18Å; C93-E95 PolarHBondContact SG-N 3.1Å; E95-I97 HydrophobicContact CG-CG2 3.99Å
96	G	98.6	Very high	98.7	Very high	5 Å²	5	52 Å²	52	5%	0.052	26%	0.264	C	S	.	.	S	Bend	trans	83.8	19.5	171.9	0	0	0	0	0	115.8	C113	G96-C113 VanDerWaalsContact CA-SG 3.59Å; G96-C113 PolarHBondContact N-SG 3.35Å
97	I	98.6	Very high	98.7	Very high	94 Å²	94	51.5 Å²	51.5	48%	0.482	27%	0.274	S	S	.	.	S	Bend	trans	-101.3	-33.4	178.9	-164.1	61.6	0	0	0	114.3	C93 E95 I187	C93-I97 HydrophobicContact CB-CG2 3.7Å; C93-I97 PolarHBondContact SG-N 3.19Å; C93-I97 VanDerWaalsContact SG-N 3.42Å; E95-I97 HydrophobicContact CG-CG2 3.99Å; I97-I187 HydrophobicContact CD1-CG2 4.21Å; I97-I187 WeakPolarHBondContact O-CB 3.37Å; I97-I187 WeakPolarHBondContact O-CG2 3.38Å
98	C	98.6	Very high	98.7	Very high	47 Å²	47	53 Å²	53	32%	0.318	29%	0.29	S	S	.	.	S	Bend	trans	-83.6	-14.2	-175.3	72.4	0	0	0	0	115.6	C93 S100	C93-C98 HydrophobicContact CB-CB 3.94Å; C93-C98 PolarHBondContact SG-N 3.24Å; C93-C98 VanDerWaalsContact SG-N 3.36Å; C93-C98 PolarHBondContact SG-SG 3.43Å; C98-S100 PolarHBondContact O-N 2.98Å; C98-S100 VanDerWaalsContact O-N 3.11Å; C98-S100 PolarHBondContact SG-N 3.07Å; C98-S100 PolarHBondContact SG-OG 3.03Å
99	G	98.6	Very high	98.7	Very high	7 Å²	7	51.4 Å²	51.4	7%	0.072	28%	0.279	C	S	.	.			trans	72.9	-7.9	-178	0	0	0	0	0	117.3	C101 A102	G99-C101 PolarHBondContact O-N 2.91Å; G99-A102 PolarHBondContact O-N 2.92Å
100	S	98.9	Very high	98.7	Very high	49 Å²	49	51.4 Å²	51.4	34%	0.343	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-32.2	-169.2	-46.3	0	0	0	0	115.9	R90 C98 A102	R90-S100 WeakPolarHBondContact CB-O 3.3Å; C98-S100 PolarHBondContact O-N 2.98Å; C98-S100 VanDerWaalsContact O-N 3.11Å; C98-S100 PolarHBondContact SG-N 3.07Å; C98-S100 PolarHBondContact SG-OG 3.03Å; S100-A102 VanDerWaalsContact C-N 3.28Å; S100-A102 PolarHBondContact O-N 2.83Å
101	C	98.9	Very high	98.7	Very high	5 Å²	5	46.8 Å²	46.8	3%	0.034	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	31.1	-174.5	65.7	0	0	0	0	113.4	R90 G99 M103 A112 C113	R90-C101 WeakPolarHBondContact O-CA 3.33Å; R90-C101 WeakPolarHBondContact O-CB 3.43Å; G99-C101 PolarHBondContact O-N 2.91Å; C101-M103 PolarHBondContact O-N 3.41Å; C101-A112 HydrophobicContact CB-CB 4.22Å; C101-A112 PolarHBondContact O-N 2.87Å; C101-C113 PolarHBondContact SG-SG 3Å
102	A	98.9	Very high	98.7	Very high	10 Å²	10	40.1 Å²	40.1	8%	0.083	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	125.7	173.5	0	0	0	0	0	110.7	G99 S100 T110 L111 L130 C189	G99-A102 PolarHBondContact O-N 2.92Å; S100-A102 VanDerWaalsContact C-N 3.28Å; S100-A102 PolarHBondContact O-N 2.83Å; A102-T110 WeakPolarHBondContact CA-O 3.29Å; A102-L111 HydrophobicContact CB-CD2 4.05Å; A102-L130 HydrophobicContact CB-CD1 4.12Å; A102-L130 HydrophobicContact CB-CD2 4.14Å; A102-L130 HydrophobicContact CB-CG 4.45Å; A102-C189 HydrophobicContact CB-CB 4.12Å; A102-C189 WeakPolarHBondContact CB-O 3.18Å
103	M	98.9	Very high	98.7	Very high	3 Å²	3	36.6 Å²	36.6	2%	0.015	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	171.6	-179.9	61.6	-175.2	68.5	0	0	110.4	L76 C101 I105 N109 T110 A112 I127 Y128 L139	L76-M103 HydrophobicContact CD1-CE 3.75Å; L76-M103 HydrophobicContact CD1-SD 3.74Å; C101-M103 PolarHBondContact O-N 3.41Å; M103-I105 HydrophobicContact CG-CD1 3.96Å; M103-I105 HydrophobicContact CG-CG1 3.78Å; M103-I105 HydrophobicContact SD-CD1 4.24Å; M103-I105 HydrophobicContact SD-CG1 4.29Å; M103-N109 WeakPolarHBondContact O-CA 3.23Å; M103-T110 PolarHBondContact N-O 3.25Å; M103-T110 PolarHBondContact O-N 3.43Å; M103-A112 HydrophobicContact CE-CB 3.77Å; M103-A112 HydrophobicContact CG-CB 4.36Å; M103-A112 HydrophobicContact SD-CB 3.8Å; M103-I127 HydrophobicContact CG-CG2 4.42Å; M103-I127 HydrophobicContact SD-CG2 3.57Å; M103-I127 VanDerWaalsContact SD-CG2 3.57Å; M103-Y128 WeakPolarHBondContact CB-O 3.42Å; M103-L139 HydrophobicContact CE-CD1 4.35Å; M103-L139 HydrophobicContact SD-CD1 4.22Å
104	N	98.9	Very high	98.7	Very high	16 Å²	16	38.6 Å²	38.6	9%	0.086	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	118.5	174.7	-171.4	-80.2	0	0	0	110.1	G107 G108 N109 I127 Y128 P131	N104-G107 PolarHBondContact ND2-O 3.37Å; N104-G107 VanDerWaalsContact ND2-O 3.09Å; N104-G107 WeakPolarHBondContact OD1-CA 3.48Å; N104-G107 PolarHBondContact OD1-N 3.24Å; N104-G107 VanDerWaalsContact OD1-N 3.12Å; N104-G108 CarbonylContact C-O 3.53Å; N104-G108 WeakPolarHBondContact CA-O 3.46Å; N104-N109 PolarHBondContact ND2-OD1 3.45Å; N104-I127 WeakPolarHBondContact O-CA 3.36Å; N104-Y128 PolarHBondContact N-O 2.99Å; N104-Y128 PolarHBondContact O-N 3.34Å; N104-P131 HydrophobicContact CB-CG 4.43Å
105	I	98.9	Very high	98.7	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.021	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	117.4	-179	-55.1	177.1	0	0	0	108	V72 M103 G107 G108 T110 A112 R115	V72-I105 HydrophobicContact CB-CD1 4.02Å; V72-I105 HydrophobicContact CG1-CD1 3.82Å; V72-I105 HydrophobicContact CG2-CD1 4.27Å; V72-I105 HydrophobicContact CG2-CG2 4.29Å; M103-I105 HydrophobicContact CG-CD1 3.96Å; M103-I105 HydrophobicContact CG-CG1 3.78Å; M103-I105 HydrophobicContact SD-CD1 4.24Å; M103-I105 HydrophobicContact SD-CG1 4.29Å; I105-G107 PolarHBondContact O-N 2.9Å; I105-G108 PolarHBondContact N-O 3.43Å; I105-G108 PolarHBondContact O-N 2.7Å; I105-T110 HydrophobicContact CB-CG2 4.11Å; I105-T110 HydrophobicContact CD1-CG2 3.73Å; I105-T110 HydrophobicContact CG1-CG2 4.06Å; I105-A112 HydrophobicContact CD1-CB 4.13Å; I105-R115 HydrophobicContact CD1-CB 4.01Å; I105-R115 HydrophobicContact CD1-CG 4Å; I105-R115 HydrophobicContact CG2-CG 4.21Å
106	N	98.4	Very high	98.8	Very high	72 Å²	72	38.1 Å²	38.1	39%	0.385	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	39.3	-177.4	-63	-23.3	0	0	0	113.2	S125 K126	N106-S125 WeakPolarHBondContact OD1-CA 3.35Å; N106-K126 PolarHBondContact N-O 3.41Å; N106-K126 PolarHBondContact OD1-N 3.02Å
107	G	98.1	Very high	98.8	Very high	64 Å²	64	38.6 Å²	38.6	66%	0.66	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.2	-10.8	177.4	0	0	0	0	0	115	N104 I105	N104-G107 PolarHBondContact ND2-O 3.37Å; N104-G107 VanDerWaalsContact ND2-O 3.09Å; N104-G107 WeakPolarHBondContact OD1-CA 3.48Å; N104-G107 PolarHBondContact OD1-N 3.24Å; N104-G107 VanDerWaalsContact OD1-N 3.12Å; I105-G107 PolarHBondContact O-N 2.9Å
108	G	98.7	Very high	98.7	Very high	32 Å²	32	36.7 Å²	36.7	33%	0.33	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	139.5	178.6	0	0	0	0	0	113.3	N104 I105	N104-G108 CarbonylContact C-O 3.53Å; N104-G108 WeakPolarHBondContact CA-O 3.46Å; I105-G108 PolarHBondContact N-O 3.43Å; I105-G108 PolarHBondContact O-N 2.7Å
109	N	98.9	Very high	98.7	Very high	7 Å²	7	38.6 Å²	38.6	4%	0.037	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	128.5	173.2	-63.7	-5.2	0	0	0	109.7	M103 N104 L130 P131 C191 T194 S195 T252	M103-N109 WeakPolarHBondContact O-CA 3.23Å; N104-N109 PolarHBondContact ND2-OD1 3.45Å; N109-L130 HydrophobicContact CB-CD2 4.4Å; N109-P131 WeakPolarHBondContact ND2-CD 3.35Å; N109-P131 WeakPolarHBondContact OD1-CD 3.44Å; N109-P131 WeakPolarHBondContact OD1-CG 3.3Å; N109-C191 HydrophobicContact CB-CB 3.96Å; N109-C191 PolarHBondContact ND2-O 3.2Å; N109-T194 VanDerWaalsContact ND2-C 3.27Å; N109-T194 PolarHBondContact ND2-O 2.92Å; N109-T194 PolarHBondContact ND2-OG1 2.88Å; N109-T194 VanDerWaalsContact ND2-OG1 3.08Å; N109-S195 PolarHBondContact ND2-N 3.32Å; N109-T252 HydrophobicContact CB-CG2 4.37Å; N109-T252 WeakPolarHBondContact CB-OG1 3.49Å; N109-T252 PolarHBondContact N-OG1 3.06Å; N109-T252 PolarHBondContact O-OG1 3.04Å
110	T	98.9	Very high	98.6	Very high	22 Å²	22	41.3 Å²	41.3	14%	0.135	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	-180	-178.7	-166	0	0	0	0	110.5	A102 M103 I105 R115	A102-T110 WeakPolarHBondContact CA-O 3.29Å; M103-T110 PolarHBondContact N-O 3.25Å; M103-T110 PolarHBondContact O-N 3.43Å; I105-T110 HydrophobicContact CB-CG2 4.11Å; I105-T110 HydrophobicContact CD1-CG2 3.73Å; I105-T110 HydrophobicContact CG1-CG2 4.06Å; T110-R115 HydrophobicContact CG2-CB 3.78Å; T110-R115 HydrophobicContact CG2-CG 3.86Å
111	L	98.9	Very high	98.6	Very high	2 Å²	2	42 Å²	42	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	124.2	173.5	-52.4	178	0	0	0	109	A102 C113 T114 R115 I187 C189 P254	A102-L111 HydrophobicContact CB-CD2 4.05Å; L111-C113 PolarHBondContact O-N 2.89Å; L111-C113 VanDerWaalsContact O-N 3.14Å; L111-T114 PolarHBondContact O-N 2.78Å; L111-T114 VanDerWaalsContact O-N 3.14Å; L111-R115 WeakPolarHBondContact O-CB 3.4Å; L111-R115 PolarHBondContact O-N 2.97Å; L111-I187 HydrophobicContact CD1-CD1 3.7Å; L111-I187 HydrophobicContact CD2-CD1 4.45Å; L111-C189 HydrophobicContact CD2-CB 3.97Å; L111-P254 HydrophobicContact CD1-CB 3.96Å; L111-P254 HydrophobicContact CD1-CG 3.98Å; L111-P254 HydrophobicContact CD2-CG 4.19Å; L111-P254 HydrophobicContact CG-CB 3.76Å; L111-P254 HydrophobicContact CG-CG 3.78Å
112	A	98.9	Very high	98.5	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-31.8	-179.7	0	0	0	0	0	113	V72 L73 L76 C101 M103 I105 T114	V72-A112 HydrophobicContact CG1-CB 4.48Å; V72-A112 PolarHBondContact N-O 2.55Å; L73-A112 HydrophobicContact CB-CB 3.97Å; L73-A112 PolarHBondContact N-O 3.44Å; L76-A112 HydrophobicContact CD1-CB 4.19Å; C101-A112 HydrophobicContact CB-CB 4.22Å; C101-A112 PolarHBondContact O-N 2.87Å; M103-A112 HydrophobicContact CE-CB 3.77Å; M103-A112 HydrophobicContact CG-CB 4.36Å; M103-A112 HydrophobicContact SD-CB 3.8Å; I105-A112 HydrophobicContact CD1-CB 4.13Å; A112-T114 VanDerWaalsContact C-N 3.31Å; A112-T114 PolarHBondContact O-N 3.02Å
113	C	98.9	Very high	98.5	Very high	7 Å²	7	54.4 Å²	54.4	5%	0.047	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-18.1	-179.1	63.6	0	0	0	0	115.2	M71 L73 G96 C101 L111	M71-C113 VanDerWaalsContact CG-O 3.26Å; M71-C113 WeakPolarHBondContact CG-O 3.24Å; L73-C113 HydrophobicContact CB-CB 4.17Å; L73-C113 HydrophobicContact CD2-CB 3.56Å; G96-C113 VanDerWaalsContact CA-SG 3.59Å; G96-C113 PolarHBondContact N-SG 3.35Å; C101-C113 PolarHBondContact SG-SG 3Å; L111-C113 PolarHBondContact O-N 2.89Å; L111-C113 VanDerWaalsContact O-N 3.14Å
114	T	98.8	Very high	98.5	Very high	62 Å²	62	57.3 Å²	57.3	38%	0.38	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.3	-4	178.1	58.7	0	0	0	0	112.4	L111 A112 R116	L111-T114 PolarHBondContact O-N 2.78Å; L111-T114 VanDerWaalsContact O-N 3.14Å; A112-T114 VanDerWaalsContact C-N 3.31Å; A112-T114 PolarHBondContact O-N 3.02Å; T114-R116 PolarHBondContact O-N 2.73Å
115	R	98.8	Very high	98.5	Very high	113 Å²	113	56.6 Å²	56.6	43%	0.426	31%	0.306	S	S	.	.	S	Bend	trans	-83.5	110.7	172.9	-174.5	60.4	174.6	-172.1	0.8	109.7	M71 V72 I105 T110 L111	M71-R115 CarbonylContact C-O 3.55Å; M71-R115 WeakPolarHBondContact CA-O 3.46Å; V72-R115 HydrophobicContact CG2-CB 4.39Å; V72-R115 HydrophobicContact CG2-CG 4.11Å; V72-R115 WeakPolarHBondContact CG2-O 3.15Å; V72-R115 PolarHBondContact N-O 3.5Å; I105-R115 HydrophobicContact CD1-CB 4.01Å; I105-R115 HydrophobicContact CD1-CG 4Å; I105-R115 HydrophobicContact CG2-CG 4.21Å; T110-R115 HydrophobicContact CG2-CB 3.78Å; T110-R115 HydrophobicContact CG2-CG 3.86Å; L111-R115 WeakPolarHBondContact O-CB 3.4Å; L111-R115 PolarHBondContact O-N 2.97Å
116	R	98.7	Very high	98.5	Very high	180 Å²	180	61.6 Å²	61.6	68%	0.679	33%	0.328	S	S	*	.	B	Isolated β-bridge	trans	-59.8	142.7	171.3	-71.1	-174.9	177.7	-103.3	1.6	111.2	P70 M71 T114	P70-R116 WeakPolarHBondContact O-CA 3.49Å; M71-R116 HydrophobicContact CE-CG 4.33Å; M71-R116 HydrophobicContact SD-CG 3.86Å; T114-R116 PolarHBondContact O-N 2.73Å
117	I	98.8	Very high	98.5	Very high	15 Å²	15	58.2 Å²	58.2	8%	0.077	31%	0.31	C	S	.	.			trans	-64.6	133.6	169.5	-63.2	168.8	0	0	0	108.7	K40 F42 L65 G69 P70 M71 V72 A75 T119	K40-I117 HydrophobicContact CG-CG2 4.22Å; F42-I117 HydrophobicContact CE1-CG2 4.42Å; F42-I117 HydrophobicContact CZ-CD1 4.15Å; F42-I117 HydrophobicContact CZ-CG1 4.13Å; F42-I117 HydrophobicContact CZ-CG2 3.82Å; L65-I117 HydrophobicContact CD1-CG2 4.25Å; L65-I117 HydrophobicContact CD2-CD1 4.1Å; L65-I117 HydrophobicContact CD2-CG2 3.92Å; G69-I117 WeakPolarHBondContact O-CD1 3.36Å; P70-I117 PolarHBondContact O-N 3Å; M71-I117 WeakPolarHBondContact O-CD1 3.47Å; V72-I117 HydrophobicContact CG2-CG1 4.1Å; A75-I117 HydrophobicContact CB-CD1 3.92Å; I117-T119 PolarHBondContact O-N 3.09Å
118	D	97.9	Very high	98.5	Very high	53 Å²	53	59 Å²	59	28%	0.283	29%	0.293	S	S	.	.			trans	-68.4	112.2	167.9	-179.7	-4.9	0	0	0	109.2	K40 N120	K40-D118 WeakPolarHBondContact CD-O 3.31Å; K40-D118 WeakPolarHBondContact CE-O 3.35Å; K40-D118 PolarHBondContact NZ-O 3.04Å; D118-N120 PolarHBondContact O-N 3.47Å; D118-N120 WeakPolarHBondContact OD1-CB 3.49Å; D118-N120 PolarHBondContact OD1-N 3.34Å
119	T	97.6	Very high	98.5	Very high	88 Å²	88	57.9 Å²	57.9	54%	0.54	28%	0.281	S	S	.	.			trans	-75.8	-4.7	-176.6	52.7	0	0	0	0	113.9	I117 L121	I117-T119 PolarHBondContact O-N 3.09Å; T119-L121 PolarHBondContact O-N 3.21Å; T119-L121 VanDerWaalsContact O-N 3.15Å
120	N	97.9	Very high	98.5	Very high	63 Å²	63	57.8 Å²	57.8	34%	0.337	28%	0.28	S	S	.	.			trans	-70.4	104.8	170.8	-174.5	-22.2	0	0	0	110.1	K40 D118 N122 K123	K40-N120 PolarHBondContact NZ-O 3.49Å; D118-N120 PolarHBondContact O-N 3.47Å; D118-N120 WeakPolarHBondContact OD1-CB 3.49Å; D118-N120 PolarHBondContact OD1-N 3.34Å; N120-N122 PolarHBondContact O-N 3.33Å; N120-N122 WeakPolarHBondContact OD1-CB 3.31Å; N120-N122 PolarHBondContact OD1-N 3.42Å; N120-K123 HydrophobicContact CB-CD 4.47Å; N120-K123 HydrophobicContact CB-CG 4.49Å; N120-K123 PolarHBondContact O-N 3.2Å
121	L	97.8	Very high	98.5	Very high	64 Å²	64	58.2 Å²	58.2	34%	0.335	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-21.3	-175.2	-53.3	-175.4	0	0	0	113.1	R38 K40 L65 T119 K123	R38-L121 HydrophobicContact CB-CD1 4.15Å; R38-L121 HydrophobicContact CB-CD2 4.46Å; R38-L121 HydrophobicContact CG-CD1 4.41Å; K40-L121 HydrophobicContact CB-CD2 4.22Å; L65-L121 HydrophobicContact CD1-CD2 3.83Å; L65-L121 HydrophobicContact CG-CD2 4.49Å; T119-L121 PolarHBondContact O-N 3.21Å; T119-L121 VanDerWaalsContact O-N 3.15Å; L121-K123 VanDerWaalsContact C-N 3.27Å; L121-K123 PolarHBondContact O-N 3.03Å
122	N	97.6	Very high	98.5	Very high	157 Å²	157	64.2 Å²	64.2	84%	0.84	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-11.4	179.4	-60.7	-27.3	0	0	0	113	N120	N120-N122 PolarHBondContact O-N 3.33Å; N120-N122 WeakPolarHBondContact OD1-CB 3.31Å; N120-N122 PolarHBondContact OD1-N 3.42Å
123	K	97.8	Very high	98.5	Very high	119 Å²	119	66 Å²	66	52%	0.517	32%	0.32	S	S	.	.	S	Bend	trans	-101.1	129.5	176.7	-67.5	-175.1	179.3	-178.2	0	110.3	K40 N120 L121	K40-K123 WeakPolarHBondContact CE-O 3.33Å; K40-K123 PolarHBondContact NZ-O 3.14Å; N120-K123 HydrophobicContact CB-CD 4.47Å; N120-K123 HydrophobicContact CB-CG 4.49Å; N120-K123 PolarHBondContact O-N 3.2Å; L121-K123 VanDerWaalsContact C-N 3.27Å; L121-K123 PolarHBondContact O-N 3.03Å
124	V	98.6	Very high	98.5	Very high	63 Å²	63	75.5 Å²	75.5	38%	0.382	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-80.8	124.7	169.9	-176.4	0	0	0	0	108.9	K41 A43	K41-V124 HydrophobicContact CB-CB 4.38Å; K41-V124 HydrophobicContact CB-CG1 4.11Å; K41-V124 HydrophobicContact CB-CG2 3.94Å; K41-V124 HydrophobicContact CD-CG2 4.38Å; A43-V124 HydrophobicContact CB-CG1 3.65Å
125	S	98.7	Very high	98.5	Very high	2 Å²	2	74 Å²	74	1%	0.014	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	121.4	173.2	-66.4	0	0	0	0	109.6	K40 K41 F42 A43 N106	K40-S125 WeakPolarHBondContact CE-OG 2.96Å; K41-S125 PolarHBondContact O-N 2.9Å; F42-S125 CarbonylContact C-O 3.58Å; F42-S125 WeakPolarHBondContact CA-O 3.35Å; A43-S125 PolarHBondContact N-O 2.9Å; N106-S125 WeakPolarHBondContact OD1-CA 3.35Å
126	K	98.9	Very high	98.5	Very high	109 Å²	109	72.4 Å²	72.4	47%	0.474	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	130.7	177.8	-61.7	-176.3	-178.8	-179.3	0	110.4	A43 N106 Y128	A43-K126 HydrophobicContact CB-CG 4.44Å; A43-K126 CarbonylContact O-C 3.58Å; A43-K126 WeakPolarHBondContact O-CA 3.22Å; N106-K126 PolarHBondContact N-O 3.41Å; N106-K126 PolarHBondContact OD1-N 3.02Å; K126-Y128 HydrophobicContact CB-CD2 4.4Å; K126-Y128 HydrophobicContact CB-CE2 3.82Å; K126-Y128 HydrophobicContact CD-CE2 4.35Å
127	I	98.9	Very high	98.5	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	123.5	-179.2	-54.4	179.1	0	0	0	109.1	F42 A43 I44 Y45 V72 L76 M103 N104 L139	F42-I127 HydrophobicContact CD1-CD1 3.96Å; A43-I127 PolarHBondContact O-N 3.08Å; I44-I127 HydrophobicContact CD1-CD1 4.44Å; I44-I127 HydrophobicContact CG1-CB 4.34Å; I44-I127 HydrophobicContact CG1-CD1 4.3Å; I44-I127 HydrophobicContact CG2-CB 4.38Å; Y45-I127 PolarHBondContact N-O 2.77Å; V72-I127 HydrophobicContact CG1-CD1 3.57Å; L76-I127 HydrophobicContact CD2-CD1 3.89Å; L76-I127 HydrophobicContact CG-CD1 4.42Å; M103-I127 HydrophobicContact CG-CG2 4.42Å; M103-I127 HydrophobicContact SD-CG2 3.57Å; M103-I127 VanDerWaalsContact SD-CG2 3.57Å; N104-I127 WeakPolarHBondContact O-CA 3.36Å; I127-L139 HydrophobicContact CG2-CD1 3.74Å; I127-L139 HydrophobicContact CG2-CD2 3.99Å
128	Y	98.9	Very high	98.5	Very high	80 Å²	80	65.2 Å²	65.2	31%	0.314	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	161.7	178.4	-66.7	-88.1	0	0	0	110.5	Y45 M58 M103 N104 K126	Y45-Y128 AromaticContact CD2-CD1 3.99Å; Y45-Y128 HydrophobicContact CD2-CD1 3.99Å; Y45-Y128 HydrophobicContact CD2-CE1 4.41Å; Y45-Y128 HydrophobicContact CG-CD1 4.37Å; M58-Y128 HydrophobicContact CE-CE1 3.95Å; M58-Y128 HydrophobicContact CE-CE2 4.2Å; M58-Y128 HydrophobicContact SD-CD1 4.14Å; M58-Y128 HydrophobicContact SD-CE1 3.33Å; M58-Y128 WeakPolarHBondContact SD-CE1 3.33Å; M58-Y128 VanDerWaalsContact SD-CZ 3.6Å; M103-Y128 WeakPolarHBondContact CB-O 3.42Å; N104-Y128 PolarHBondContact N-O 2.99Å; N104-Y128 PolarHBondContact O-N 3.34Å; K126-Y128 HydrophobicContact CB-CD2 4.4Å; K126-Y128 HydrophobicContact CB-CE2 3.82Å; K126-Y128 HydrophobicContact CD-CE2 4.35Å
129	P	98.9	Very high	98.5	Very high	10 Å²	10	63 Å²	63	7%	0.065	31%	0.307	C	S	.	.			trans	-58.3	174.1	166.2	-17.4	30.2	0	0	0	111.5	Y45 V135 D138 L139	Y45-P129 HydrophobicContact CD1-CG 3.74Å; Y45-P129 HydrophobicContact CE1-CG 4.03Å; Y45-P129 HydrophobicContact CG-CG 4.1Å; P129-V135 HydrophobicContact CB-CG2 4.15Å; P129-V135 HydrophobicContact CG-CG1 4.48Å; P129-V135 HydrophobicContact CG-CG2 3.84Å; P129-D138 WeakPolarHBondContact CG-O 3.33Å; P129-L139 HydrophobicContact CG-CD2 4.42Å
130	L	98.9	Very high	98.6	Very high	4 Å²	4	59.3 Å²	59.3	2%	0.021	29%	0.285	C	S	.	.	S	Bend	trans	-58.9	134.3	168.1	-69.3	178.1	0	0	0	110.2	A102 N109 M133 P141 L143 A190 T194	A102-L130 HydrophobicContact CB-CD1 4.12Å; A102-L130 HydrophobicContact CB-CD2 4.14Å; A102-L130 HydrophobicContact CB-CG 4.45Å; N109-L130 HydrophobicContact CB-CD2 4.4Å; L130-M133 HydrophobicContact CB-CG 4.08Å; L130-P141 HydrophobicContact CB-CG 4.31Å; L130-P141 HydrophobicContact CD1-CG 4.31Å; L130-P141 HydrophobicContact CG-CG 4.42Å; L130-L143 HydrophobicContact CD1-CD2 4.35Å; L130-A190 HydrophobicContact CD1-CB 4.13Å; L130-T194 HydrophobicContact CB-CG2 3.98Å; L130-T194 HydrophobicContact CD1-CG2 4.13Å; L130-T194 WeakPolarHBondContact CD2-OG1 3.06Å
131	P	98.9	Very high	98.7	Very high	32 Å²	32	56.6 Å²	56.6	21%	0.208	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	146	-172.6	-23.3	32.9	0	0	0	114	N104 N109 M133 T194 W200	N104-P131 HydrophobicContact CB-CG 4.43Å; N109-P131 WeakPolarHBondContact ND2-CD 3.35Å; N109-P131 WeakPolarHBondContact OD1-CD 3.44Å; N109-P131 WeakPolarHBondContact OD1-CG 3.3Å; P131-M133 VanDerWaalsContact C-N 3.26Å; P131-M133 PolarHBondContact O-N 3.22Å; P131-T194 WeakPolarHBondContact CD-O 3.19Å; P131-T194 WeakPolarHBondContact CG-O 3.44Å; P131-W200 HydrophobicContact CB-CZ2 4.03Å
132	H	98.7	Very high	98.7	Very high	128 Å²	128	56.5 Å²	56.5	59%	0.593	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	36.5	174.5	-156.1	-77.3	0	0	0	114.1	W200	H132-W200 HydrophobicContact CB-CB 3.96Å; H132-W200 HydrophobicContact CB-CD2 4.49Å; H132-W200 HydrophobicContact CB-CG 3.75Å; H132-W200 PolarHBondContact CE1-O 3.5Å; H132-W200 PolarHBondContact ND1-O 2.81Å
133	M	98.7	Very high	98.8	Very high	36 Å²	36	49.9 Å²	49.9	18%	0.177	24%	0.235	C	C	.	.			trans	-113.3	149.2	173.8	-57.3	-59.4	-62.6	0	0	109.8	L130 P131 V135 P141 D142 L143 T194	L130-M133 HydrophobicContact CB-CG 4.08Å; P131-M133 VanDerWaalsContact C-N 3.26Å; P131-M133 PolarHBondContact O-N 3.22Å; M133-V135 PolarHBondContact O-N 3.21Å; M133-P141 HydrophobicContact CB-CB 3.67Å; M133-P141 HydrophobicContact CG-CB 4.15Å; M133-D142 WeakPolarHBondContact CE-O 3.46Å; M133-L143 HydrophobicContact CE-CD2 3.9Å; M133-T194 HydrophobicContact CG-CG2 3.89Å; M133-T194 HydrophobicContact SD-CG2 3.6Å; M133-T194 VanDerWaalsContact SD-CG2 3.6Å
134	Y	98.7	Very high	98.8	Very high	208 Å²	208	47.4 Å²	47.4	82%	0.816	23%	0.232	S	C	*	.			trans	-63	130.3	164.3	-68.3	-71.9	0	0	0	109.1	P141 D142	Y134-P141 CarbonylContact O-C 3.53Å; Y134-P141 WeakPolarHBondContact O-CA 3.18Å; Y134-D142 PolarHBondContact O-N 2.99Å
135	V	98.8	Very high	98.8	Very high	30 Å²	30	47.5 Å²	47.5	18%	0.182	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	129.7	179.6	-179.4	0	0	0	0	108.6	Y45 W47 P129 M133 D138	Y45-V135 HydrophobicContact CE1-CG1 4Å; Y45-V135 HydrophobicContact CE1-CG2 4.32Å; W47-V135 HydrophobicContact CE3-CB 4.5Å; W47-V135 HydrophobicContact CE3-CG1 4.21Å; W47-V135 WeakPolarHBondContact CZ3-O 3.26Å; P129-V135 HydrophobicContact CB-CG2 4.15Å; P129-V135 HydrophobicContact CG-CG1 4.48Å; P129-V135 HydrophobicContact CG-CG2 3.84Å; M133-V135 PolarHBondContact O-N 3.21Å; V135-D138 WeakPolarHBondContact CG1-O 3.2Å
136	I	98.7	Very high	98.8	Very high	79 Å²	79	47.5 Å²	47.5	41%	0.405	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	-46.8	174.9	-61.8	173	0	0	0	110.1	W47 P49 V140 D142	W47-I136 VanDerWaalsContact CZ3-O 3.25Å; W47-I136 WeakPolarHBondContact CZ3-O 3.46Å; P49-I136 VanDerWaalsContact CG-O 3.31Å; P49-I136 WeakPolarHBondContact CG-O 3.45Å; I136-V140 HydrophobicContact CB-CG1 4.33Å; I136-V140 HydrophobicContact CD1-CG1 4.48Å; I136-V140 PolarHBondContact N-O 3.09Å; I136-D142 HydrophobicContact CD1-CB 3.94Å; I136-D142 HydrophobicContact CG1-CB 3.98Å
137	K	98.8	Very high	98.8	Very high	43 Å²	43	48 Å²	48	19%	0.187	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	136.2	174.7	-174.2	165.8	-174.9	131.4	0	109.3	D48 P49 D50 L139 V140	D48-K137 IonicContact OD1-NZ 3.09Å; D48-K137 PolarHBondContact OD1-NZ 3.26Å; D48-K137 IonicContact OD2-NZ 2.7Å; D48-K137 PolarHBondContact OD2-NZ 3.2Å; P49-K137 HydrophobicContact CG-CB 4.4Å; D50-K137 IonicContact OD2-NZ 2.77Å; K137-L139 PolarHBondContact O-N 3.25Å; K137-V140 WeakPolarHBondContact O-CB 3.14Å; K137-V140 WeakPolarHBondContact O-CG2 3.47Å; K137-V140 PolarHBondContact O-N 3.06Å
138	D	98.8	Very high	98.8	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.011	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	43.4	-113.7	178.3	-68.8	-24.6	0	0	0	113.2	Y45 R46 W47 T88 P129 V135 V140	Y45-D138 VanDerWaalsContact CD1-O 3.25Å; Y45-D138 WeakPolarHBondContact CD1-O 3.36Å; Y45-D138 WeakPolarHBondContact CE1-O 3.43Å; R46-D138 VanDerWaalsContact CA-OD1 3.32Å; R46-D138 WeakPolarHBondContact CA-OD1 3.26Å; R46-D138 IonicContact CZ-OD1 2.86Å; R46-D138 IonicContact CZ-OD2 3.27Å; R46-D138 VanDerWaalsContact NE-CG 3.28Å; R46-D138 IonicContact NE-OD1 3.68Å; R46-D138 PolarHBondContact NE-OD1 3.24Å; R46-D138 IonicContact NE-OD2 3.71Å; R46-D138 PolarHBondContact NE-OD2 3.48Å; R46-D138 IonicContact NH2-OD1 3.72Å; R46-D138 IonicContact NH2-OD2 3.61Å; R46-D138 PolarHBondContact NH2-OD2 3.11Å; R46-D138 VanDerWaalsContact NH2-OD2 3.09Å; W47-D138 PolarHBondContact N-OD1 3Å; W47-D138 VanDerWaalsContact N-OD1 3.09Å; W47-D138 PolarHBondContact O-N 3.15Å; T88-D138 PolarHBondContact N-OD2 3.45Å; T88-D138 VanDerWaalsContact O-CB 3.26Å; T88-D138 WeakPolarHBondContact O-CB 3.29Å; P129-D138 WeakPolarHBondContact CG-O 3.33Å; V135-D138 WeakPolarHBondContact CG1-O 3.2Å; D138-V140 VanDerWaalsContact C-N 3.32Å; D138-V140 PolarHBondContact O-N 3.3Å
139	L	98.9	Very high	98.8	Very high	5 Å²	5	47.5 Å²	47.5	3%	0.026	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	15	-176.4	-58.6	179.1	0	0	0	113.7	I44 L76 T88 F89 M103 I127 P129 K137 P141	I44-L139 HydrophobicContact CG2-CD1 3.85Å; I44-L139 HydrophobicContact CG2-CD2 3.98Å; I44-L139 HydrophobicContact CG2-CG 4.08Å; L76-L139 HydrophobicContact CD1-CD1 4.43Å; L76-L139 HydrophobicContact CD2-CD1 4.22Å; T88-L139 PolarHBondContact O-N 3.25Å; F89-L139 HydrophobicContact CB-CB 4.05Å; F89-L139 HydrophobicContact CB-CD1 4.21Å; M103-L139 HydrophobicContact CE-CD1 4.35Å; M103-L139 HydrophobicContact SD-CD1 4.22Å; I127-L139 HydrophobicContact CG2-CD1 3.74Å; I127-L139 HydrophobicContact CG2-CD2 3.99Å; P129-L139 HydrophobicContact CG-CD2 4.42Å; K137-L139 PolarHBondContact O-N 3.25Å; L139-P141 WeakPolarHBondContact O-CD 3.49Å
140	V	98.9	Very high	98.8	Very high	12 Å²	12	49.6 Å²	49.6	7%	0.073	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	98.4	-172.8	-174.9	0	0	0	0	110	T88 R90 I136 K137 D138	T88-V140 HydrophobicContact CG2-CG2 3.88Å; R90-V140 HydrophobicContact CG-CG1 4.21Å; R90-V140 HydrophobicContact CG-CG2 4.38Å; R90-V140 VanDerWaalsContact NH1-CG1 3.31Å; R90-V140 VanDerWaalsContact NH2-CG1 3.3Å; I136-V140 HydrophobicContact CB-CG1 4.33Å; I136-V140 HydrophobicContact CD1-CG1 4.48Å; I136-V140 PolarHBondContact N-O 3.09Å; K137-V140 WeakPolarHBondContact O-CB 3.14Å; K137-V140 WeakPolarHBondContact O-CG2 3.47Å; K137-V140 PolarHBondContact O-N 3.06Å; D138-V140 VanDerWaalsContact C-N 3.32Å; D138-V140 PolarHBondContact O-N 3.3Å
141	P	98.8	Very high	98.8	Very high	6 Å²	6	57.1 Å²	57.1	4%	0.039	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	156.6	173.1	31.7	-35.5	0	0	0	111.5	R90 L130 M133 Y134 L139 L143	R90-P141 PolarHBondContact NH1-O 2.94Å; R90-P141 PolarHBondContact NH2-O 2.9Å; L130-P141 HydrophobicContact CB-CG 4.31Å; L130-P141 HydrophobicContact CD1-CG 4.31Å; L130-P141 HydrophobicContact CG-CG 4.42Å; M133-P141 HydrophobicContact CB-CB 3.67Å; M133-P141 HydrophobicContact CG-CB 4.15Å; Y134-P141 CarbonylContact O-C 3.53Å; Y134-P141 WeakPolarHBondContact O-CA 3.18Å; L139-P141 WeakPolarHBondContact O-CD 3.49Å; P141-L143 HydrophobicContact CG-CD2 4.48Å; P141-L143 HydrophobicContact CG-CG 4.39Å
142	D	98.8	Very high	98.8	Very high	62 Å²	62	58.6 Å²	58.6	33%	0.332	29%	0.291	S	S	.	.			trans	-78.2	126.2	161.4	-173.7	8	0	0	0	110	M133 Y134 I136 S144	M133-D142 WeakPolarHBondContact CE-O 3.46Å; Y134-D142 PolarHBondContact O-N 2.99Å; I136-D142 HydrophobicContact CD1-CB 3.94Å; I136-D142 HydrophobicContact CG1-CB 3.98Å; D142-S144 VanDerWaalsContact CG-OG 3.23Å; D142-S144 VanDerWaalsContact OD1-CB 3.23Å; D142-S144 WeakPolarHBondContact OD1-CB 3.44Å; D142-S144 PolarHBondContact OD1-N 2.99Å; D142-S144 PolarHBondContact OD1-OG 3.29Å; D142-S144 PolarHBondContact OD2-OG 3.17Å
143	L	98.9	Very high	98.8	Very high	18 Å²	18	53 Å²	53	9%	0.094	27%	0.265	C	S	.	.			trans	-113.4	9.9	179.1	-67	175.5	0	0	0	112.4	L130 M133 P141 N145 F146 Y147 A190	L130-L143 HydrophobicContact CD1-CD2 4.35Å; M133-L143 HydrophobicContact CE-CD2 3.9Å; P141-L143 HydrophobicContact CG-CD2 4.48Å; P141-L143 HydrophobicContact CG-CG 4.39Å; L143-N145 PolarHBondContact O-N 3.02Å; L143-F146 HydrophobicContact CB-CB 4.46Å; L143-F146 HydrophobicContact CD2-CB 4.39Å; L143-F146 WeakPolarHBondContact O-CB 3.37Å; L143-F146 PolarHBondContact O-N 3.39Å; L143-F146 VanDerWaalsContact O-N 3.09Å; L143-Y147 HydrophobicContact CB-CD2 4.05Å; L143-Y147 HydrophobicContact CB-CE2 3.53Å; L143-Y147 HydrophobicContact CD1-CE2 4.5Å; L143-Y147 WeakPolarHBondContact O-CD2 3.39Å; L143-Y147 PolarHBondContact O-N 3.17Å; L143-A190 HydrophobicContact CD2-CB 4Å
144	S	98.8	Very high	98.8	Very high	66 Å²	66	53.7 Å²	53.7	46%	0.462	27%	0.268	S	S	.	.	H	α-helix	trans	-51.7	-50.9	-179.4	59.5	0	0	0	0	112.8	D142 F146 Y147 A148	D142-S144 VanDerWaalsContact CG-OG 3.23Å; D142-S144 VanDerWaalsContact OD1-CB 3.23Å; D142-S144 WeakPolarHBondContact OD1-CB 3.44Å; D142-S144 PolarHBondContact OD1-N 2.99Å; D142-S144 PolarHBondContact OD1-OG 3.29Å; D142-S144 PolarHBondContact OD2-OG 3.17Å; S144-F146 PolarHBondContact O-N 3.38Å; S144-Y147 PolarHBondContact O-N 3.09Å; S144-A148 PolarHBondContact O-N 2.99Å
145	N	98.8	Very high	98.8	Very high	66 Å²	66	45 Å²	45	35%	0.353	24%	0.237	S	C	.	.	H	α-helix	trans	-59.4	-42.9	175.9	175.9	48.2	0	0	0	112.6	L143 Y147 A148 Q149 G203	L143-N145 PolarHBondContact O-N 3.02Å; N145-Y147 VanDerWaalsContact C-N 3.33Å; N145-Y147 PolarHBondContact O-N 3.41Å; N145-A148 PolarHBondContact O-N 3.26Å; N145-Q149 VanDerWaalsContact CG-NE2 3.32Å; N145-Q149 PolarHBondContact ND2-NE2 3.02Å; N145-Q149 WeakPolarHBondContact O-CG 3.34Å; N145-Q149 PolarHBondContact O-N 3.02Å; N145-Q149 PolarHBondContact OD1-NE2 3.06Å; N145-G203 PolarHBondContact ND2-O 3.33Å
146	F	98.9	Very high	98.8	Very high	1 Å²	1	49.4 Å²	49.4	0%	0.004	25%	0.251	C	S	.	.	H	α-helix	trans	-59.7	-43.3	177.2	172.1	-94.8	0	0	0	111.6	L143 S144 Y150 L188 A190 A210	L143-F146 HydrophobicContact CB-CB 4.46Å; L143-F146 HydrophobicContact CD2-CB 4.39Å; L143-F146 WeakPolarHBondContact O-CB 3.37Å; L143-F146 PolarHBondContact O-N 3.39Å; L143-F146 VanDerWaalsContact O-N 3.09Å; S144-F146 PolarHBondContact O-N 3.38Å; F146-Y150 PolarHBondContact O-N 2.81Å; F146-Y150 VanDerWaalsContact O-N 3.09Å; F146-L188 HydrophobicContact CE1-CB 4.36Å; F146-A190 HydrophobicContact CD1-CB 4.22Å; F146-A190 HydrophobicContact CD2-CB 3.89Å; F146-A190 HydrophobicContact CE1-CB 4.08Å; F146-A190 HydrophobicContact CE2-CB 3.71Å; F146-A190 HydrophobicContact CG-CB 4.14Å; F146-A190 HydrophobicContact CZ-CB 3.83Å; F146-A210 HydrophobicContact CE2-CB 3.62Å; F146-A210 HydrophobicContact CZ-CB 3.8Å
147	Y	98.9	Very high	98.8	Very high	120 Å²	120	48.1 Å²	48.1	47%	0.471	25%	0.245	S	C	.	.	H	α-helix	trans	-71.1	-35.8	176.8	-61.7	-49.8	0	0	0	112.9	L143 S144 N145 Q149 Y150 K151	L143-Y147 HydrophobicContact CB-CD2 4.05Å; L143-Y147 HydrophobicContact CB-CE2 3.53Å; L143-Y147 HydrophobicContact CD1-CE2 4.5Å; L143-Y147 WeakPolarHBondContact O-CD2 3.39Å; L143-Y147 PolarHBondContact O-N 3.17Å; S144-Y147 PolarHBondContact O-N 3.09Å; N145-Y147 VanDerWaalsContact C-N 3.33Å; N145-Y147 PolarHBondContact O-N 3.41Å; Y147-Q149 VanDerWaalsContact C-N 3.33Å; Y147-Q149 PolarHBondContact O-N 3.49Å; Y147-Y150 PolarHBondContact O-N 3.36Å; Y147-K151 PolarHBondContact O-N 3.42Å
148	A	98.8	Very high	98.8	Very high	57 Å²	57	47.6 Å²	47.6	47%	0.471	24%	0.243	S	C	.	.	H	α-helix	trans	-61.5	-42	174.9	0	0	0	0	0	111.6	S144 N145 K151 S152	S144-A148 PolarHBondContact O-N 2.99Å; N145-A148 PolarHBondContact O-N 3.26Å; A148-K151 PolarHBondContact O-N 3.28Å; A148-S152 PolarHBondContact O-N 2.98Å
149	Q	98.9	Very high	98.7	Very high	12 Å²	12	50 Å²	50	6%	0.056	25%	0.253	C	S	.	.	H	α-helix	trans	-66.4	-38.2	174.1	-69.5	173.4	27.1	0	0	112.6	N145 Y147 K151 S152 Y199 G203 Y206 L207 V211	N145-Q149 VanDerWaalsContact CG-NE2 3.32Å; N145-Q149 PolarHBondContact ND2-NE2 3.02Å; N145-Q149 WeakPolarHBondContact O-CG 3.34Å; N145-Q149 PolarHBondContact O-N 3.02Å; N145-Q149 PolarHBondContact OD1-NE2 3.06Å; Y147-Q149 VanDerWaalsContact C-N 3.33Å; Y147-Q149 PolarHBondContact O-N 3.49Å; Q149-K151 VanDerWaalsContact C-N 3.29Å; Q149-K151 PolarHBondContact O-N 2.89Å; Q149-S152 PolarHBondContact O-N 2.78Å; Q149-S152 PolarHBondContact O-OG 3.03Å; Q149-Y199 PolarHBondContact NE2-OH 2.73Å; Q149-Y199 PolarHBondContact OE1-OH 3.02Å; Q149-G203 PolarHBondContact NE2-O 3.09Å; Q149-Y206 PolarHBondContact OE1-O 2.82Å; Q149-L207 HydrophobicContact CB-CD2 4.15Å; Q149-L207 HydrophobicContact CG-CD2 4.13Å; Q149-L207 VanDerWaalsContact OE1-CA 3.29Å; Q149-L207 PolarHBondContact OE1-O 2.85Å; Q149-V211 HydrophobicContact CB-CG2 4.03Å; Q149-V211 WeakPolarHBondContact O-CG1 3.47Å
150	Y	98.9	Very high	98.6	Very high	54 Å²	54	55.6 Å²	55.6	21%	0.212	28%	0.277	C	S	.	.	H	α-helix	trans	-62.3	-38.7	173	178	-113	0	0	0	111.9	F146 Y147 I153 P155 L188 Q214	F146-Y150 PolarHBondContact O-N 2.81Å; F146-Y150 VanDerWaalsContact O-N 3.09Å; Y147-Y150 PolarHBondContact O-N 3.36Å; Y150-I153 HydrophobicContact CD2-CD1 4.26Å; Y150-I153 HydrophobicContact CE2-CD1 4.46Å; Y150-I153 WeakPolarHBondContact O-CG1 3.28Å; Y150-P155 HydrophobicContact CD1-CG 4.04Å; Y150-P155 HydrophobicContact CD2-CB 4.31Å; Y150-P155 HydrophobicContact CD2-CG 4.36Å; Y150-P155 HydrophobicContact CE1-CB 4.07Å; Y150-P155 HydrophobicContact CE1-CG 3.57Å; Y150-P155 HydrophobicContact CE2-CB 3.58Å; Y150-P155 HydrophobicContact CE2-CG 3.92Å; Y150-P155 HydrophobicContact CG-CG 4.43Å; Y150-P155 VanDerWaalsContact CZ-CB 3.46Å; Y150-P155 WeakPolarHBondContact O-CD 3.5Å; Y150-P155 WeakPolarHBondContact O-CG 3.41Å; Y150-L188 HydrophobicContact CD1-CD1 4.05Å; Y150-L188 HydrophobicContact CD2-CD2 3.94Å; Y150-L188 HydrophobicContact CE1-CD1 3.7Å; Y150-L188 HydrophobicContact CE2-CD1 4.21Å; Y150-L188 HydrophobicContact CE2-CD2 3.93Å; Y150-L188 HydrophobicContact CG-CD1 4.43Å; Y150-L188 HydrophobicContact CG-CD2 4.37Å; Y150-Q214 HydrophobicContact CD2-CB 4.29Å; Y150-Q214 HydrophobicContact CD2-CG 4.35Å; Y150-Q214 HydrophobicContact CE2-CB 3.86Å; Y150-Q214 HydrophobicContact CE2-CG 3.81Å
151	K	98.8	Very high	98.5	Very high	163 Å²	163	59.5 Å²	59.5	71%	0.709	30%	0.298	S	S	*	.	H	α-helix	trans	-66.2	-36.8	175.7	-174.7	179.4	177.2	-177.9	0	112.4	Y147 A148 Q149 I153 E154	Y147-K151 PolarHBondContact O-N 3.42Å; A148-K151 PolarHBondContact O-N 3.28Å; Q149-K151 VanDerWaalsContact C-N 3.29Å; Q149-K151 PolarHBondContact O-N 2.89Å; K151-I153 PolarHBondContact O-N 3.07Å; K151-E154 PolarHBondContact O-N 2.91Å
152	S	98.6	Very high	98.3	Very high	62 Å²	62	64.1 Å²	64.1	43%	0.434	32%	0.319	S	S	.	.	H	α-helix	trans	-65.4	-24.1	-173.7	72.6	0	0	0	0	114.2	A148 Q149 E154	A148-S152 PolarHBondContact O-N 2.98Å; Q149-S152 PolarHBondContact O-N 2.78Å; Q149-S152 PolarHBondContact O-OG 3.03Å; S152-E154 PolarHBondContact O-N 3.05Å
153	I	98.6	Very high	98.1	Very high	12 Å²	12	64.5 Å²	64.5	6%	0.062	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	1.3	175.1	61.8	155.5	0	0	0	113.8	Y150 K151 P155 L207 V211 Q214 A215 R230	Y150-I153 HydrophobicContact CD2-CD1 4.26Å; Y150-I153 HydrophobicContact CE2-CD1 4.46Å; Y150-I153 WeakPolarHBondContact O-CG1 3.28Å; K151-I153 PolarHBondContact O-N 3.07Å; I153-P155 HydrophobicContact CD1-CB 4.27Å; I153-P155 HydrophobicContact CG1-CB 4.32Å; I153-L207 HydrophobicContact CG2-CD1 4.05Å; I153-V211 HydrophobicContact CB-CG1 4.46Å; I153-V211 HydrophobicContact CD1-CG1 4Å; I153-V211 WeakPolarHBondContact CD1-O 3.26Å; I153-V211 HydrophobicContact CG1-CG1 4.07Å; I153-V211 HydrophobicContact CG2-CG1 3.56Å; I153-Q214 HydrophobicContact CD1-CB 3.77Å; I153-A215 HydrophobicContact CB-CB 4.34Å; I153-A215 HydrophobicContact CD1-CB 4.06Å; I153-A215 HydrophobicContact CG2-CB 4.19Å; I153-R230 PolarHBondContact O-NH1 3.03Å; I153-R230 VanDerWaalsContact O-NH1 3.09Å
154	E	98.8	Very high	97.8	Very high	49 Å²	49	68.1 Å²	68.1	23%	0.229	34%	0.343	C	S	.	.			trans	51.6	69.1	-177.5	-68.7	171.7	-163.1	0	0	111.9	K151 S152 Y156 K158 R230 K233	K151-E154 PolarHBondContact O-N 2.91Å; S152-E154 PolarHBondContact O-N 3.05Å; E154-Y156 HydrophobicContact CB-CD1 4.31Å; E154-Y156 HydrophobicContact CB-CE1 3.6Å; E154-Y156 HydrophobicContact CG-CE1 3.99Å; E154-Y156 PolarHBondContact O-N 2.88Å; E154-K158 IonicContact OE2-NZ 2.72Å; E154-K158 PolarHBondContact OE2-NZ 3.46Å; E154-R230 PolarHBondContact O-NH1 3.09Å; E154-K233 IonicContact OE1-NZ 3.58Å; E154-K233 PolarHBondContact OE1-NZ 2.7Å; E154-K233 IonicContact OE2-NZ 3.09Å; E154-K233 PolarHBondContact OE2-NZ 2.79Å
155	P	98.7	Very high	97.6	Very high	26 Å²	26	71.7 Å²	71.7	17%	0.169	35%	0.352	C	S	.	.			trans	-81.9	56.3	-167.5	36	-38.1	0	0	0	112.4	Y150 I153 W218	Y150-P155 HydrophobicContact CD1-CG 4.04Å; Y150-P155 HydrophobicContact CD2-CB 4.31Å; Y150-P155 HydrophobicContact CD2-CG 4.36Å; Y150-P155 HydrophobicContact CE1-CB 4.07Å; Y150-P155 HydrophobicContact CE1-CG 3.57Å; Y150-P155 HydrophobicContact CE2-CB 3.58Å; Y150-P155 HydrophobicContact CE2-CG 3.92Å; Y150-P155 HydrophobicContact CG-CG 4.43Å; Y150-P155 VanDerWaalsContact CZ-CB 3.46Å; Y150-P155 WeakPolarHBondContact O-CD 3.5Å; Y150-P155 WeakPolarHBondContact O-CG 3.41Å; I153-P155 HydrophobicContact CD1-CB 4.27Å; I153-P155 HydrophobicContact CG1-CB 4.32Å; P155-W218 WeakPolarHBondContact O-CZ2 3.28Å
156	Y	98.8	Very high	97.5	Very high	122 Å²	122	72.3 Å²	72.3	48%	0.478	37%	0.374	S	S	.	.	S	Bend	trans	-144.8	161.9	178.1	52.6	-92.6	0	0	0	109.7	E154 K158 W218 R230	E154-Y156 HydrophobicContact CB-CD1 4.31Å; E154-Y156 HydrophobicContact CB-CE1 3.6Å; E154-Y156 HydrophobicContact CG-CE1 3.99Å; E154-Y156 PolarHBondContact O-N 2.88Å; Y156-K158 HydrophobicContact CD2-CG 3.91Å; Y156-K158 HydrophobicContact CE2-CD 4.06Å; Y156-K158 HydrophobicContact CE2-CG 3.7Å; Y156-W218 VanDerWaalsContact C-CH2 3.46Å; Y156-W218 VanDerWaalsContact C-CZ3 3.4Å; Y156-W218 VanDerWaalsContact CA-CZ2 3.44Å; Y156-R230 PolarHBondContact O-NH2 3.34Å
157	L	98.7	Very high	97.5	Very high	53 Å²	53	78.5 Å²	78.5	28%	0.277	40%	0.401	S	S	.	.			trans	-68.1	133.7	-179	-175.7	64.9	0	0	0	109.9	Y170 W218 R223 D224	L157-Y170 HydrophobicContact CD2-CD2 3.8Å; L157-Y170 HydrophobicContact CD2-CE2 3.69Å; L157-W218 VanDerWaalsContact CA-CZ3 3.43Å; L157-W218 HydrophobicContact CB-CH2 4.38Å; L157-W218 HydrophobicContact CB-CZ3 3.8Å; L157-W218 HydrophobicContact CD1-CZ3 4.28Å; L157-W218 VanDerWaalsContact N-CH2 3.34Å; L157-R223 HydrophobicContact CD1-CB 3.84Å; L157-R223 HydrophobicContact CD2-CB 4.47Å; L157-D224 HydrophobicContact CD1-CB 4.01Å
158	K	98.4	Very high	97.4	Very high	31 Å²	31	80.8 Å²	80.8	14%	0.135	42%	0.416	C	S	.	.			trans	-125.4	129.6	174.9	-62.6	178	66.1	178.4	0	110.2	E154 Y156 D224 D225 F226	E154-K158 IonicContact OE2-NZ 2.72Å; E154-K158 PolarHBondContact OE2-NZ 3.46Å; Y156-K158 HydrophobicContact CD2-CG 3.91Å; Y156-K158 HydrophobicContact CE2-CD 4.06Å; Y156-K158 HydrophobicContact CE2-CG 3.7Å; K158-D224 PolarHBondContact N-OD2 3.34Å; K158-D225 PolarHBondContact O-N 3.42Å; K158-F226 HydrophobicContact CB-CB 4.24Å; K158-F226 HydrophobicContact CB-CD2 3.3Å; K158-F226 HydrophobicContact CB-CE2 3.73Å; K158-F226 HydrophobicContact CB-CG 3.89Å; K158-F226 HydrophobicContact CD-CB 4.39Å; K158-F226 HydrophobicContact CD-CD2 4.43Å; K158-F226 HydrophobicContact CD-CG 4.22Å; K158-F226 HydrophobicContact CG-CD2 4.47Å
159	K	97.8	Very high	97.3	Very high	54 Å²	54	86.6 Å²	86.6	24%	0.235	43%	0.433	C	S	.	.			trans	-117.9	150.2	173.8	-62.2	-146.5	74	176	0	110.5	D161 E162 Y170 D225	K159-D161 VanDerWaalsContact C-N 3.26Å; K159-D161 PolarHBondContact O-N 3.17Å; K159-E162 HydrophobicContact CB-CG 4.26Å; K159-Y170 HydrophobicContact CD-CD1 4.48Å; K159-Y170 HydrophobicContact CD-CD2 4.27Å; K159-Y170 HydrophobicContact CD-CE1 3.92Å; K159-Y170 HydrophobicContact CD-CE2 3.67Å; K159-Y170 VanDerWaalsContact CD-CZ 3.47Å; K159-Y170 HydrophobicContact CG-CE2 4.39Å; K159-D225 WeakPolarHBondContact CA-OD2 3.37Å; K159-D225 WeakPolarHBondContact CE-OD2 3.46Å
160	K	97	Very high	97.3	Very high	121 Å²	121	89.5 Å²	89.5	53%	0.526	44%	0.444	S	S	.	.	S	Bend	trans	-66.5	-33.2	175.9	-67	-60.8	-178.8	-168.2	0	112.1	D225 F226 E229	K160-D225 WeakPolarHBondContact CE-O 3.2Å; K160-D225 HydrophobicContact CG-CB 3.78Å; K160-D225 PolarHBondContact N-OD2 2.89Å; K160-F226 HydrophobicContact CD-CE2 3.84Å; K160-F226 HydrophobicContact CD-CZ 3.87Å; K160-F226 VanDerWaalsContact NZ-CE1 3.34Å; K160-E229 IonicContact NZ-OE1 2.6Å; K160-E229 PolarHBondContact NZ-OE1 3.19Å; K160-E229 IonicContact NZ-OE2 3.82Å
161	D	95.8	Very high	97.2	Very high	94 Å²	94	94.8 Å²	94.8	50%	0.503	48%	0.475	S	S	.	.			trans	-120.3	110.7	172.2	179.8	10	0	0	0	109.9	K159 S163	K159-D161 VanDerWaalsContact C-N 3.26Å; K159-D161 PolarHBondContact O-N 3.17Å; D161-S163 VanDerWaalsContact CG-OG 3.31Å; D161-S163 WeakPolarHBondContact OD1-CB 3.4Å; D161-S163 PolarHBondContact OD1-N 3.37Å; D161-S163 PolarHBondContact OD1-OG 3.16Å; D161-S163 PolarHBondContact OD2-OG 2.95Å
162	E	94.6	Very high	97.2	Very high	104 Å²	104	89.3 Å²	89.3	49%	0.486	45%	0.452	S	S	.	.			trans	-96.7	0.4	178.4	-64.2	179	178.6	0	0	112.2	K159 Q164 E165	K159-E162 HydrophobicContact CB-CG 4.26Å; E162-Q164 PolarHBondContact O-N 3.14Å; E162-E165 VanDerWaalsContact O-CB 3.31Å; E162-E165 WeakPolarHBondContact O-CB 3.25Å; E162-E165 PolarHBondContact O-N 2.98Å
163	S	94.7	Very high	97.2	Very high	70 Å²	70	88.5 Å²	88.5	49%	0.49	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-14.1	-177.5	71.3	0	0	0	0	114.8	D161 K167	D161-S163 VanDerWaalsContact CG-OG 3.31Å; D161-S163 WeakPolarHBondContact OD1-CB 3.4Å; D161-S163 PolarHBondContact OD1-N 3.37Å; D161-S163 PolarHBondContact OD1-OG 3.16Å; D161-S163 PolarHBondContact OD2-OG 2.95Å; S163-K167 PolarHBondContact O-NZ 3.36Å
164	Q	93	Very high	97.3	Very high	93 Å²	93	94.6 Å²	94.6	44%	0.435	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	6.6	178.5	-51.4	-53.9	-49.8	0	0	113.3	E162 G166 K167	E162-Q164 PolarHBondContact O-N 3.14Å; Q164-G166 PolarHBondContact O-N 3.14Å; Q164-K167 PolarHBondContact O-N 3.38Å
165	E	95.3	Very high	97.3	Very high	141 Å²	141	98 Å²	98	66%	0.659	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	137.2	176.6	-170.2	177.4	-172.2	0	0	111.2	E162 K167	E162-E165 VanDerWaalsContact O-CB 3.31Å; E162-E165 WeakPolarHBondContact O-CB 3.25Å; E162-E165 PolarHBondContact O-N 2.98Å; E165-K167 PolarHBondContact O-N 3.01Å; E165-K167 VanDerWaalsContact O-N 3.11Å
166	G	96.6	Very high	97.2	Very high	79 Å²	79	99.8 Å²	99.8	81%	0.814	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	75	-9.5	177.7	0	0	0	0	0	116.1	Q164	Q164-G166 PolarHBondContact O-N 3.14Å
167	K	97.1	Very high	97.2	Very high	131 Å²	131	98 Å²	98	57%	0.57	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-40.5	-179.4	-67.8	179.1	-177.8	154.8	0	113.1	S163 Q164 E165	S163-K167 PolarHBondContact O-NZ 3.36Å; Q164-K167 PolarHBondContact O-N 3.38Å; E165-K167 PolarHBondContact O-N 3.01Å; E165-K167 VanDerWaalsContact O-N 3.11Å
168	Q	97.1	Very high	97.2	Very high	169 Å²	169	101.5 Å²	101.5	79%	0.79	51%	0.507	S	S	*	.	S	Bend	trans	-148.8	164.3	-178.7	-63.8	-174.4	1.5	0	0	110.7
169	Q	97.8	Very high	97.3	Very high	178 Å²	178	105.7 Å²	105.7	83%	0.832	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-70.8	138.4	172.6	-60.7	169.5	31.8	0	0	109.7
170	Y	98	Very high	97.3	Very high	73 Å²	73	103.2 Å²	103.2	29%	0.286	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-73.6	127.5	167.1	-61	-39.3	0	0	0	109.9	L157 K159	L157-Y170 HydrophobicContact CD2-CD2 3.8Å; L157-Y170 HydrophobicContact CD2-CE2 3.69Å; K159-Y170 HydrophobicContact CD-CD1 4.48Å; K159-Y170 HydrophobicContact CD-CD2 4.27Å; K159-Y170 HydrophobicContact CD-CE1 3.92Å; K159-Y170 HydrophobicContact CD-CE2 3.67Å; K159-Y170 VanDerWaalsContact CD-CZ 3.47Å; K159-Y170 HydrophobicContact CG-CE2 4.39Å
171	L	98.2	Very high	97.4	Very high	165 Å²	165	101.3 Å²	101.3	86%	0.864	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-70.9	138.3	176.2	-58.3	-179.8	0	0	0	110
172	Q	98.8	Very high	97.5	Very high	48 Å²	48	98.1 Å²	98.1	22%	0.224	50%	0.5	C	S	.	.			trans	-148.7	132.5	175.8	174.5	166.4	78.2	0	0	107.2	E176 R177 D221 S222 R223	Q172-E176 HydrophobicContact CG-CB 3.8Å; Q172-R177 HydrophobicContact CG-CB 4.18Å; Q172-D221 PolarHBondContact NE2-OD1 3.46Å; Q172-S222 PolarHBondContact NE2-OG 3.04Å; Q172-R223 HydrophobicContact CB-CG 4.39Å
173	S	98.8	Very high	97.7	Very high	46 Å²	46	93.9 Å²	93.9	32%	0.322	48%	0.48	S	S	.	.			trans	-72.7	162.5	178.6	94.5	0	0	0	0	111.3	E175 E176 R177	S173-E175 VanDerWaalsContact C-N 3.26Å; S173-E175 VanDerWaalsContact CB-OE2 3.26Å; S173-E175 WeakPolarHBondContact CB-OE2 3.25Å; S173-E175 PolarHBondContact O-N 3.31Å; S173-E175 PolarHBondContact OG-N 3.36Å; S173-E175 PolarHBondContact OG-OE2 2.95Å; S173-E176 PolarHBondContact N-OE2 3.14Å; S173-E176 VanDerWaalsContact N-OE2 3.13Å; S173-E176 PolarHBondContact O-N 3.28Å; S173-E176 PolarHBondContact OG-N 3.15Å; S173-E176 VanDerWaalsContact OG-N 3.15Å; S173-R177 WeakPolarHBondContact O-CB 3.17Å; S173-R177 PolarHBondContact O-N 3.14Å
174	I	98.8	Very high	97.9	Very high	139 Å²	139	95.9 Å²	95.9	71%	0.713	48%	0.478	S	S	*	.	H	α-helix	trans	-60.1	-42.5	176.6	-66.5	174.4	0	0	0	109.9	E176 R177 E178	I174-E176 VanDerWaalsContact C-N 3.34Å; I174-E176 PolarHBondContact O-N 3.04Å; I174-R177 PolarHBondContact O-N 3.42Å; I174-E178 WeakPolarHBondContact O-CB 3.41Å; I174-E178 PolarHBondContact O-N 3.19Å
175	E	98.7	Very high	98.2	Very high	122 Å²	122	94 Å²	94	57%	0.57	47%	0.47	S	S	*	.	H	α-helix	trans	-67.3	-34.4	-178.9	-54.1	72.6	-157.7	0	0	111.9	S173 K179	S173-E175 VanDerWaalsContact C-N 3.26Å; S173-E175 VanDerWaalsContact CB-OE2 3.26Å; S173-E175 WeakPolarHBondContact CB-OE2 3.25Å; S173-E175 PolarHBondContact O-N 3.31Å; S173-E175 PolarHBondContact OG-N 3.36Å; S173-E175 PolarHBondContact OG-OE2 2.95Å; E175-K179 WeakPolarHBondContact O-CG 3.49Å
176	E	98.6	Very high	98.4	Very high	62 Å²	62	88.6 Å²	88.6	29%	0.29	45%	0.447	S	S	.	.	H	α-helix	trans	-70.5	-41.5	173.3	-70.1	-179.1	142.8	0	0	111.9	Q172 S173 I174 K179 S222	Q172-E176 HydrophobicContact CG-CB 3.8Å; S173-E176 PolarHBondContact N-OE2 3.14Å; S173-E176 VanDerWaalsContact N-OE2 3.13Å; S173-E176 PolarHBondContact O-N 3.28Å; S173-E176 PolarHBondContact OG-N 3.15Å; S173-E176 VanDerWaalsContact OG-N 3.15Å; I174-E176 VanDerWaalsContact C-N 3.34Å; I174-E176 PolarHBondContact O-N 3.04Å; E176-K179 WeakPolarHBondContact O-CB 3.19Å; E176-K179 PolarHBondContact O-N 3.35Å; E176-S222 VanDerWaalsContact CD-OG 3.22Å; E176-S222 VanDerWaalsContact OE1-CB 3.26Å; E176-S222 WeakPolarHBondContact OE1-CB 3.36Å; E176-S222 WeakPolarHBondContact OE2-CB 3.32Å; E176-S222 PolarHBondContact OE2-OG 3.22Å
177	R	98.8	Very high	98.5	Very high	85 Å²	85	86 Å²	86	32%	0.321	41%	0.414	S	S	.	.	H	α-helix	trans	-64.6	-40.4	177.2	173.1	57.1	-171.2	73.8	5.1	111.5	Q172 S173 I174 K179 L180 D181 Y184	Q172-R177 HydrophobicContact CG-CB 4.18Å; S173-R177 WeakPolarHBondContact O-CB 3.17Å; S173-R177 PolarHBondContact O-N 3.14Å; I174-R177 PolarHBondContact O-N 3.42Å; R177-K179 PolarHBondContact O-N 3.09Å; R177-L180 WeakPolarHBondContact O-CB 3.26Å; R177-L180 PolarHBondContact O-N 3.37Å; R177-D181 IonicContact CZ-OD1 3.53Å; R177-D181 IonicContact NH1-OD1 2.72Å; R177-D181 PolarHBondContact NH1-OD1 3.32Å; R177-D181 IonicContact NH2-OD1 3.42Å; R177-Y184 VanDerWaalsContact NH2-CE1 3.27Å
178	E	98.6	Very high	98.6	Very high	126 Å²	126	81.7 Å²	81.7	59%	0.589	40%	0.397	S	S	*	.	H	α-helix	trans	-58.8	-29.8	179.8	-171.1	176.8	-169.9	0	0	112	I174 L180 D181	I174-E178 WeakPolarHBondContact O-CB 3.41Å; I174-E178 PolarHBondContact O-N 3.19Å; E178-L180 PolarHBondContact O-N 3.03Å; E178-D181 WeakPolarHBondContact O-CB 3.48Å; E178-D181 PolarHBondContact O-N 3.17Å
179	K	98.6	Very high	98.6	Very high	119 Å²	119	74.3 Å²	74.3	52%	0.517	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-21.5	174.9	-62.6	169.9	-171.6	170	0	113.5	E175 E176 R177 I220	E175-K179 WeakPolarHBondContact O-CG 3.49Å; E176-K179 WeakPolarHBondContact O-CB 3.19Å; E176-K179 PolarHBondContact O-N 3.35Å; R177-K179 PolarHBondContact O-N 3.09Å; K179-I220 HydrophobicContact CB-CD1 4.17Å; K179-I220 WeakPolarHBondContact O-CD1 3.41Å
180	L	98.9	Very high	98.7	Very high	2 Å²	2	65.9 Å²	65.9	1%	0.01	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-18.6	178.2	-54.6	-176.8	0	0	0	112.6	R177 E178 L183 Y184 I220 D221	R177-L180 WeakPolarHBondContact O-CB 3.26Å; R177-L180 PolarHBondContact O-N 3.37Å; E178-L180 PolarHBondContact O-N 3.03Å; L180-L183 VanDerWaalsContact O-CB 3.3Å; L180-L183 WeakPolarHBondContact O-CB 3.11Å; L180-L183 PolarHBondContact O-N 2.72Å; L180-Y184 HydrophobicContact CB-CD1 4.32Å; L180-Y184 VanDerWaalsContact O-CD1 3.3Å; L180-Y184 WeakPolarHBondContact O-CD1 3.34Å; L180-Y184 PolarHBondContact O-N 3.43Å; L180-I220 HydrophobicContact CD2-CG1 4.22Å; L180-D221 HydrophobicContact CD2-CB 4.16Å
181	D	98.8	Very high	98.7	Very high	81 Å²	81	62.4 Å²	62.4	43%	0.433	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	135.9	178.4	-67.4	-6.7	0	0	0	110.6	R177 E178 L183 Y184	R177-D181 IonicContact CZ-OD1 3.53Å; R177-D181 IonicContact NH1-OD1 2.72Å; R177-D181 PolarHBondContact NH1-OD1 3.32Å; R177-D181 IonicContact NH2-OD1 3.42Å; E178-D181 WeakPolarHBondContact O-CB 3.48Å; E178-D181 PolarHBondContact O-N 3.17Å; D181-L183 VanDerWaalsContact C-N 3.3Å; D181-Y184 VanDerWaalsContact OD1-CE1 3.26Å; D181-Y184 WeakPolarHBondContact OD1-CE1 3.25Å
182	G	98.5	Very high	98.8	Very high	28 Å²	28	55.1 Å²	55.1	29%	0.289	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.3	1.2	-169.8	0	0	0	0	0	114.8	E185	G182-E185 VanDerWaalsContact C-OE2 3.26Å; G182-E185 VanDerWaalsContact CA-OE2 3.24Å; G182-E185 WeakPolarHBondContact CA-OE2 3.34Å; G182-E185 VanDerWaalsContact N-CD 3.28Å; G182-E185 PolarHBondContact N-OE1 3.32Å; G182-E185 PolarHBondContact N-OE2 2.77Å
183	L	98.8	Very high	98.8	Very high	14 Å²	14	52.8 Å²	52.8	7%	0.073	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	-51.1	176.1	-52.6	177.4	0	0	0	112.9	L180 D181 E185 C186 M213 Q214 Y216 R217 I220 A262	L180-L183 VanDerWaalsContact O-CB 3.3Å; L180-L183 WeakPolarHBondContact O-CB 3.11Å; L180-L183 PolarHBondContact O-N 2.72Å; D181-L183 VanDerWaalsContact C-N 3.3Å; L183-E185 VanDerWaalsContact C-N 3.27Å; L183-E185 PolarHBondContact N-OE2 3.08Å; L183-E185 PolarHBondContact O-N 3.08Å; L183-C186 WeakPolarHBondContact O-CB 3.26Å; L183-C186 PolarHBondContact O-N 3.28Å; L183-M213 HydrophobicContact CD2-CG 3.68Å; L183-M213 HydrophobicContact CD2-SD 4.33Å; L183-Q214 PolarHBondContact O-NE2 3.11Å; L183-Y216 HydrophobicContact CD1-CD1 3.75Å; L183-Y216 HydrophobicContact CD1-CE1 4.03Å; L183-Y216 HydrophobicContact CD2-CD1 3.99Å; L183-Y216 HydrophobicContact CD2-CE1 4.5Å; L183-R217 HydrophobicContact CB-CB 3.94Å; L183-R217 HydrophobicContact CB-CG 4.06Å; L183-R217 HydrophobicContact CD1-CB 4.25Å; L183-I220 HydrophobicContact CD1-CD1 3.56Å; L183-I220 HydrophobicContact CD1-CG1 4.27Å; L183-A262 HydrophobicContact CD2-CB 4.16Å
184	Y	98.7	Very high	98.8	Very high	112 Å²	112	50.7 Å²	50.7	44%	0.439	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-18	-173.5	78.5	-88.4	0	0	0	113.6	R177 L180 D181 C186	R177-Y184 VanDerWaalsContact NH2-CE1 3.27Å; L180-Y184 HydrophobicContact CB-CD1 4.32Å; L180-Y184 VanDerWaalsContact O-CD1 3.3Å; L180-Y184 WeakPolarHBondContact O-CD1 3.34Å; L180-Y184 PolarHBondContact O-N 3.43Å; D181-Y184 VanDerWaalsContact OD1-CE1 3.26Å; D181-Y184 WeakPolarHBondContact OD1-CE1 3.25Å; Y184-C186 PolarHBondContact O-N 3.4Å
185	E	98.9	Very high	98.8	Very high	55 Å²	55	44.5 Å²	44.5	26%	0.257	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	0.2	179.4	-51.9	89.3	151.9	0	0	112.8	G182 L183 I187 L257	G182-E185 VanDerWaalsContact C-OE2 3.26Å; G182-E185 VanDerWaalsContact CA-OE2 3.24Å; G182-E185 WeakPolarHBondContact CA-OE2 3.34Å; G182-E185 VanDerWaalsContact N-CD 3.28Å; G182-E185 PolarHBondContact N-OE1 3.32Å; G182-E185 PolarHBondContact N-OE2 2.77Å; L183-E185 VanDerWaalsContact C-N 3.27Å; L183-E185 PolarHBondContact N-OE2 3.08Å; L183-E185 PolarHBondContact O-N 3.08Å; E185-I187 WeakPolarHBondContact O-CG2 3.47Å; E185-I187 PolarHBondContact O-N 3.01Å; E185-L257 HydrophobicContact CB-CD1 4.42Å; E185-L257 HydrophobicContact CB-CD2 4.09Å
186	C	98.9	Very high	98.8	Very high	26 Å²	26	39.2 Å²	39.2	18%	0.176	19%	0.193	C	C	.	.			trans	-61.6	122	175	-174.2	0	0	0	0	110.8	L183 Y184 M213 Q214 L257	L183-C186 WeakPolarHBondContact O-CB 3.26Å; L183-C186 PolarHBondContact O-N 3.28Å; Y184-C186 PolarHBondContact O-N 3.4Å; C186-M213 HydrophobicContact CB-CE 3.75Å; C186-Q214 VanDerWaalsContact CB-NE2 3.32Å; C186-L257 HydrophobicContact CB-CD1 4.02Å
187	I	98.9	Very high	98.8	Very high	24 Å²	24	37.6 Å²	37.6	12%	0.123	19%	0.188	C	C	.	.			trans	-95.6	13.4	-178.1	64.6	172.4	0	0	0	113.6	I97 L111 E185 C189 K255	I97-I187 HydrophobicContact CD1-CG2 4.21Å; I97-I187 WeakPolarHBondContact O-CB 3.37Å; I97-I187 WeakPolarHBondContact O-CG2 3.38Å; L111-I187 HydrophobicContact CD1-CD1 3.7Å; L111-I187 HydrophobicContact CD2-CD1 4.45Å; E185-I187 WeakPolarHBondContact O-CG2 3.47Å; E185-I187 PolarHBondContact O-N 3.01Å; I187-C189 HydrophobicContact CD1-CB 4.04Å; I187-C189 HydrophobicContact CG1-CB 3.91Å; I187-C189 PolarHBondContact O-N 3.32Å; I187-K255 HydrophobicContact CD1-CD 4.28Å; I187-K255 HydrophobicContact CD1-CG 4.14Å; I187-K255 HydrophobicContact CG1-CG 4.23Å; I187-K255 HydrophobicContact CG2-CD 4.29Å; I187-K255 HydrophobicContact CG2-CG 4.27Å
188	L	98.9	Very high	98.8	Very high	41 Å²	41	33.9 Å²	33.9	22%	0.215	18%	0.175	C	C	.	.			trans	50	35.8	-179.8	-60.7	176.1	0	0	0	115	F146 Y150 A190 Q214	F146-L188 HydrophobicContact CE1-CB 4.36Å; Y150-L188 HydrophobicContact CD1-CD1 4.05Å; Y150-L188 HydrophobicContact CD2-CD2 3.94Å; Y150-L188 HydrophobicContact CE1-CD1 3.7Å; Y150-L188 HydrophobicContact CE2-CD1 4.21Å; Y150-L188 HydrophobicContact CE2-CD2 3.93Å; Y150-L188 HydrophobicContact CG-CD1 4.43Å; Y150-L188 HydrophobicContact CG-CD2 4.37Å; L188-A190 VanDerWaalsContact C-N 3.28Å; L188-A190 PolarHBondContact O-N 3.4Å; L188-Q214 HydrophobicContact CD2-CG 4.29Å
189	C	98.9	Very high	98.8	Very high	14 Å²	14	28.3 Å²	28.3	10%	0.095	15%	0.149	C	C	.	.			trans	-77.7	-4	-177.9	68.2	0	0	0	0	115.4	A102 L111 I187 C191	A102-C189 HydrophobicContact CB-CB 4.12Å; A102-C189 WeakPolarHBondContact CB-O 3.18Å; L111-C189 HydrophobicContact CD2-CB 3.97Å; I187-C189 HydrophobicContact CD1-CB 4.04Å; I187-C189 HydrophobicContact CG1-CB 3.91Å; I187-C189 PolarHBondContact O-N 3.32Å; C189-C191 PolarHBondContact O-N 2.91Å
190	A	98.9	Very high	98.8	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.008	14%	0.138	C	C	.	.			trans	59.7	-1.3	-176.8	0	0	0	0	0	117.6	L130 L143 F146 L188 C192 S193 T194	L130-A190 HydrophobicContact CD1-CB 4.13Å; L143-A190 HydrophobicContact CD2-CB 4Å; F146-A190 HydrophobicContact CD1-CB 4.22Å; F146-A190 HydrophobicContact CD2-CB 3.89Å; F146-A190 HydrophobicContact CE1-CB 4.08Å; F146-A190 HydrophobicContact CE2-CB 3.71Å; F146-A190 HydrophobicContact CG-CB 4.14Å; F146-A190 HydrophobicContact CZ-CB 3.83Å; L188-A190 VanDerWaalsContact C-N 3.28Å; L188-A190 PolarHBondContact O-N 3.4Å; A190-C192 PolarHBondContact O-N 3.23Å; A190-C192 VanDerWaalsContact O-N 3.14Å; A190-S193 PolarHBondContact O-N 3.1Å; A190-S193 VanDerWaalsContact O-N 3.14Å; A190-T194 HydrophobicContact CB-CG2 4.34Å; A190-T194 PolarHBondContact O-N 3.02Å; A190-T194 PolarHBondContact O-OG1 3.07Å
191	C	98.9	Very high	98.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.6	-44.1	178.9	-75.3	0	0	0	0	113.2	N109 C189 T194 S195 T252	N109-C191 HydrophobicContact CB-CB 3.96Å; N109-C191 PolarHBondContact ND2-O 3.2Å; C189-C191 PolarHBondContact O-N 2.91Å; C191-T194 PolarHBondContact O-OG1 3.17Å; C191-S195 WeakPolarHBondContact O-CB 3.4Å; C191-S195 PolarHBondContact O-N 2.89Å; C191-S195 PolarHBondContact O-OG 2.59Å; C191-T252 HydrophobicContact CB-CG2 4.29Å; C191-T252 WeakPolarHBondContact O-CG2 3.35Å
192	C	98.9	Very high	98.8	Very high	12 Å²	12	33.4 Å²	33.4	8%	0.081	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-44.1	-178.3	56	0	0	0	0	112.3	A190 S195 C196 P209 C249 T252 P259	A190-C192 PolarHBondContact O-N 3.23Å; A190-C192 VanDerWaalsContact O-N 3.14Å; C192-S195 PolarHBondContact O-N 3.09Å; C192-S195 PolarHBondContact O-OG 2.86Å; C192-C196 PolarHBondContact O-N 3.19Å; C192-P209 VanDerWaalsContact C-CG 3.5Å; C192-P209 HydrophobicContact CB-CB 4.43Å; C192-P209 HydrophobicContact CB-CG 4.03Å; C192-P209 WeakPolarHBondContact O-CG 3.41Å; C192-C249 HydrophobicContact CB-CB 3.88Å; C192-C249 WeakPolarHBondContact CB-O 3.44Å; C192-T252 HydrophobicContact CB-CG2 4.42Å; C192-P259 HydrophobicContact CB-CG 4.36Å
193	S	98.9	Very high	98.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-65.7	-46.2	179.2	-63.3	0	0	0	0	111.5	A190 S195 C196 Y199 P209 A210	A190-S193 PolarHBondContact O-N 3.1Å; A190-S193 VanDerWaalsContact O-N 3.14Å; S193-S195 PolarHBondContact O-N 3.27Å; S193-S195 VanDerWaalsContact O-N 3.11Å; S193-C196 WeakPolarHBondContact O-CB 3.21Å; S193-C196 PolarHBondContact O-N 3.07Å; S193-Y199 WeakPolarHBondContact O-CB 3.46Å; S193-P209 WeakPolarHBondContact OG-CD 3.47Å; S193-A210 PolarHBondContact OG-N 2.99Å
194	T	98.9	Very high	98.7	Very high	2 Å²	2	37 Å²	37	1%	0.012	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-76.5	3.9	179.5	62.2	0	0	0	0	113.6	N109 L130 P131 M133 A190 C191 W200	N109-T194 VanDerWaalsContact ND2-C 3.27Å; N109-T194 PolarHBondContact ND2-O 2.92Å; N109-T194 PolarHBondContact ND2-OG1 2.88Å; N109-T194 VanDerWaalsContact ND2-OG1 3.08Å; L130-T194 HydrophobicContact CB-CG2 3.98Å; L130-T194 HydrophobicContact CD1-CG2 4.13Å; L130-T194 WeakPolarHBondContact CD2-OG1 3.06Å; P131-T194 WeakPolarHBondContact CD-O 3.19Å; P131-T194 WeakPolarHBondContact CG-O 3.44Å; M133-T194 HydrophobicContact CG-CG2 3.89Å; M133-T194 HydrophobicContact SD-CG2 3.6Å; M133-T194 VanDerWaalsContact SD-CG2 3.6Å; A190-T194 HydrophobicContact CB-CG2 4.34Å; A190-T194 PolarHBondContact O-N 3.02Å; A190-T194 PolarHBondContact O-OG1 3.07Å; C191-T194 PolarHBondContact O-OG1 3.17Å; T194-W200 PolarHBondContact O-NE1 3.25Å
195	S	98.9	Very high	98.7	Very high	9 Å²	9	36 Å²	36	6%	0.063	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-101.7	-8.7	167.4	74.5	0	0	0	0	113.4	N109 C191 C192 S193 P197 N248 T252	N109-S195 PolarHBondContact ND2-N 3.32Å; C191-S195 WeakPolarHBondContact O-CB 3.4Å; C191-S195 PolarHBondContact O-N 2.89Å; C191-S195 PolarHBondContact O-OG 2.59Å; C192-S195 PolarHBondContact O-N 3.09Å; C192-S195 PolarHBondContact O-OG 2.86Å; S193-S195 PolarHBondContact O-N 3.27Å; S193-S195 VanDerWaalsContact O-N 3.11Å; S195-P197 WeakPolarHBondContact O-CD 3.44Å; S195-N248 VanDerWaalsContact O-CB 3.27Å; S195-N248 WeakPolarHBondContact O-CB 3.39Å; S195-N248 PolarHBondContact O-ND2 2.84Å; S195-T252 WeakPolarHBondContact OG-CG2 3.46Å
196	C	98.9	Very high	98.7	Very high	10 Å²	10	33.4 Å²	33.4	7%	0.068	16%	0.163	C	C	.	.			trans	-91.7	116.7	-172.8	-176.7	0	0	0	0	110.1	C192 S193 S198 Y199 W200 P209	C192-C196 PolarHBondContact O-N 3.19Å; S193-C196 WeakPolarHBondContact O-CB 3.21Å; S193-C196 PolarHBondContact O-N 3.07Å; C196-S198 VanDerWaalsContact C-N 3.28Å; C196-S198 PolarHBondContact O-N 3.21Å; C196-Y199 WeakPolarHBondContact O-CA 3.49Å; C196-Y199 WeakPolarHBondContact O-CB 3.38Å; C196-Y199 PolarHBondContact O-N 3.11Å; C196-W200 PolarHBondContact O-N 2.94Å; C196-W200 VanDerWaalsContact O-N 3.11Å; C196-P209 HydrophobicContact CB-CG 4.43Å
197	P	98.8	Very high	98.7	Very high	28 Å²	28	32.9 Å²	32.9	18%	0.182	16%	0.158	C	C	.	.	H	α-helix	trans	-57.7	-37.7	178.4	-27.7	36.6	0	0	0	113.5	S195 Y199 W200 W201 I246	S195-P197 WeakPolarHBondContact O-CD 3.44Å; P197-Y199 PolarHBondContact O-N 3.06Å; P197-W200 HydrophobicContact CB-CE3 4.08Å; P197-W200 HydrophobicContact CB-CZ3 4.4Å; P197-W200 HydrophobicContact CG-CE3 4.25Å; P197-W200 HydrophobicContact CG-CZ3 4.12Å; P197-W200 WeakPolarHBondContact O-CB 3.49Å; P197-W200 PolarHBondContact O-N 3.21Å; P197-W201 PolarHBondContact O-N 2.68Å; P197-I246 HydrophobicContact CB-CD1 4.02Å; P197-I246 HydrophobicContact CG-CD1 3.99Å; P197-I246 HydrophobicContact CG-CG2 4.3Å
198	S	98.7	Very high	98.6	Very high	7 Å²	7	31.7 Å²	31.7	5%	0.049	15%	0.152	C	C	.	.	H	α-helix	trans	-57.8	-33.5	174.7	-58.4	0	0	0	0	113	C196 N202 R242	C196-S198 VanDerWaalsContact C-N 3.28Å; C196-S198 PolarHBondContact O-N 3.21Å; S198-N202 PolarHBondContact O-N 3.44Å; S198-R242 WeakPolarHBondContact CB-O 3.5Å; S198-R242 PolarHBondContact OG-O 2.82Å
199	Y	98.9	Very high	98.7	Very high	10 Å²	10	29.8 Å²	29.8	4%	0.039	14%	0.142	C	C	.	.	H	α-helix	trans	-78.9	-29.5	176.9	-164.2	-100.8	0	0	0	112.5	Q149 S193 C196 P197 W201 G203 Y206	Q149-Y199 PolarHBondContact NE2-OH 2.73Å; Q149-Y199 PolarHBondContact OE1-OH 3.02Å; S193-Y199 WeakPolarHBondContact O-CB 3.46Å; C196-Y199 WeakPolarHBondContact O-CA 3.49Å; C196-Y199 WeakPolarHBondContact O-CB 3.38Å; C196-Y199 PolarHBondContact O-N 3.11Å; P197-Y199 PolarHBondContact O-N 3.06Å; Y199-W201 VanDerWaalsContact C-N 3.35Å; Y199-G203 WeakPolarHBondContact O-CA 3.34Å; Y199-G203 PolarHBondContact O-N 3.13Å; Y199-Y206 AromaticContact CD2-CD1 3.96Å; Y199-Y206 HydrophobicContact CD2-CD1 3.96Å; Y199-Y206 HydrophobicContact CD2-CE1 4.46Å; Y199-Y206 VanDerWaalsContact CD2-O 3.29Å; Y199-Y206 WeakPolarHBondContact CD2-O 3.36Å; Y199-Y206 WeakPolarHBondContact CE2-O 3.37Å
200	W	98.8	Very high	98.7	Very high	75 Å²	75	29.1 Å²	29.1	28%	0.284	14%	0.138	S	C	.	.	H	α-helix	trans	-62	-46.9	170.3	-57.5	-19.8	0	0	0	110.5	P131 H132 T194 C196 P197	P131-W200 HydrophobicContact CB-CZ2 4.03Å; H132-W200 HydrophobicContact CB-CB 3.96Å; H132-W200 HydrophobicContact CB-CD2 4.49Å; H132-W200 HydrophobicContact CB-CG 3.75Å; H132-W200 PolarHBondContact CE1-O 3.5Å; H132-W200 PolarHBondContact ND1-O 2.81Å; T194-W200 PolarHBondContact O-NE1 3.25Å; C196-W200 PolarHBondContact O-N 2.94Å; C196-W200 VanDerWaalsContact O-N 3.11Å; P197-W200 HydrophobicContact CB-CE3 4.08Å; P197-W200 HydrophobicContact CB-CZ3 4.4Å; P197-W200 HydrophobicContact CG-CE3 4.25Å; P197-W200 HydrophobicContact CG-CZ3 4.12Å; P197-W200 WeakPolarHBondContact O-CB 3.49Å; P197-W200 PolarHBondContact O-N 3.21Å
201	W	98.5	Very high	98.7	Very high	190 Å²	190	29.1 Å²	29.1	72%	0.72	14%	0.138	S	C	*	.	H	α-helix	trans	-79.1	-31	-175	-59.4	121.9	0	0	0	114.7	P197 Y199	P197-W201 PolarHBondContact O-N 2.68Å; Y199-W201 VanDerWaalsContact C-N 3.35Å
202	N	98.4	Very high	98.7	Very high	44 Å²	44	29.1 Å²	29.1	24%	0.235	14%	0.138	C	C	.	.	H	α-helix	trans	-135.7	31.2	-172.5	-59.3	-92.1	0	0	0	112	S198 D204 K205 Y206	S198-N202 PolarHBondContact O-N 3.44Å; N202-D204 WeakPolarHBondContact CA-OD1 3.37Å; N202-D204 PolarHBondContact O-N 3.17Å; N202-D204 VanDerWaalsContact O-N 3.07Å; N202-K205 PolarHBondContact O-N 2.92Å; N202-Y206 WeakPolarHBondContact O-CB 3.38Å; N202-Y206 PolarHBondContact O-N 3.44Å
203	G	98.1	Very high	98.7	Very high	10 Å²	10	28.7 Å²	28.7	10%	0.103	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-6.5	-176.9	0	0	0	0	0	114.5	N145 Q149 Y199	N145-G203 PolarHBondContact ND2-O 3.33Å; Q149-G203 PolarHBondContact NE2-O 3.09Å; Y199-G203 WeakPolarHBondContact O-CA 3.34Å; Y199-G203 PolarHBondContact O-N 3.13Å
204	D	96.9	Very high	98.7	Very high	107 Å²	107	29.3 Å²	29.3	57%	0.572	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-29.9	169.9	62.4	-42.8	0	0	0	112.9	N202	N202-D204 WeakPolarHBondContact CA-OD1 3.37Å; N202-D204 PolarHBondContact O-N 3.17Å; N202-D204 VanDerWaalsContact O-N 3.07Å
205	K	98	Very high	98.7	Very high	90 Å²	90	29.4 Å²	29.4	39%	0.391	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.5	-37.3	-174.7	-67	171.3	-67.8	-169.8	0	114.1	N202 L207 F238	N202-K205 PolarHBondContact O-N 2.92Å; K205-L207 PolarHBondContact O-N 2.82Å; K205-F238 HydrophobicContact CB-CB 3.61Å; K205-F238 HydrophobicContact CB-CD1 4Å; K205-F238 HydrophobicContact CB-CG 3.86Å; K205-F238 HydrophobicContact CD-CD1 4.12Å; K205-F238 HydrophobicContact CD-CD2 4.18Å; K205-F238 HydrophobicContact CD-CE1 4.35Å; K205-F238 HydrophobicContact CD-CE2 4.4Å; K205-F238 HydrophobicContact CD-CG 4.04Å; K205-F238 HydrophobicContact CD-CZ 4.49Å
206	Y	98.8	Very high	98.7	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.008	14%	0.142	C	C	.	.			trans	-75.6	120.1	174.9	172.8	-127.7	0	0	0	109.5	Q149 Y199 N202 G208 L212 S239 R242 C243	Q149-Y206 PolarHBondContact OE1-O 2.82Å; Y199-Y206 AromaticContact CD2-CD1 3.96Å; Y199-Y206 HydrophobicContact CD2-CD1 3.96Å; Y199-Y206 HydrophobicContact CD2-CE1 4.46Å; Y199-Y206 VanDerWaalsContact CD2-O 3.29Å; Y199-Y206 WeakPolarHBondContact CD2-O 3.36Å; Y199-Y206 WeakPolarHBondContact CE2-O 3.37Å; N202-Y206 WeakPolarHBondContact O-CB 3.38Å; N202-Y206 PolarHBondContact O-N 3.44Å; Y206-G208 PolarHBondContact O-N 3.29Å; Y206-L212 HydrophobicContact CD2-CD1 4.47Å; Y206-L212 HydrophobicContact CE2-CD1 3.61Å; Y206-S239 WeakPolarHBondContact CD2-O 3.44Å; Y206-R242 HydrophobicContact CD1-CB 4.37Å; Y206-R242 HydrophobicContact CD2-CB 3.79Å; Y206-R242 HydrophobicContact CE2-CB 4.39Å; Y206-R242 HydrophobicContact CG-CB 3.79Å; Y206-R242 HydrophobicContact CG-CG 4.48Å; Y206-C243 HydrophobicContact CE2-CB 4.24Å
207	L	98.8	Very high	98.7	Very high	14 Å²	14	31.5 Å²	31.5	7%	0.073	14%	0.144	C	C	.	.			trans	-65.4	-23.9	-174.2	-62.4	-179.9	0	0	0	113.6	Q149 I153 K205 V211 L212 L234 S239	Q149-L207 HydrophobicContact CB-CD2 4.15Å; Q149-L207 HydrophobicContact CG-CD2 4.13Å; Q149-L207 VanDerWaalsContact OE1-CA 3.29Å; Q149-L207 PolarHBondContact OE1-O 2.85Å; I153-L207 HydrophobicContact CG2-CD1 4.05Å; K205-L207 PolarHBondContact O-N 2.82Å; L207-V211 HydrophobicContact CB-CB 4.18Å; L207-V211 HydrophobicContact CB-CG1 4.01Å; L207-V211 HydrophobicContact CD1-CG1 4.37Å; L207-V211 WeakPolarHBondContact O-CB 3.26Å; L207-V211 WeakPolarHBondContact O-CG2 3.45Å; L207-L212 HydrophobicContact CB-CD2 4.18Å; L207-L212 HydrophobicContact CB-CG 4.09Å; L207-L212 HydrophobicContact CD1-CD2 4.02Å; L207-L234 HydrophobicContact CD1-CD2 3.54Å; L207-S239 PolarHBondContact N-O 3.05Å
208	G	98.8	Very high	98.7	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	79.9	163.8	179	0	0	0	0	0	114.7	Y206 A210 V211 L212	Y206-G208 PolarHBondContact O-N 3.29Å; G208-A210 PolarHBondContact O-N 3.41Å; G208-V211 PolarHBondContact O-N 3.49Å; G208-L212 WeakPolarHBondContact O-CB 3.24Å; G208-L212 VanDerWaalsContact O-CG 3.29Å; G208-L212 WeakPolarHBondContact O-CG 3.31Å; G208-L212 PolarHBondContact O-N 3.24Å
209	P	98.9	Very high	98.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62.3	-34.8	-171.9	24.1	-36.5	0	0	0	115.2	C192 S193 C196 M213 C249 P259 I263	C192-P209 VanDerWaalsContact C-CG 3.5Å; C192-P209 HydrophobicContact CB-CB 4.43Å; C192-P209 HydrophobicContact CB-CG 4.03Å; C192-P209 WeakPolarHBondContact O-CG 3.41Å; S193-P209 WeakPolarHBondContact OG-CD 3.47Å; C196-P209 HydrophobicContact CB-CG 4.43Å; P209-M213 VanDerWaalsContact O-CB 3.3Å; P209-M213 WeakPolarHBondContact O-CB 3.21Å; P209-M213 PolarHBondContact O-N 3.23Å; P209-M213 VanDerWaalsContact O-N 3.09Å; P209-C249 HydrophobicContact CB-CB 3.57Å; P209-C249 HydrophobicContact CG-CB 3.63Å; P209-P259 HydrophobicContact CB-CB 3.8Å; P209-P259 HydrophobicContact CB-CG 4.14Å; P209-I263 HydrophobicContact CB-CD1 4.05Å
210	A	98.9	Very high	98.7	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.008	15%	0.146	C	C	.	.	H	α-helix	trans	-65.7	-49.7	179.6	0	0	0	0	0	111.5	F146 S193 G208 Q214	F146-A210 HydrophobicContact CE2-CB 3.62Å; F146-A210 HydrophobicContact CZ-CB 3.8Å; S193-A210 PolarHBondContact OG-N 2.99Å; G208-A210 PolarHBondContact O-N 3.41Å; A210-Q214 WeakPolarHBondContact O-CG 3.42Å; A210-Q214 PolarHBondContact O-N 2.94Å
211	V	98.9	Very high	98.7	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-68	-44.5	-177.7	177.2	0	0	0	0	110.1	Q149 I153 L207 G208 M213 Q214 A215	Q149-V211 HydrophobicContact CB-CG2 4.03Å; Q149-V211 WeakPolarHBondContact O-CG1 3.47Å; I153-V211 HydrophobicContact CB-CG1 4.46Å; I153-V211 HydrophobicContact CD1-CG1 4Å; I153-V211 WeakPolarHBondContact CD1-O 3.26Å; I153-V211 HydrophobicContact CG1-CG1 4.07Å; I153-V211 HydrophobicContact CG2-CG1 3.56Å; L207-V211 HydrophobicContact CB-CB 4.18Å; L207-V211 HydrophobicContact CB-CG1 4.01Å; L207-V211 HydrophobicContact CD1-CG1 4.37Å; L207-V211 WeakPolarHBondContact O-CB 3.26Å; L207-V211 WeakPolarHBondContact O-CG2 3.45Å; G208-V211 PolarHBondContact O-N 3.49Å; V211-M213 PolarHBondContact O-N 3.05Å; V211-Q214 CarbonylContact O-C 3.54Å; V211-Q214 WeakPolarHBondContact O-CA 3.5Å; V211-Q214 WeakPolarHBondContact O-CB 3.43Å; V211-Q214 PolarHBondContact O-N 2.86Å; V211-Q214 VanDerWaalsContact O-N 3.08Å; V211-A215 PolarHBondContact O-N 3.3Å
212	L	98.9	Very high	98.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-63.6	-39.3	179	-69.2	170	0	0	0	112.7	Y206 L207 G208 Q214 A215 Y216 L234 L240 I263 I266	Y206-L212 HydrophobicContact CD2-CD1 4.47Å; Y206-L212 HydrophobicContact CE2-CD1 3.61Å; L207-L212 HydrophobicContact CB-CD2 4.18Å; L207-L212 HydrophobicContact CB-CG 4.09Å; L207-L212 HydrophobicContact CD1-CD2 4.02Å; G208-L212 WeakPolarHBondContact O-CB 3.24Å; G208-L212 VanDerWaalsContact O-CG 3.29Å; G208-L212 WeakPolarHBondContact O-CG 3.31Å; G208-L212 PolarHBondContact O-N 3.24Å; L212-Q214 VanDerWaalsContact C-N 3.27Å; L212-Q214 PolarHBondContact O-N 3.34Å; L212-A215 WeakPolarHBondContact O-CB 3.41Å; L212-A215 PolarHBondContact O-N 3.48Å; L212-Y216 PolarHBondContact O-N 3.08Å; L212-L234 HydrophobicContact CD2-CD1 4.16Å; L212-L234 HydrophobicContact CD2-CD2 4.15Å; L212-L240 HydrophobicContact CD1-CD1 4.03Å; L212-L240 HydrophobicContact CD2-CB 4.44Å; L212-L240 HydrophobicContact CD2-CD1 3.99Å; L212-I263 HydrophobicContact CB-CD1 4.29Å; L212-I263 HydrophobicContact CB-CG1 3.72Å; L212-I263 HydrophobicContact CD1-CD1 4.02Å; L212-I263 HydrophobicContact CD1-CG1 3.94Å; L212-I263 HydrophobicContact CG-CG1 4.49Å; L212-I266 HydrophobicContact CB-CD1 4.12Å; L212-I266 HydrophobicContact CD2-CD1 4.45Å; L212-I266 VanDerWaalsContact O-CD1 3.24Å; L212-I266 WeakPolarHBondContact O-CD1 3.47Å
213	M	98.9	Very high	98.7	Very high	4 Å²	4	23.4 Å²	23.4	2%	0.02	12%	0.115	C	C	.	.	H	α-helix	trans	-63.4	-34.9	173.9	-172.9	173.8	77.7	0	0	112	L183 C186 P209 V211 R217 L257 P259 A262	L183-M213 HydrophobicContact CD2-CG 3.68Å; L183-M213 HydrophobicContact CD2-SD 4.33Å; C186-M213 HydrophobicContact CB-CE 3.75Å; P209-M213 VanDerWaalsContact O-CB 3.3Å; P209-M213 WeakPolarHBondContact O-CB 3.21Å; P209-M213 PolarHBondContact O-N 3.23Å; P209-M213 VanDerWaalsContact O-N 3.09Å; V211-M213 PolarHBondContact O-N 3.05Å; M213-R217 PolarHBondContact O-N 3.46Å; M213-L257 HydrophobicContact CE-CB 4.1Å; M213-L257 HydrophobicContact CE-CD1 3.66Å; M213-L257 HydrophobicContact SD-CB 4.16Å; M213-P259 HydrophobicContact CB-CB 4.04Å; M213-P259 HydrophobicContact CG-CB 4.43Å; M213-P259 VanDerWaalsContact SD-CA 3.59Å; M213-P259 HydrophobicContact SD-CB 3.76Å; M213-P259 HydrophobicContact SD-CG 4.48Å; M213-A262 HydrophobicContact CB-CB 4.09Å; M213-A262 HydrophobicContact CG-CB 3.76Å
214	Q	98.9	Very high	98.7	Very high	12 Å²	12	23.3 Å²	23.3	6%	0.056	11%	0.113	C	C	.	.	H	α-helix	trans	-72.4	-35.2	173.5	-70.3	-65	-62.7	0	0	112.6	Y150 I153 L183 C186 L188 A210 V211 L212 Y216 R217 W218	Y150-Q214 HydrophobicContact CD2-CB 4.29Å; Y150-Q214 HydrophobicContact CD2-CG 4.35Å; Y150-Q214 HydrophobicContact CE2-CB 3.86Å; Y150-Q214 HydrophobicContact CE2-CG 3.81Å; I153-Q214 HydrophobicContact CD1-CB 3.77Å; L183-Q214 PolarHBondContact O-NE2 3.11Å; C186-Q214 VanDerWaalsContact CB-NE2 3.32Å; L188-Q214 HydrophobicContact CD2-CG 4.29Å; A210-Q214 WeakPolarHBondContact O-CG 3.42Å; A210-Q214 PolarHBondContact O-N 2.94Å; V211-Q214 CarbonylContact O-C 3.54Å; V211-Q214 WeakPolarHBondContact O-CA 3.5Å; V211-Q214 WeakPolarHBondContact O-CB 3.43Å; V211-Q214 PolarHBondContact O-N 2.86Å; V211-Q214 VanDerWaalsContact O-N 3.08Å; L212-Q214 VanDerWaalsContact C-N 3.27Å; L212-Q214 PolarHBondContact O-N 3.34Å; Q214-Y216 VanDerWaalsContact C-N 3.32Å; Q214-Y216 PolarHBondContact O-N 3.21Å; Q214-R217 WeakPolarHBondContact O-CB 3.35Å; Q214-R217 PolarHBondContact O-N 3.02Å; Q214-W218 PolarHBondContact O-N 2.74Å
215	A	98.9	Very high	98.8	Very high	5 Å²	5	21.4 Å²	21.4	4%	0.041	10%	0.102	C	C	.	.	H	α-helix	trans	-60.5	-46.1	171.7	0	0	0	0	0	110.3	I153 V211 L212 R217 W218 M219	I153-A215 HydrophobicContact CB-CB 4.34Å; I153-A215 HydrophobicContact CD1-CB 4.06Å; I153-A215 HydrophobicContact CG2-CB 4.19Å; V211-A215 PolarHBondContact O-N 3.3Å; L212-A215 WeakPolarHBondContact O-CB 3.41Å; L212-A215 PolarHBondContact O-N 3.48Å; A215-R217 VanDerWaalsContact C-N 3.34Å; A215-R217 PolarHBondContact O-N 3.48Å; A215-W218 PolarHBondContact O-N 2.65Å; A215-W218 VanDerWaalsContact O-N 3.14Å; A215-M219 HydrophobicContact CB-CE 4.06Å; A215-M219 VanDerWaalsContact O-CG 3.29Å; A215-M219 WeakPolarHBondContact O-CG 3.46Å; A215-M219 PolarHBondContact O-N 3.32Å
216	Y	98.9	Very high	98.8	Very high	33 Å²	33	18.9 Å²	18.9	13%	0.129	9%	0.091	C	C	.	.	H	α-helix	trans	-59.3	-42.3	174.8	-173.1	-118.7	0	0	0	112.7	L183 L212 Q214 W218 M219 I220 A262 E265 I266 M269	L183-Y216 HydrophobicContact CD1-CD1 3.75Å; L183-Y216 HydrophobicContact CD1-CE1 4.03Å; L183-Y216 HydrophobicContact CD2-CD1 3.99Å; L183-Y216 HydrophobicContact CD2-CE1 4.5Å; L212-Y216 PolarHBondContact O-N 3.08Å; Q214-Y216 VanDerWaalsContact C-N 3.32Å; Q214-Y216 PolarHBondContact O-N 3.21Å; Y216-W218 PolarHBondContact O-N 2.92Å; Y216-W218 VanDerWaalsContact O-N 3.16Å; Y216-M219 PolarHBondContact O-N 2.92Å; Y216-M219 VanDerWaalsContact O-N 3.09Å; Y216-I220 HydrophobicContact CD1-CD1 4.23Å; Y216-I220 HydrophobicContact CD2-CG2 3.98Å; Y216-I220 HydrophobicContact CE1-CD1 3.68Å; Y216-I220 HydrophobicContact CE1-CG2 4.39Å; Y216-I220 HydrophobicContact CE2-CG2 3.44Å; Y216-I220 VanDerWaalsContact CE2-CG2 3.44Å; Y216-I220 WeakPolarHBondContact O-CG1 3.46Å; Y216-I220 PolarHBondContact O-N 3.01Å; Y216-A262 HydrophobicContact CD1-CB 3.76Å; Y216-A262 HydrophobicContact CE1-CB 4.47Å; Y216-A262 HydrophobicContact CG-CB 4.26Å; Y216-E265 HydrophobicContact CD2-CB 4.28Å; Y216-E265 HydrophobicContact CE1-CB 4.1Å; Y216-E265 HydrophobicContact CE1-CG 4.48Å; Y216-E265 HydrophobicContact CE2-CB 3.48Å; Y216-E265 VanDerWaalsContact CE2-CB 3.48Å; Y216-E265 WeakPolarHBondContact OH-CB 3.35Å; Y216-I266 HydrophobicContact CD2-CG1 3.71Å; Y216-I266 HydrophobicContact CG-CG1 4.04Å; Y216-M269 HydrophobicContact CD2-SD 4.11Å; Y216-M269 HydrophobicContact CE2-SD 3.71Å
217	R	98.9	Very high	98.8	Very high	30 Å²	30	20.6 Å²	20.6	11%	0.113	10%	0.102	C	C	.	.	H	α-helix	trans	-53.7	-33.6	175.2	178.7	-94	176.4	-89.2	6.6	113.3	L183 M213 Q214 A215 D221	L183-R217 HydrophobicContact CB-CB 3.94Å; L183-R217 HydrophobicContact CB-CG 4.06Å; L183-R217 HydrophobicContact CD1-CB 4.25Å; M213-R217 PolarHBondContact O-N 3.46Å; Q214-R217 WeakPolarHBondContact O-CB 3.35Å; Q214-R217 PolarHBondContact O-N 3.02Å; A215-R217 VanDerWaalsContact C-N 3.34Å; A215-R217 PolarHBondContact O-N 3.48Å; R217-D221 IonicContact CZ-OD2 3.6Å; R217-D221 IonicContact NH1-OD2 3.02Å; R217-D221 PolarHBondContact NH1-OD2 2.97Å; R217-D221 IonicContact NH2-OD2 2.86Å; R217-D221 PolarHBondContact NH2-OD2 2.72Å
218	W	98.9	Very high	98.7	Very high	27 Å²	27	24.2 Å²	24.2	10%	0.102	12%	0.119	C	C	.	.	H	α-helix	trans	-86	-35.6	176.8	-69.5	108.4	0	0	0	112.5	P155 Y156 L157 Q214 A215 Y216 I220 D221	P155-W218 WeakPolarHBondContact O-CZ2 3.28Å; Y156-W218 VanDerWaalsContact C-CH2 3.46Å; Y156-W218 VanDerWaalsContact C-CZ3 3.4Å; Y156-W218 VanDerWaalsContact CA-CZ2 3.44Å; L157-W218 VanDerWaalsContact CA-CZ3 3.43Å; L157-W218 HydrophobicContact CB-CH2 4.38Å; L157-W218 HydrophobicContact CB-CZ3 3.8Å; L157-W218 HydrophobicContact CD1-CZ3 4.28Å; L157-W218 VanDerWaalsContact N-CH2 3.34Å; Q214-W218 PolarHBondContact O-N 2.74Å; A215-W218 PolarHBondContact O-N 2.65Å; A215-W218 VanDerWaalsContact O-N 3.14Å; Y216-W218 PolarHBondContact O-N 2.92Å; Y216-W218 VanDerWaalsContact O-N 3.16Å; W218-I220 PolarHBondContact O-N 2.86Å; W218-D221 PolarHBondContact O-N 2.89Å
219	M	98.7	Very high	98.7	Very high	5 Å²	5	27.8 Å²	27.8	3%	0.025	14%	0.135	C	C	.	.	H	α-helix	trans	-60.4	-30.3	178.1	-70.6	166.6	-174.1	0	0	113.9	A215 Y216 T227 R230 L231 L234 I266 M269	A215-M219 HydrophobicContact CB-CE 4.06Å; A215-M219 VanDerWaalsContact O-CG 3.29Å; A215-M219 WeakPolarHBondContact O-CG 3.46Å; A215-M219 PolarHBondContact O-N 3.32Å; Y216-M219 PolarHBondContact O-N 2.92Å; Y216-M219 VanDerWaalsContact O-N 3.09Å; M219-T227 HydrophobicContact CB-CG2 4.11Å; M219-T227 WeakPolarHBondContact O-CG2 3.5Å; M219-T227 PolarHBondContact O-OG1 2.77Å; M219-R230 HydrophobicContact CE-CB 3.98Å; M219-R230 HydrophobicContact CG-CB 3.94Å; M219-L231 HydrophobicContact CE-CD2 4.04Å; M219-L231 HydrophobicContact CE-CG 4.44Å; M219-L231 HydrophobicContact SD-CD2 3.84Å; M219-L231 HydrophobicContact SD-CG 4.4Å; M219-L234 HydrophobicContact CE-CD1 3.71Å; M219-I266 HydrophobicContact CE-CG2 4.4Å; M219-I266 HydrophobicContact SD-CG1 4.14Å; M219-I266 HydrophobicContact SD-CG2 4.33Å; M219-M269 HydrophobicContact CB-CE 4Å
220	I	98.7	Very high	98.7	Very high	35 Å²	35	28.4 Å²	28.4	18%	0.179	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	1.6	-175.9	73.1	172.2	0	0	0	114.3	K179 L180 L183 Y216 W218 S222 M269	K179-I220 HydrophobicContact CB-CD1 4.17Å; K179-I220 WeakPolarHBondContact O-CD1 3.41Å; L180-I220 HydrophobicContact CD2-CG1 4.22Å; L183-I220 HydrophobicContact CD1-CD1 3.56Å; L183-I220 HydrophobicContact CD1-CG1 4.27Å; Y216-I220 HydrophobicContact CD1-CD1 4.23Å; Y216-I220 HydrophobicContact CD2-CG2 3.98Å; Y216-I220 HydrophobicContact CE1-CD1 3.68Å; Y216-I220 HydrophobicContact CE1-CG2 4.39Å; Y216-I220 HydrophobicContact CE2-CG2 3.44Å; Y216-I220 VanDerWaalsContact CE2-CG2 3.44Å; Y216-I220 WeakPolarHBondContact O-CG1 3.46Å; Y216-I220 PolarHBondContact O-N 3.01Å; W218-I220 PolarHBondContact O-N 2.86Å; I220-S222 PolarHBondContact O-N 3.48Å; I220-M269 HydrophobicContact CG2-SD 4.33Å
221	D	98.9	Very high	98.6	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.011	14%	0.138	C	C	.	.			trans	-71.4	118.4	172	-164.9	-37.5	0	0	0	107.9	Q172 L180 R217 W218 R223 D224	Q172-D221 PolarHBondContact NE2-OD1 3.46Å; L180-D221 HydrophobicContact CD2-CB 4.16Å; R217-D221 IonicContact CZ-OD2 3.6Å; R217-D221 IonicContact NH1-OD2 3.02Å; R217-D221 PolarHBondContact NH1-OD2 2.97Å; R217-D221 IonicContact NH2-OD2 2.86Å; R217-D221 PolarHBondContact NH2-OD2 2.72Å; W218-D221 PolarHBondContact O-N 2.89Å; D221-R223 PolarHBondContact O-N 3.38Å; D221-R223 IonicContact OD1-CZ 2.77Å; D221-R223 PolarHBondContact OD1-N 3.27Å; D221-R223 IonicContact OD1-NE 3.6Å; D221-R223 PolarHBondContact OD1-NE 2.98Å; D221-R223 IonicContact OD1-NH2 3.49Å; D221-R223 PolarHBondContact OD1-NH2 2.73Å; D221-R223 IonicContact OD2-CZ 3.45Å; D221-R223 IonicContact OD2-NE 3.66Å; D221-R223 IonicContact OD2-NH2 2.75Å; D221-R223 PolarHBondContact OD2-NH2 3.37Å; D221-D224 HydrophobicContact CB-CB 4.47Å; D221-D224 PolarHBondContact O-N 3.43Å
222	S	98.7	Very high	98.6	Very high	48 Å²	48	30.7 Å²	30.7	34%	0.336	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-11.7	-175.7	59.4	0	0	0	0	114.3	Q172 E176 I220	Q172-S222 PolarHBondContact NE2-OG 3.04Å; E176-S222 VanDerWaalsContact CD-OG 3.22Å; E176-S222 VanDerWaalsContact OE1-CB 3.26Å; E176-S222 WeakPolarHBondContact OE1-CB 3.36Å; E176-S222 WeakPolarHBondContact OE2-CB 3.32Å; E176-S222 PolarHBondContact OE2-OG 3.22Å; I220-S222 PolarHBondContact O-N 3.48Å
223	R	98.4	Very high	98.5	Very high	66 Å²	66	34.9 Å²	34.9	25%	0.249	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-13.3	179.7	-57.3	169.9	-63	168.8	4	113.2	L157 Q172 D221	L157-R223 HydrophobicContact CD1-CB 3.84Å; L157-R223 HydrophobicContact CD2-CB 4.47Å; Q172-R223 HydrophobicContact CB-CG 4.39Å; D221-R223 PolarHBondContact O-N 3.38Å; D221-R223 IonicContact OD1-CZ 2.77Å; D221-R223 PolarHBondContact OD1-N 3.27Å; D221-R223 IonicContact OD1-NE 3.6Å; D221-R223 PolarHBondContact OD1-NE 2.98Å; D221-R223 IonicContact OD1-NH2 3.49Å; D221-R223 PolarHBondContact OD1-NH2 2.73Å; D221-R223 IonicContact OD2-CZ 3.45Å; D221-R223 IonicContact OD2-NE 3.66Å; D221-R223 IonicContact OD2-NH2 2.75Å; D221-R223 PolarHBondContact OD2-NH2 3.37Å
224	D	98.7	Very high	98.4	Very high	9 Å²	9	34.9 Å²	34.9	5%	0.048	17%	0.174	C	C	.	.			trans	-90.8	127.5	-178.4	-164.6	-94.4	0	0	0	110.9	L157 K158 D221 F226 R230	L157-D224 HydrophobicContact CD1-CB 4.01Å; K158-D224 PolarHBondContact N-OD2 3.34Å; D221-D224 HydrophobicContact CB-CB 4.47Å; D221-D224 PolarHBondContact O-N 3.43Å; D224-F226 PolarHBondContact OD1-N 3.22Å; D224-F226 VanDerWaalsContact OD1-N 3.14Å; D224-R230 IonicContact OD1-CZ 3.69Å; D224-R230 IonicContact OD1-NE 3.63Å; D224-R230 PolarHBondContact OD1-NE 3.25Å; D224-R230 IonicContact OD1-NH2 2.67Å; D224-R230 PolarHBondContact OD1-NH2 3.26Å; D224-R230 IonicContact OD2-CZ 2.87Å; D224-R230 IonicContact OD2-NE 3.6Å; D224-R230 IonicContact OD2-NH2 3.25Å; D224-R230 PolarHBondContact OD2-NH2 2.85Å
225	D	98.5	Very high	98.3	Very high	67 Å²	67	39 Å²	39	36%	0.358	19%	0.193	S	C	.	.	S	Bend	trans	-98.3	11.8	-176	-58.1	-38.6	0	0	0	113.1	K158 K159 K160	K158-D225 PolarHBondContact O-N 3.42Å; K159-D225 WeakPolarHBondContact CA-OD2 3.37Å; K159-D225 WeakPolarHBondContact CE-OD2 3.46Å; K160-D225 WeakPolarHBondContact CE-O 3.2Å; K160-D225 HydrophobicContact CG-CB 3.78Å; K160-D225 PolarHBondContact N-OD2 2.89Å
226	F	98.4	Very high	98.1	Very high	36 Å²	36	41.1 Å²	41.1	16%	0.158	20%	0.204	C	C	.	.			trans	-119	25	-170.6	-78.4	-102.4	0	0	0	113.9	K158 K160 D224 E228 E229 R230	K158-F226 HydrophobicContact CB-CB 4.24Å; K158-F226 HydrophobicContact CB-CD2 3.3Å; K158-F226 HydrophobicContact CB-CE2 3.73Å; K158-F226 HydrophobicContact CB-CG 3.89Å; K158-F226 HydrophobicContact CD-CB 4.39Å; K158-F226 HydrophobicContact CD-CD2 4.43Å; K158-F226 HydrophobicContact CD-CG 4.22Å; K158-F226 HydrophobicContact CG-CD2 4.47Å; K160-F226 HydrophobicContact CD-CE2 3.84Å; K160-F226 HydrophobicContact CD-CZ 3.87Å; K160-F226 VanDerWaalsContact NZ-CE1 3.34Å; D224-F226 PolarHBondContact OD1-N 3.22Å; D224-F226 VanDerWaalsContact OD1-N 3.14Å; F226-E228 VanDerWaalsContact C-N 3.3Å; F226-E228 PolarHBondContact O-N 3.28Å; F226-E229 VanDerWaalsContact CA-OE2 3.26Å; F226-E229 WeakPolarHBondContact CA-OE2 3.39Å; F226-E229 HydrophobicContact CD1-CB 4.12Å; F226-E229 HydrophobicContact CD1-CG 3.99Å; F226-E229 PolarHBondContact O-N 2.96Å; F226-R230 WeakPolarHBondContact O-CB 3.4Å; F226-R230 VanDerWaalsContact O-CG 3.23Å; F226-R230 WeakPolarHBondContact O-CG 3.48Å; F226-R230 PolarHBondContact O-N 2.85Å
227	T	98.4	Very high	98	Very high	39 Å²	39	43.8 Å²	43.8	24%	0.239	23%	0.226	C	C	.	.	H	α-helix	trans	-54.7	-43.7	-179.9	-54.4	0	0	0	0	112.6	M219 R230 L231 M269	M219-T227 HydrophobicContact CB-CG2 4.11Å; M219-T227 WeakPolarHBondContact O-CG2 3.5Å; M219-T227 PolarHBondContact O-OG1 2.77Å; T227-R230 PolarHBondContact O-N 2.96Å; T227-L231 HydrophobicContact CG2-CD1 4.26Å; T227-L231 WeakPolarHBondContact O-CG 3.32Å; T227-L231 PolarHBondContact O-N 3.2Å; T227-M269 HydrophobicContact CG2-CE 3.55Å
228	E	97.8	Very high	98	Very high	90 Å²	90	45.2 Å²	45.2	42%	0.421	23%	0.233	S	C	.	.	H	α-helix	trans	-65.8	-44.3	-179.6	-69.3	-175.2	178.7	0	0	111.9	F226 R230 L231 A232	F226-E228 VanDerWaalsContact C-N 3.3Å; F226-E228 PolarHBondContact O-N 3.28Å; E228-R230 VanDerWaalsContact C-N 3.33Å; E228-R230 PolarHBondContact O-N 3.37Å; E228-L231 PolarHBondContact O-N 3.06Å; E228-A232 WeakPolarHBondContact O-CB 3.4Å; E228-A232 PolarHBondContact O-N 3.38Å
229	E	98.1	Very high	97.9	Very high	75 Å²	75	44.8 Å²	44.8	35%	0.35	23%	0.234	S	C	.	.	H	α-helix	trans	-67.3	-34.7	177.6	-63.9	87.9	159.1	0	0	112.1	K160 F226 A232 K233	K160-E229 IonicContact NZ-OE1 2.6Å; K160-E229 PolarHBondContact NZ-OE1 3.19Å; K160-E229 IonicContact NZ-OE2 3.82Å; F226-E229 VanDerWaalsContact CA-OE2 3.26Å; F226-E229 WeakPolarHBondContact CA-OE2 3.39Å; F226-E229 HydrophobicContact CD1-CB 4.12Å; F226-E229 HydrophobicContact CD1-CG 3.99Å; F226-E229 PolarHBondContact O-N 2.96Å; E229-A232 PolarHBondContact O-N 3.35Å; E229-K233 WeakPolarHBondContact O-CG 3.47Å; E229-K233 PolarHBondContact O-N 2.96Å
230	R	98.5	Very high	97.9	Very high	13 Å²	13	44.5 Å²	44.5	5%	0.049	23%	0.233	C	C	.	.	H	α-helix	trans	-65.4	-38.4	173.7	-71.5	174.3	-171.1	-73.3	5.3	111.7	I153 E154 Y156 M219 D224 F226 T227 E228	I153-R230 PolarHBondContact O-NH1 3.03Å; I153-R230 VanDerWaalsContact O-NH1 3.09Å; E154-R230 PolarHBondContact O-NH1 3.09Å; Y156-R230 PolarHBondContact O-NH2 3.34Å; M219-R230 HydrophobicContact CE-CB 3.98Å; M219-R230 HydrophobicContact CG-CB 3.94Å; D224-R230 IonicContact OD1-CZ 3.69Å; D224-R230 IonicContact OD1-NE 3.63Å; D224-R230 PolarHBondContact OD1-NE 3.25Å; D224-R230 IonicContact OD1-NH2 2.67Å; D224-R230 PolarHBondContact OD1-NH2 3.26Å; D224-R230 IonicContact OD2-CZ 2.87Å; D224-R230 IonicContact OD2-NE 3.6Å; D224-R230 IonicContact OD2-NH2 3.25Å; D224-R230 PolarHBondContact OD2-NH2 2.85Å; F226-R230 WeakPolarHBondContact O-CB 3.4Å; F226-R230 VanDerWaalsContact O-CG 3.23Å; F226-R230 WeakPolarHBondContact O-CG 3.48Å; F226-R230 PolarHBondContact O-N 2.85Å; T227-R230 PolarHBondContact O-N 2.96Å; E228-R230 VanDerWaalsContact C-N 3.33Å; E228-R230 PolarHBondContact O-N 3.37Å
231	L	98.3	Very high	97.9	Very high	3 Å²	3	46.6 Å²	46.6	2%	0.016	24%	0.239	C	C	.	.	H	α-helix	trans	-68.5	-43.9	173.8	-70.8	168.1	0	0	0	111.3	M219 T227 E228 K233 L234 I266 M269 M270 Y273	M219-L231 HydrophobicContact CE-CD2 4.04Å; M219-L231 HydrophobicContact CE-CG 4.44Å; M219-L231 HydrophobicContact SD-CD2 3.84Å; M219-L231 HydrophobicContact SD-CG 4.4Å; T227-L231 HydrophobicContact CG2-CD1 4.26Å; T227-L231 WeakPolarHBondContact O-CG 3.32Å; T227-L231 PolarHBondContact O-N 3.2Å; E228-L231 PolarHBondContact O-N 3.06Å; L231-K233 PolarHBondContact O-N 3.44Å; L231-L234 WeakPolarHBondContact O-CB 3.49Å; L231-L234 PolarHBondContact O-N 3.46Å; L231-I266 HydrophobicContact CD2-CG2 4.27Å; L231-M269 HydrophobicContact CD1-CB 4.17Å; L231-M269 HydrophobicContact CD1-CE 4.26Å; L231-M269 HydrophobicContact CD2-CB 3.84Å; L231-M270 HydrophobicContact CB-SD 3.79Å; L231-M270 HydrophobicContact CD2-CG 3.97Å; L231-M270 HydrophobicContact CD2-SD 3.61Å; L231-M270 HydrophobicContact CG-SD 4.29Å; L231-M270 VanDerWaalsContact O-SD 3.39Å; L231-Y273 HydrophobicContact CB-CD1 4.41Å; L231-Y273 HydrophobicContact CB-CE1 4.17Å; L231-Y273 HydrophobicContact CB-CE2 4.45Å; L231-Y273 HydrophobicContact CD1-CD1 3.99Å; L231-Y273 HydrophobicContact CD1-CD2 4.3Å; L231-Y273 HydrophobicContact CD1-CG 3.81Å
232	A	97.3	Very high	97.9	Very high	45 Å²	45	50.2 Å²	50.2	37%	0.372	25%	0.252	S	S	.	.	H	α-helix	trans	-57.5	-36.2	179.2	0	0	0	0	0	112.6	E228 E229 L234 Q235	E228-A232 WeakPolarHBondContact O-CB 3.4Å; E228-A232 PolarHBondContact O-N 3.38Å; E229-A232 PolarHBondContact O-N 3.35Å; A232-L234 PolarHBondContact O-N 3.36Å; A232-L234 VanDerWaalsContact O-N 3.09Å; A232-Q235 WeakPolarHBondContact O-CB 3.43Å; A232-Q235 PolarHBondContact O-N 3.29Å; A232-Q235 VanDerWaalsContact O-N 3.08Å
233	K	97.2	Very high	97.9	Very high	89 Å²	89	48.7 Å²	48.7	39%	0.387	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-15.4	174	-76.1	-178.6	174.4	-172.7	0	114.8	E154 E229 L231	E154-K233 IonicContact OE1-NZ 3.58Å; E154-K233 PolarHBondContact OE1-NZ 2.7Å; E154-K233 IonicContact OE2-NZ 3.09Å; E154-K233 PolarHBondContact OE2-NZ 2.79Å; E229-K233 WeakPolarHBondContact O-CG 3.47Å; E229-K233 PolarHBondContact O-N 2.96Å; L231-K233 PolarHBondContact O-N 3.44Å
234	L	97.8	Very high	97.9	Very high	4 Å²	4	50.9 Å²	50.9	2%	0.021	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	3.3	179.1	-55.2	-176.8	0	0	0	112.9	L207 L212 M219 L231 A232 D236 L240 I266 M270	L207-L234 HydrophobicContact CD1-CD2 3.54Å; L212-L234 HydrophobicContact CD2-CD1 4.16Å; L212-L234 HydrophobicContact CD2-CD2 4.15Å; M219-L234 HydrophobicContact CE-CD1 3.71Å; L231-L234 WeakPolarHBondContact O-CB 3.49Å; L231-L234 PolarHBondContact O-N 3.46Å; A232-L234 PolarHBondContact O-N 3.36Å; A232-L234 VanDerWaalsContact O-N 3.09Å; L234-D236 PolarHBondContact O-N 2.85Å; L234-L240 HydrophobicContact CB-CB 4.16Å; L234-L240 HydrophobicContact CB-CD2 4.47Å; L234-L240 HydrophobicContact CD1-CB 4.46Å; L234-L240 HydrophobicContact CD1-CD2 4.4Å; L234-I266 HydrophobicContact CD1-CG2 3.74Å; L234-M270 HydrophobicContact CB-CE 4.08Å; L234-M270 HydrophobicContact CB-SD 4.33Å
235	Q	95.6	Very high	97.9	Very high	97 Å²	97	55 Å²	55	45%	0.453	28%	0.28	S	S	.	.			trans	-78.9	63.9	178.8	-71.6	-69.4	10.1	0	0	112.2	A232 M270 Y273	A232-Q235 WeakPolarHBondContact O-CB 3.43Å; A232-Q235 PolarHBondContact O-N 3.29Å; A232-Q235 VanDerWaalsContact O-N 3.08Å; Q235-M270 HydrophobicContact CG-CE 3.69Å; Q235-Y273 VanDerWaalsContact CG-OH 3.25Å; Q235-Y273 WeakPolarHBondContact CG-OH 3.14Å; Q235-Y273 VanDerWaalsContact NE2-CE1 3.34Å; Q235-Y273 PolarHBondContact NE2-OH 3.12Å
236	D	96.3	Very high	97.9	Very high	51 Å²	51	55.3 Å²	55.3	27%	0.273	28%	0.28	S	S	.	.	S	Bend	trans	-149.1	163.4	171.7	73.5	86.3	0	0	0	110.6	L234 F238 S239 Y241	L234-D236 PolarHBondContact O-N 2.85Å; D236-F238 PolarHBondContact O-N 3.35Å; D236-F238 WeakPolarHBondContact OD1-CA 3.39Å; D236-F238 WeakPolarHBondContact OD1-CB 3.27Å; D236-F238 PolarHBondContact OD1-N 3.16Å; D236-S239 PolarHBondContact OD1-N 3.09Å; D236-S239 PolarHBondContact OD1-OG 2.93Å; D236-S239 WeakPolarHBondContact OD2-CB 3.49Å; D236-S239 PolarHBondContact OD2-OG 2.77Å; D236-Y241 VanDerWaalsContact O-CD2 3.28Å; D236-Y241 WeakPolarHBondContact O-CD2 3.42Å
237	P	96.9	Very high	97.9	Very high	89 Å²	89	57.1 Å²	57.1	58%	0.578	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-15.1	-174.8	-24	34.7	0	0	0	115.7	R242	P237-R242 PolarHBondContact O-NE 3.39Å
238	F	97.8	Very high	97.9	Very high	59 Å²	59	58 Å²	58	26%	0.259	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-55.8	-168.2	-68.5	-89.1	0	0	0	114.6	K205 D236 L240 R242	K205-F238 HydrophobicContact CB-CB 3.61Å; K205-F238 HydrophobicContact CB-CD1 4Å; K205-F238 HydrophobicContact CB-CG 3.86Å; K205-F238 HydrophobicContact CD-CD1 4.12Å; K205-F238 HydrophobicContact CD-CD2 4.18Å; K205-F238 HydrophobicContact CD-CE1 4.35Å; K205-F238 HydrophobicContact CD-CE2 4.4Å; K205-F238 HydrophobicContact CD-CG 4.04Å; K205-F238 HydrophobicContact CD-CZ 4.49Å; D236-F238 PolarHBondContact O-N 3.35Å; D236-F238 WeakPolarHBondContact OD1-CA 3.39Å; D236-F238 WeakPolarHBondContact OD1-CB 3.27Å; D236-F238 PolarHBondContact OD1-N 3.16Å; F238-L240 PolarHBondContact O-N 3.11Å; F238-R242 HydrophobicContact CB-CG 4.47Å; F238-R242 HydrophobicContact CD1-CG 3.93Å
239	S	97.9	Very high	98	Very high	18 Å²	18	54.2 Å²	54.2	13%	0.126	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48	-45.3	-164.3	-66.1	0	0	0	0	113.4	Y206 L207 D236	Y206-S239 WeakPolarHBondContact CD2-O 3.44Å; L207-S239 PolarHBondContact N-O 3.05Å; D236-S239 PolarHBondContact OD1-N 3.09Å; D236-S239 PolarHBondContact OD1-OG 2.93Å; D236-S239 WeakPolarHBondContact OD2-CB 3.49Å; D236-S239 PolarHBondContact OD2-OG 2.77Å
240	L	98.5	Very high	98	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	-42.8	177.4	174.3	65.5	0	0	0	113	L212 L234 F238 R242 C243 I263 I266 K267 M270	L212-L240 HydrophobicContact CD1-CD1 4.03Å; L212-L240 HydrophobicContact CD2-CB 4.44Å; L212-L240 HydrophobicContact CD2-CD1 3.99Å; L234-L240 HydrophobicContact CB-CB 4.16Å; L234-L240 HydrophobicContact CB-CD2 4.47Å; L234-L240 HydrophobicContact CD1-CB 4.46Å; L234-L240 HydrophobicContact CD1-CD2 4.4Å; F238-L240 PolarHBondContact O-N 3.11Å; L240-R242 VanDerWaalsContact C-N 3.27Å; L240-R242 PolarHBondContact O-N 2.77Å; L240-C243 PolarHBondContact O-N 3.36Å; L240-C243 VanDerWaalsContact O-N 3.16Å; L240-I263 HydrophobicContact CD1-CG2 3.83Å; L240-I266 HydrophobicContact CD1-CB 4.33Å; L240-I266 HydrophobicContact CD1-CD1 4.47Å; L240-I266 HydrophobicContact CD1-CG2 4.05Å; L240-I266 HydrophobicContact CD2-CG2 3.66Å; L240-K267 HydrophobicContact CD1-CG 4.4Å; L240-K267 HydrophobicContact CD2-CG 4.13Å; L240-K267 HydrophobicContact CG-CG 4.32Å; L240-M270 HydrophobicContact CD2-CE 4.47Å; L240-M270 HydrophobicContact CD2-CG 3.74Å
241	Y	98.3	Very high	98	Very high	79 Å²	79	62.3 Å²	62.3	31%	0.31	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	1.7	-161.3	-65.2	-81.5	0	0	0	115.3	D236 C243 M270	D236-Y241 VanDerWaalsContact O-CD2 3.28Å; D236-Y241 WeakPolarHBondContact O-CD2 3.42Å; Y241-C243 VanDerWaalsContact C-N 3.25Å; Y241-M270 HydrophobicContact CE2-CE 4.04Å; Y241-M270 VanDerWaalsContact OH-CE 3.3Å; Y241-M270 WeakPolarHBondContact OH-CE 3.33Å
242	R	98.4	Very high	98	Very high	78 Å²	78	63.2 Å²	63.2	29%	0.294	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-4.1	164.9	-60.2	-59.5	86.3	-157.3	1.4	113.7	S198 Y206 P237 F238 L240 H244	S198-R242 WeakPolarHBondContact CB-O 3.5Å; S198-R242 PolarHBondContact OG-O 2.82Å; Y206-R242 HydrophobicContact CD1-CB 4.37Å; Y206-R242 HydrophobicContact CD2-CB 3.79Å; Y206-R242 HydrophobicContact CE2-CB 4.39Å; Y206-R242 HydrophobicContact CG-CB 3.79Å; Y206-R242 HydrophobicContact CG-CG 4.48Å; P237-R242 PolarHBondContact O-NE 3.39Å; F238-R242 HydrophobicContact CB-CG 4.47Å; F238-R242 HydrophobicContact CD1-CG 3.93Å; L240-R242 VanDerWaalsContact C-N 3.27Å; L240-R242 PolarHBondContact O-N 2.77Å; R242-H244 PolarHBondContact O-CD2 2.94Å; R242-H244 PolarHBondContact O-N 3.5Å; R242-H244 VanDerWaalsContact O-N 3.17Å; R242-H244 PolarHBondContact O-NE2 2.92Å
243	C	98.7	Very high	98.1	Very high	15 Å²	15	62 Å²	62	10%	0.101	30%	0.303	C	S	.	.			trans	-71.5	108.8	170.4	179	0	0	0	0	110.6	Y206 L240 Y241 I263 K267	Y206-C243 HydrophobicContact CE2-CB 4.24Å; L240-C243 PolarHBondContact O-N 3.36Å; L240-C243 VanDerWaalsContact O-N 3.16Å; Y241-C243 VanDerWaalsContact C-N 3.25Å; C243-I263 HydrophobicContact CB-CG2 3.77Å; C243-K267 PolarHBondContact O-NZ 2.9Å
244	H	98.4	Very high	98.2	Very high	112 Å²	112	59.6 Å²	59.6	52%	0.519	30%	0.296	S	S	.	.			trans	-103.5	28.3	176.2	-57.3	-61.6	0	0	0	112.8	R242 I246	R242-H244 PolarHBondContact O-CD2 2.94Å; R242-H244 PolarHBondContact O-N 3.5Å; R242-H244 VanDerWaalsContact O-N 3.17Å; R242-H244 PolarHBondContact O-NE2 2.92Å; H244-I246 VanDerWaalsContact C-N 3.29Å; H244-I246 PolarHBondContact O-N 2.86Å
245	T	98.5	Very high	98.2	Very high	96 Å²	96	63.5 Å²	63.5	59%	0.589	31%	0.313	S	S	*	.			trans	54.9	40.7	173.4	-39.1	0	0	0	0	113.6	M247	T245-M247 VanDerWaalsContact C-N 3.29Å; T245-M247 HydrophobicContact CG2-CG 4.18Å; T245-M247 HydrophobicContact CG2-SD 3.9Å; T245-M247 WeakPolarHBondContact O-CG 3.45Å; T245-M247 PolarHBondContact O-N 2.9Å
246	I	98.8	Very high	98.4	Very high	73 Å²	73	62.2 Å²	62.2	37%	0.374	33%	0.325	S	S	.	.			trans	-71	-25.1	179.4	-61.6	169.2	0	0	0	112	P197 H244 N248	P197-I246 HydrophobicContact CB-CD1 4.02Å; P197-I246 HydrophobicContact CG-CD1 3.99Å; P197-I246 HydrophobicContact CG-CG2 4.3Å; H244-I246 VanDerWaalsContact C-N 3.29Å; H244-I246 PolarHBondContact O-N 2.86Å; I246-N248 PolarHBondContact O-N 3.09Å; I246-N248 VanDerWaalsContact O-N 3.09Å
247	M	98.6	Very high	98.5	Very high	75 Å²	75	60.4 Å²	60.4	37%	0.369	32%	0.315	S	S	.	.			trans	64.9	4.5	174.6	-56.5	-53.7	-68.9	0	0	118	T245 C249 T250 R251	T245-M247 VanDerWaalsContact C-N 3.29Å; T245-M247 HydrophobicContact CG2-CG 4.18Å; T245-M247 HydrophobicContact CG2-SD 3.9Å; T245-M247 WeakPolarHBondContact O-CG 3.45Å; T245-M247 PolarHBondContact O-N 2.9Å; M247-C249 PolarHBondContact O-N 3.21Å; M247-T250 PolarHBondContact O-N 3.09Å; M247-R251 PolarHBondContact O-N 3.12Å
248	N	98.8	Very high	98.6	Very high	57 Å²	57	59.2 Å²	59.2	31%	0.305	30%	0.304	S	S	.	.	H	α-helix	trans	-53.7	-37.2	168.4	-82.1	4.3	0	0	0	112.6	S195 I246 T250 R251 T252	S195-N248 VanDerWaalsContact O-CB 3.27Å; S195-N248 WeakPolarHBondContact O-CB 3.39Å; S195-N248 PolarHBondContact O-ND2 2.84Å; I246-N248 PolarHBondContact O-N 3.09Å; I246-N248 VanDerWaalsContact O-N 3.09Å; N248-T250 PolarHBondContact O-N 3.45Å; N248-R251 PolarHBondContact O-N 2.93Å; N248-T252 WeakPolarHBondContact O-CB 3.15Å; N248-T252 WeakPolarHBondContact O-CG2 3.33Å; N248-T252 PolarHBondContact O-N 3.19Å
249	C	98.8	Very high	98.6	Very high	10 Å²	10	56.4 Å²	56.4	7%	0.068	29%	0.292	C	S	.	.	H	α-helix	trans	-58.1	-46.4	-177.9	53.8	0	0	0	0	113.2	C192 P209 M247 C253 P259	C192-C249 HydrophobicContact CB-CB 3.88Å; C192-C249 WeakPolarHBondContact CB-O 3.44Å; P209-C249 HydrophobicContact CB-CB 3.57Å; P209-C249 HydrophobicContact CG-CB 3.63Å; M247-C249 PolarHBondContact O-N 3.21Å; C249-C253 PolarHBondContact O-N 3.29Å; C249-P259 HydrophobicContact CB-CG 3.85Å
250	T	98.8	Very high	98.7	Very high	35 Å²	35	56 Å²	56	22%	0.215	29%	0.291	C	S	.	.	H	α-helix	trans	-71.5	-43.7	176.7	-59.3	0	0	0	0	110.9	M247 N248 T252 C253 N258 G260	M247-T250 PolarHBondContact O-N 3.09Å; N248-T250 PolarHBondContact O-N 3.45Å; T250-T252 VanDerWaalsContact C-N 3.26Å; T250-T252 PolarHBondContact O-N 3.49Å; T250-C253 PolarHBondContact O-N 3.25Å; T250-N258 HydrophobicContact CG2-CB 4.04Å; T250-N258 WeakPolarHBondContact CG2-OD1 3.42Å; T250-N258 PolarHBondContact OG1-OD1 3.24Å; T250-G260 PolarHBondContact OG1-N 2.83Å
251	R	98.8	Very high	98.7	Very high	223 Å²	223	62.3 Å²	62.3	84%	0.842	32%	0.318	S	S	*	.	H	α-helix	trans	-55.8	-40.4	178.6	176.5	-177.7	-73.6	-124.8	0.1	112.7	M247 N248	M247-R251 PolarHBondContact O-N 3.12Å; N248-R251 PolarHBondContact O-N 2.93Å
252	T	98.8	Very high	98.7	Very high	22 Å²	22	58.7 Å²	58.7	14%	0.135	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-6.8	-171.7	-147.5	0	0	0	0	113.8	N109 C191 C192 S195 N248 T250 P254	N109-T252 HydrophobicContact CB-CG2 4.37Å; N109-T252 WeakPolarHBondContact CB-OG1 3.49Å; N109-T252 PolarHBondContact N-OG1 3.06Å; N109-T252 PolarHBondContact O-OG1 3.04Å; C191-T252 HydrophobicContact CB-CG2 4.29Å; C191-T252 WeakPolarHBondContact O-CG2 3.35Å; C192-T252 HydrophobicContact CB-CG2 4.42Å; S195-T252 WeakPolarHBondContact OG-CG2 3.46Å; N248-T252 WeakPolarHBondContact O-CB 3.15Å; N248-T252 WeakPolarHBondContact O-CG2 3.33Å; N248-T252 PolarHBondContact O-N 3.19Å; T250-T252 VanDerWaalsContact C-N 3.26Å; T250-T252 PolarHBondContact O-N 3.49Å; T252-P254 VanDerWaalsContact O-CD 3.28Å; T252-P254 WeakPolarHBondContact O-CD 3.29Å; T252-P254 VanDerWaalsContact O-N 3.14Å
253	C	98.9	Very high	98.7	Very high	21 Å²	21	55.1 Å²	55.1	14%	0.142	29%	0.291	C	S	.	.			trans	-64	114.6	-173	-175.9	0	0	0	0	110.7	C249 T250 K255 G256 L257	C249-C253 PolarHBondContact O-N 3.29Å; T250-C253 PolarHBondContact O-N 3.25Å; C253-K255 PolarHBondContact O-N 3.22Å; C253-K255 VanDerWaalsContact O-N 3.09Å; C253-G256 PolarHBondContact O-N 3.37Å; C253-G256 VanDerWaalsContact O-N 3.09Å; C253-L257 PolarHBondContact SG-N 3.04Å; C253-L257 VanDerWaalsContact SG-N 3.37Å
254	P	98.6	Very high	98.8	Very high	38 Å²	38	56.5 Å²	56.5	25%	0.247	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-10.2	-176.1	30	-36.2	0	0	0	113.2	L111 T252	L111-P254 HydrophobicContact CD1-CB 3.96Å; L111-P254 HydrophobicContact CD1-CG 3.98Å; L111-P254 HydrophobicContact CD2-CG 4.19Å; L111-P254 HydrophobicContact CG-CB 3.76Å; L111-P254 HydrophobicContact CG-CG 3.78Å; T252-P254 VanDerWaalsContact O-CD 3.28Å; T252-P254 WeakPolarHBondContact O-CD 3.29Å; T252-P254 VanDerWaalsContact O-N 3.14Å
255	K	98.8	Very high	98.8	Very high	86 Å²	86	53.5 Å²	53.5	37%	0.374	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	1.4	177.5	-63.3	-60.2	-60.6	-176.3	0	113.1	I187 C253 L257	I187-K255 HydrophobicContact CD1-CD 4.28Å; I187-K255 HydrophobicContact CD1-CG 4.14Å; I187-K255 HydrophobicContact CG1-CG 4.23Å; I187-K255 HydrophobicContact CG2-CD 4.29Å; I187-K255 HydrophobicContact CG2-CG 4.27Å; C253-K255 PolarHBondContact O-N 3.22Å; C253-K255 VanDerWaalsContact O-N 3.09Å; K255-L257 HydrophobicContact CB-CD1 4.17Å; K255-L257 HydrophobicContact CB-CD2 4.41Å; K255-L257 HydrophobicContact CB-CG 3.87Å; K255-L257 PolarHBondContact O-N 2.91Å
256	G	98.6	Very high	98.8	Very high	69 Å²	69	49 Å²	49	71%	0.711	26%	0.262	S	S	*	.			trans	71.2	13.1	-179.2	0	0	0	0	0	115	C253	C253-G256 PolarHBondContact O-N 3.37Å; C253-G256 VanDerWaalsContact O-N 3.09Å
257	L	98.8	Very high	98.8	Very high	13 Å²	13	48.4 Å²	48.4	7%	0.068	26%	0.257	C	S	.	.			trans	-75	159.2	178.6	-45.7	177.3	0	0	0	111.6	E185 C186 M213 C253 K255 P259	E185-L257 HydrophobicContact CB-CD1 4.42Å; E185-L257 HydrophobicContact CB-CD2 4.09Å; C186-L257 HydrophobicContact CB-CD1 4.02Å; M213-L257 HydrophobicContact CE-CB 4.1Å; M213-L257 HydrophobicContact CE-CD1 3.66Å; M213-L257 HydrophobicContact SD-CB 4.16Å; C253-L257 PolarHBondContact SG-N 3.04Å; C253-L257 VanDerWaalsContact SG-N 3.37Å; K255-L257 HydrophobicContact CB-CD1 4.17Å; K255-L257 HydrophobicContact CB-CD2 4.41Å; K255-L257 HydrophobicContact CB-CG 3.87Å; K255-L257 PolarHBondContact O-N 2.91Å; L257-P259 VanDerWaalsContact C-CD 3.46Å; L257-P259 WeakPolarHBondContact O-CD 3.33Å
258	N	98.9	Very high	98.8	Very high	64 Å²	64	50.5 Å²	50.5	34%	0.342	26%	0.264	S	S	.	.			trans	-118.6	74	-176.5	-164.3	-15.3	0	0	0	113.1	T250 G260 K261 A262	T250-N258 HydrophobicContact CG2-CB 4.04Å; T250-N258 WeakPolarHBondContact CG2-OD1 3.42Å; T250-N258 PolarHBondContact OG1-OD1 3.24Å; N258-G260 PolarHBondContact O-N 2.82Å; N258-K261 HydrophobicContact CB-CB 4.12Å; N258-K261 VanDerWaalsContact CG-CB 3.5Å; N258-K261 PolarHBondContact O-N 2.84Å; N258-K261 PolarHBondContact OD1-N 2.93Å; N258-A262 PolarHBondContact O-N 2.87Å
259	P	98.9	Very high	98.7	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.006	26%	0.259	C	S	.	.	H	α-helix	trans	-63	-28.2	177.7	25.9	-35.1	0	0	0	113	C192 P209 M213 C249 L257 K261 A262 I263	C192-P259 HydrophobicContact CB-CG 4.36Å; P209-P259 HydrophobicContact CB-CB 3.8Å; P209-P259 HydrophobicContact CB-CG 4.14Å; M213-P259 HydrophobicContact CB-CB 4.04Å; M213-P259 HydrophobicContact CG-CB 4.43Å; M213-P259 VanDerWaalsContact SD-CA 3.59Å; M213-P259 HydrophobicContact SD-CB 3.76Å; M213-P259 HydrophobicContact SD-CG 4.48Å; C249-P259 HydrophobicContact CB-CG 3.85Å; L257-P259 VanDerWaalsContact C-CD 3.46Å; L257-P259 WeakPolarHBondContact O-CD 3.33Å; P259-K261 VanDerWaalsContact C-N 3.35Å; P259-A262 PolarHBondContact O-N 3.25Å; P259-I263 VanDerWaalsContact O-CG1 3.28Å; P259-I263 WeakPolarHBondContact O-CG1 3.49Å; P259-I263 PolarHBondContact O-N 2.83Å
260	G	98.8	Very high	98.6	Very high	9 Å²	9	49.8 Å²	49.8	9%	0.093	26%	0.259	C	S	.	.	H	α-helix	trans	-61.1	-42.7	174.4	0	0	0	0	0	112.5	T250 N258 A264	T250-G260 PolarHBondContact OG1-N 2.83Å; N258-G260 PolarHBondContact O-N 2.82Å; G260-A264 PolarHBondContact O-N 2.87Å; G260-A264 VanDerWaalsContact O-N 3.15Å
261	K	98.8	Very high	98.5	Very high	132 Å²	132	52.2 Å²	52.2	57%	0.574	28%	0.283	S	S	*	.	H	α-helix	trans	-64.6	-47.3	173.6	-178.1	-179.7	177.6	-177.1	0	111.4	N258 P259 I263 A264 E265	N258-K261 HydrophobicContact CB-CB 4.12Å; N258-K261 VanDerWaalsContact CG-CB 3.5Å; N258-K261 PolarHBondContact O-N 2.84Å; N258-K261 PolarHBondContact OD1-N 2.93Å; P259-K261 VanDerWaalsContact C-N 3.35Å; K261-I263 VanDerWaalsContact C-N 3.31Å; K261-I263 PolarHBondContact O-N 2.85Å; K261-A264 WeakPolarHBondContact O-CB 3.35Å; K261-A264 PolarHBondContact O-N 3.32Å; K261-E265 PolarHBondContact O-N 2.85Å
262	A	98.9	Very high	98.2	Very high	4 Å²	4	46.8 Å²	46.8	3%	0.033	27%	0.274	C	S	.	.	H	α-helix	trans	-56.7	-44.4	178	0	0	0	0	0	111.9	L183 M213 Y216 N258 P259 A264 E265 I266	L183-A262 HydrophobicContact CD2-CB 4.16Å; M213-A262 HydrophobicContact CB-CB 4.09Å; M213-A262 HydrophobicContact CG-CB 3.76Å; Y216-A262 HydrophobicContact CD1-CB 3.76Å; Y216-A262 HydrophobicContact CE1-CB 4.47Å; Y216-A262 HydrophobicContact CG-CB 4.26Å; N258-A262 PolarHBondContact O-N 2.87Å; P259-A262 PolarHBondContact O-N 3.25Å; A262-A264 VanDerWaalsContact C-N 3.31Å; A262-A264 PolarHBondContact O-N 2.97Å; A262-E265 PolarHBondContact O-N 2.88Å; A262-I266 WeakPolarHBondContact O-CG1 3.22Å; A262-I266 PolarHBondContact O-N 3.39Å
263	I	98.9	Very high	97.8	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.01	28%	0.276	C	S	.	.	H	α-helix	trans	-60.9	-39.4	175.4	-69.1	163.1	0	0	0	112	P209 L212 L240 C243 P259 K261 E265 I266 K267	P209-I263 HydrophobicContact CB-CD1 4.05Å; L212-I263 HydrophobicContact CB-CD1 4.29Å; L212-I263 HydrophobicContact CB-CG1 3.72Å; L212-I263 HydrophobicContact CD1-CD1 4.02Å; L212-I263 HydrophobicContact CD1-CG1 3.94Å; L212-I263 HydrophobicContact CG-CG1 4.49Å; L240-I263 HydrophobicContact CD1-CG2 3.83Å; C243-I263 HydrophobicContact CB-CG2 3.77Å; P259-I263 VanDerWaalsContact O-CG1 3.28Å; P259-I263 WeakPolarHBondContact O-CG1 3.49Å; P259-I263 PolarHBondContact O-N 2.83Å; K261-I263 VanDerWaalsContact C-N 3.31Å; K261-I263 PolarHBondContact O-N 2.85Å; I263-E265 VanDerWaalsContact C-N 3.34Å; I263-I266 PolarHBondContact O-N 2.81Å; I263-K267 WeakPolarHBondContact O-CG 3.46Å; I263-K267 PolarHBondContact O-N 3.3Å
264	A	98.8	Very high	96.8	Very high	45 Å²	45	55.2 Å²	55.2	37%	0.372	31%	0.306	S	S	.	.	H	α-helix	trans	-64.8	-38.4	176.4	0	0	0	0	0	112	G260 K261 A262 K267 K268	G260-A264 PolarHBondContact O-N 2.87Å; G260-A264 VanDerWaalsContact O-N 3.15Å; K261-A264 WeakPolarHBondContact O-CB 3.35Å; K261-A264 PolarHBondContact O-N 3.32Å; A262-A264 VanDerWaalsContact C-N 3.31Å; A262-A264 PolarHBondContact O-N 2.97Å; A264-K267 WeakPolarHBondContact O-CB 3.42Å; A264-K267 PolarHBondContact O-N 2.7Å; A264-K268 PolarHBondContact O-N 2.94Å
265	E	98.8	Very high	95.3	Very high	49 Å²	49	60.1 Å²	60.1	23%	0.229	33%	0.325	C	S	.	.	H	α-helix	trans	-66.1	-40.1	174.6	-65.5	-57.4	145.7	0	0	112.2	Y216 K261 A262 I263 K267 K268 M269	Y216-E265 HydrophobicContact CD2-CB 4.28Å; Y216-E265 HydrophobicContact CE1-CB 4.1Å; Y216-E265 HydrophobicContact CE1-CG 4.48Å; Y216-E265 HydrophobicContact CE2-CB 3.48Å; Y216-E265 VanDerWaalsContact CE2-CB 3.48Å; Y216-E265 WeakPolarHBondContact OH-CB 3.35Å; K261-E265 PolarHBondContact O-N 2.85Å; A262-E265 PolarHBondContact O-N 2.88Å; I263-E265 VanDerWaalsContact C-N 3.34Å; E265-K267 VanDerWaalsContact C-N 3.32Å; E265-K267 PolarHBondContact O-N 2.76Å; E265-K268 VanDerWaalsContact CD-NZ 3.31Å; E265-K268 WeakPolarHBondContact O-CB 3.2Å; E265-K268 PolarHBondContact O-N 2.93Å; E265-K268 IonicContact OE1-NZ 3.63Å; E265-K268 PolarHBondContact OE1-NZ 3.16Å; E265-K268 VanDerWaalsContact OE1-NZ 3.09Å; E265-K268 WeakPolarHBondContact OE2-CE 3.12Å; E265-K268 IonicContact OE2-NZ 3.61Å; E265-K268 PolarHBondContact OE2-NZ 3.22Å; E265-M269 WeakPolarHBondContact O-CG 3.42Å; E265-M269 PolarHBondContact O-N 2.95Å
266	I	98.7	Very high	93.2	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-57.1	-47.7	170.6	-59.3	167.9	0	0	0	110	L212 Y216 M219 L231 L234 L240 A262 I263 K268 M269 M270	L212-I266 HydrophobicContact CB-CD1 4.12Å; L212-I266 HydrophobicContact CD2-CD1 4.45Å; L212-I266 VanDerWaalsContact O-CD1 3.24Å; L212-I266 WeakPolarHBondContact O-CD1 3.47Å; Y216-I266 HydrophobicContact CD2-CG1 3.71Å; Y216-I266 HydrophobicContact CG-CG1 4.04Å; M219-I266 HydrophobicContact CE-CG2 4.4Å; M219-I266 HydrophobicContact SD-CG1 4.14Å; M219-I266 HydrophobicContact SD-CG2 4.33Å; L231-I266 HydrophobicContact CD2-CG2 4.27Å; L234-I266 HydrophobicContact CD1-CG2 3.74Å; L240-I266 HydrophobicContact CD1-CB 4.33Å; L240-I266 HydrophobicContact CD1-CD1 4.47Å; L240-I266 HydrophobicContact CD1-CG2 4.05Å; L240-I266 HydrophobicContact CD2-CG2 3.66Å; A262-I266 WeakPolarHBondContact O-CG1 3.22Å; A262-I266 PolarHBondContact O-N 3.39Å; I263-I266 PolarHBondContact O-N 2.81Å; I266-K268 VanDerWaalsContact C-N 3.27Å; I266-K268 PolarHBondContact O-N 3.48Å; I266-M269 WeakPolarHBondContact O-CB 3.19Å; I266-M269 PolarHBondContact O-N 2.95Å; I266-M269 VanDerWaalsContact O-N 3.09Å; I266-M270 HydrophobicContact CG2-CG 4.02Å; I266-M270 VanDerWaalsContact O-CG 3.23Å; I266-M270 WeakPolarHBondContact O-CG 3.22Å; I266-M270 PolarHBondContact O-N 2.99Å
267	K	98.4	Very high	90.6	Very high	62 Å²	62	70.2 Å²	70.2	27%	0.27	35%	0.35	S	S	.	.	H	α-helix	trans	-59.8	-35.9	179.2	-73.2	178.7	176.9	-175.6	0	112.8	L240 C243 I263 A264 E265 A271	L240-K267 HydrophobicContact CD1-CG 4.4Å; L240-K267 HydrophobicContact CD2-CG 4.13Å; L240-K267 HydrophobicContact CG-CG 4.32Å; C243-K267 PolarHBondContact O-NZ 2.9Å; I263-K267 WeakPolarHBondContact O-CG 3.46Å; I263-K267 PolarHBondContact O-N 3.3Å; A264-K267 WeakPolarHBondContact O-CB 3.42Å; A264-K267 PolarHBondContact O-N 2.7Å; E265-K267 VanDerWaalsContact C-N 3.32Å; E265-K267 PolarHBondContact O-N 2.76Å; K267-A271 PolarHBondContact O-N 2.84Å
268	K	98.4	Very high	87.9	Confident	118 Å²	118	73.7 Å²	73.7	51%	0.513	38%	0.38	S	S	.	.	H	α-helix	trans	-64.8	-46.1	173.3	-72.2	165.6	62.5	-160.7	0	111.1	A264 E265 I266 M270 A271 T272	A264-K268 PolarHBondContact O-N 2.94Å; E265-K268 VanDerWaalsContact CD-NZ 3.31Å; E265-K268 WeakPolarHBondContact O-CB 3.2Å; E265-K268 PolarHBondContact O-N 2.93Å; E265-K268 IonicContact OE1-NZ 3.63Å; E265-K268 PolarHBondContact OE1-NZ 3.16Å; E265-K268 VanDerWaalsContact OE1-NZ 3.09Å; E265-K268 WeakPolarHBondContact OE2-CE 3.12Å; E265-K268 IonicContact OE2-NZ 3.61Å; E265-K268 PolarHBondContact OE2-NZ 3.22Å; I266-K268 VanDerWaalsContact C-N 3.27Å; I266-K268 PolarHBondContact O-N 3.48Å; K268-M270 PolarHBondContact O-N 2.87Å; K268-A271 PolarHBondContact O-N 2.86Å; K268-T272 PolarHBondContact O-N 2.88Å; K268-T272 PolarHBondContact O-OG1 2.99Å
269	M	98.1	Very high	84.8	Confident	41 Å²	41	76.3 Å²	76.3	20%	0.202	40%	0.403	C	S	.	.	H	α-helix	trans	-60.5	-44.6	175.7	-64.8	173.3	71.9	0	0	111.5	Y216 M219 I220 T227 L231 E265 I266 A271 T272 Y273	Y216-M269 HydrophobicContact CD2-SD 4.11Å; Y216-M269 HydrophobicContact CE2-SD 3.71Å; M219-M269 HydrophobicContact CB-CE 4Å; I220-M269 HydrophobicContact CG2-SD 4.33Å; T227-M269 HydrophobicContact CG2-CE 3.55Å; L231-M269 HydrophobicContact CD1-CB 4.17Å; L231-M269 HydrophobicContact CD1-CE 4.26Å; L231-M269 HydrophobicContact CD2-CB 3.84Å; E265-M269 WeakPolarHBondContact O-CG 3.42Å; E265-M269 PolarHBondContact O-N 2.95Å; I266-M269 WeakPolarHBondContact O-CB 3.19Å; I266-M269 PolarHBondContact O-N 2.95Å; I266-M269 VanDerWaalsContact O-N 3.09Å; M269-A271 PolarHBondContact O-N 2.94Å; M269-T272 PolarHBondContact O-N 2.87Å; M269-T272 VanDerWaalsContact O-N 3.1Å; M269-T272 PolarHBondContact O-OG1 2.9Å; M269-Y273 WeakPolarHBondContact O-CD1 3.04Å; M269-Y273 PolarHBondContact O-N 3.23Å
270	M	96.8	Very high	81.8	Confident	11 Å²	11	86.2 Å²	86.2	5%	0.054	46%	0.464	C	S	.	.	H	α-helix	trans	-58.4	-30.9	177.4	-69.6	-68.9	-74	0	0	113.1	L231 L234 Q235 L240 Y241 I266 K268 Y273	L231-M270 HydrophobicContact CB-SD 3.79Å; L231-M270 HydrophobicContact CD2-CG 3.97Å; L231-M270 HydrophobicContact CD2-SD 3.61Å; L231-M270 HydrophobicContact CG-SD 4.29Å; L231-M270 VanDerWaalsContact O-SD 3.39Å; L234-M270 HydrophobicContact CB-CE 4.08Å; L234-M270 HydrophobicContact CB-SD 4.33Å; Q235-M270 HydrophobicContact CG-CE 3.69Å; L240-M270 HydrophobicContact CD2-CE 4.47Å; L240-M270 HydrophobicContact CD2-CG 3.74Å; Y241-M270 HydrophobicContact CE2-CE 4.04Å; Y241-M270 VanDerWaalsContact OH-CE 3.3Å; Y241-M270 WeakPolarHBondContact OH-CE 3.33Å; I266-M270 HydrophobicContact CG2-CG 4.02Å; I266-M270 VanDerWaalsContact O-CG 3.23Å; I266-M270 WeakPolarHBondContact O-CG 3.22Å; I266-M270 PolarHBondContact O-N 2.99Å; K268-M270 PolarHBondContact O-N 2.87Å; M270-Y273 WeakPolarHBondContact O-CD1 3.42Å; M270-Y273 HydrophobicContact SD-CE1 4.01Å
271	A	95.3	Very high	81	Confident	87 Å²	87	90.1 Å²	90.1	72%	0.719	48%	0.482	S	S	*	.	H	α-helix	trans	-84.8	-15.6	179.8	0	0	0	0	0	113.9	K267 K268 M269	K267-A271 PolarHBondContact O-N 2.84Å; K268-A271 PolarHBondContact O-N 2.86Å; M269-A271 PolarHBondContact O-N 2.94Å
272	T	93.2	Very high	80	Confident	108 Å²	108	87.9 Å²	87.9	66%	0.663	48%	0.477	S	S	*	.	H	α-helix	trans	-117.7	-22.2	-173.2	59.5	0	0	0	0	114.2	K268 M269	K268-T272 PolarHBondContact O-N 2.88Å; K268-T272 PolarHBondContact O-OG1 2.99Å; M269-T272 PolarHBondContact O-N 2.87Å; M269-T272 VanDerWaalsContact O-N 3.1Å; M269-T272 PolarHBondContact O-OG1 2.9Å
273	Y	89.9	Confident	79	Confident	44 Å²	44	92.6 Å²	92.6	17%	0.173	50%	0.502	C	S	.	.			trans	-67.4	139.5	178.1	91	-79	0	0	0	110.2	L231 Q235 M269 M270 E275	L231-Y273 HydrophobicContact CB-CD1 4.41Å; L231-Y273 HydrophobicContact CB-CE1 4.17Å; L231-Y273 HydrophobicContact CB-CE2 4.45Å; L231-Y273 HydrophobicContact CD1-CD1 3.99Å; L231-Y273 HydrophobicContact CD1-CD2 4.3Å; L231-Y273 HydrophobicContact CD1-CG 3.81Å; Q235-Y273 VanDerWaalsContact CG-OH 3.25Å; Q235-Y273 WeakPolarHBondContact CG-OH 3.14Å; Q235-Y273 VanDerWaalsContact NE2-CE1 3.34Å; Q235-Y273 PolarHBondContact NE2-OH 3.12Å; M269-Y273 WeakPolarHBondContact O-CD1 3.04Å; M269-Y273 PolarHBondContact O-N 3.23Å; M270-Y273 WeakPolarHBondContact O-CD1 3.42Å; M270-Y273 HydrophobicContact SD-CE1 4.01Å; Y273-E275 HydrophobicContact CE2-CB 4.35Å
274	K	78.8	Confident	77.8	Confident	177 Å²	177	97.9 Å²	97.9	77%	0.77	53%	0.531	S	S	*	.			trans	-98.6	112.4	177.7	-65.9	179.7	-178.1	177.8	0	107	K276	K274-K276 PolarHBondContact O-N 3.43Å; K274-K276 VanDerWaalsContact O-N 3.14Å
275	E	65.9	Low	76.5	Confident	141 Å²	141	101.2 Å²	101.2	66%	0.659	54%	0.541	S	S	*	.			trans	-59.1	119.5	169	-169.6	174.3	-162.8	0	0	108.1	Y273 K277	Y273-E275 HydrophobicContact CE2-CB 4.35Å; E275-K277 VanDerWaalsContact C-N 3.31Å; E275-K277 PolarHBondContact O-N 3.23Å
276	K	55.9	Low	75	Confident	172 Å²	172	104.7 Å²	104.7	75%	0.748	56%	0.562	S	S	*	*			trans	-61	104.8	159.5	-86.2	-178.9	177.5	174.3	0	105.2	K274 A278	K274-K276 PolarHBondContact O-N 3.43Å; K274-K276 VanDerWaalsContact O-N 3.14Å; K276-A278 PolarHBondContact O-N 3.27Å
277	K	43.4	Very low	73.3	Confident	194 Å²	194	112.1 Å²	112.1	84%	0.843	60%	0.602	S	S	*	*			trans	-45.1	112.9	168.5	-84.6	-172.8	175.1	-176.8	0	106.3	E275 S279	E275-K277 VanDerWaalsContact C-N 3.31Å; E275-K277 PolarHBondContact O-N 3.23Å; K277-S279 PolarHBondContact O-N 3.06Å
278	A	43	Very low	71.4	Confident	86 Å²	86	116 Å²	116	71%	0.711	63%	0.628	S	S	*	*			trans	-53.6	112.3	168.6	0	0	0	0	0	105.4	K276 V280	K276-A278 PolarHBondContact O-N 3.27Å; A278-V280 PolarHBondContact O-N 3.15Å
279	S	33.7	Very low	69.2	Low	119 Å²	119	115.8 Å²	115.8	83%	0.832	64%	0.637	S	S	*	*			trans	-59.5	104.9	171.4	41.6	0	0	0	0	106.2	K277	K277-S279 PolarHBondContact O-N 3.06Å
280	V	36	Very low	66.5	Low	210 Å²	210	122.6 Å²	122.6	100%	1.273	68%	0.677	S	S	*	*			trans	-62.5	0	166.1	-179.4	0	0	0	0	108.5	A278	A278-V280 PolarHBondContact O-N 3.15Å

Retrieved 280 of 280 residues in 49.2 ms (Link to these results)

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