A0A096N535_PAPAN Loading...

Clavesin-1

Required for normal morphology of late endosomes and/or lysosomes in neurons. Binds phosphatidylinositol 3,5-bisphosphate (PtdIns(3,5)P2).

AlphaFold DB (A0A2K5V9P6), UniProt , Accession A0A096N535, Species PAPAN (Papio anubis, Olive baboon), Gene CLVS1, Length 354 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.6	Very low	37.1	Very low	250 Å²	250	148.8 Å²	148.8	100%	1.232	81%	0.805	S	S	*	*				0	114.4	0	-67.7	-175.2	-170.6	0	0	106.8
2	G	30.7	Very low	37.5	Very low	65 Å²	65	153 Å²	153	67%	0.67	81%	0.81	S	S	*	*			trans	-76	162.4	-170.8	0	0	0	0	0	113.4
3	P	31.3	Very low	37.9	Very low	132 Å²	132	152.8 Å²	152.8	86%	0.857	81%	0.808	S	S	*	*			trans	-73.9	129	-179.8	30.1	-31.7	0	0	0	110.6	S5	P3-S5 PolarHBondContact O-N 3.1Å
4	V	32.5	Very low	38.1	Very low	133 Å²	133	148.9 Å²	148.9	81%	0.806	80%	0.8	S	S	*	*			trans	-73.8	104.7	170.6	176.7	0	0	0	0	107.6	L6	V4-L6 PolarHBondContact O-N 3.43Å
5	S	30.5	Very low	38.3	Very low	92 Å²	92	147.5 Å²	147.5	64%	0.643	80%	0.799	S	S	*	*			trans	-73.7	110.7	171.7	70.8	0	0	0	0	109.7	P3 L7	P3-S5 PolarHBondContact O-N 3.1Å; S5-L7 VanDerWaalsContact C-N 3.34Å; S5-L7 PolarHBondContact O-N 2.69Å
6	L	37.9	Very low	38.5	Very low	169 Å²	169	149.4 Å²	149.4	89%	0.885	79%	0.791	S	S	*	*			trans	-85.5	83.6	160.2	-72.3	169.2	0	0	0	107.7	V4	V4-L6 PolarHBondContact O-N 3.43Å
7	L	38.1	Very low	38.6	Very low	137 Å²	137	150.5 Å²	150.5	72%	0.717	80%	0.797	S	S	*	*			trans	-71.1	143.8	168.3	-79.7	163.5	0	0	0	109.8	S5	S5-L7 VanDerWaalsContact C-N 3.34Å; S5-L7 PolarHBondContact O-N 2.69Å
8	P	42	Very low	39	Very low	95 Å²	95	144.4 Å²	144.4	62%	0.617	78%	0.777	S	S	*	*			trans	-65.9	136.8	175.2	-11.6	25.7	0	0	0	110.4	Y10	P8-Y10 PolarHBondContact O-N 2.79Å
9	K	38.9	Very low	39.5	Very low	203 Å²	203	142.2 Å²	142.2	88%	0.883	77%	0.765	S	S	*	*	S	Bend	trans	-64.3	11.8	173.4	-85.4	-174.2	174.8	-178.9	0	114.9
10	Y	42.7	Very low	39.9	Very low	185 Å²	185	142.4 Å²	142.4	73%	0.725	77%	0.765	S	S	*	*			trans	-125.3	60.3	-173.4	-62.4	-78.8	0	0	0	111.3	P8	P8-Y10 PolarHBondContact O-N 2.79Å
11	Q	42	Very low	40.2	Very low	176 Å²	176	140.6 Å²	140.6	82%	0.822	77%	0.77	S	S	*	*	S	Bend	trans	-151.8	76.7	165.3	-112.8	172.2	14.5	0	0	110.6
12	K	41.5	Very low	40.9	Very low	199 Å²	199	133.6 Å²	133.6	87%	0.865	73%	0.732	S	S	*	*			trans	166.8	99.5	144.8	-97.6	176.5	-179.7	-179.7	0	107.8
13	L	42.4	Very low	42.3	Very low	150 Å²	150	134.3 Å²	134.3	79%	0.785	72%	0.719	S	S	*	*			trans	-132	97.5	157.9	-75.8	173.2	0	0	0	108.4
14	S	40.7	Very low	44.2	Very low	99 Å²	99	129.5 Å²	129.5	69%	0.692	69%	0.687	S	S	*	*			trans	-61.4	123.7	160.8	46.7	0	0	0	0	109.8
15	T	42.4	Very low	46.5	Very low	127 Å²	127	129.6 Å²	129.6	78%	0.779	68%	0.679	S	S	*	*			trans	38.9	79.1	154.2	59.7	0	0	0	0	116.4
16	W	41.4	Very low	48.8	Very low	178 Å²	178	126 Å²	126	67%	0.674	65%	0.652	S	S	*	*			trans	-82.6	110.1	153.3	-104.5	78.5	0	0	0	108.2
17	N	39.8	Very low	51	Low	168 Å²	168	118.1 Å²	118.1	90%	0.898	61%	0.611	S	S	*	*			trans	-116.9	22.4	-178.2	-114.9	8	0	0	0	112.3
18	G	46.2	Very low	53.3	Low	42 Å²	42	114.7 Å²	114.7	43%	0.433	60%	0.602	S	S	.	*	S	Bend	trans	-118.9	139.6	175.3	0	0	0	0	0	111.2
19	D	47.7	Very low	55.4	Low	102 Å²	102	113.4 Å²	113.4	55%	0.545	61%	0.606	S	S	.	*			trans	90.2	21.2	162.2	-56.1	-28.1	0	0	0	121.2	A21	D19-A21 PolarHBondContact O-N 3.43Å
20	L	47.1	Very low	58	Low	146 Å²	146	104.4 Å²	104.4	76%	0.764	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-65.8	-17.9	158.8	-96.9	132.3	0	0	0	112.9	M23	L20-M23 HydrophobicContact CD2-SD 4.37Å
21	A	47.3	Very low	60.4	Low	105 Å²	105	97.2 Å²	97.2	87%	0.868	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-82.8	-4.6	-177.6	0	0	0	0	0	115	D19	D19-A21 PolarHBondContact O-N 3.43Å
22	K	55.9	Low	62.9	Low	102 Å²	102	92.9 Å²	92.9	44%	0.443	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-110	7.3	-177.4	-74.7	-170.7	170.9	-160.7	0	114.6	T24 D47	K22-T24 PolarHBondContact O-N 3.08Å; K22-T24 VanDerWaalsContact O-N 3.13Å; K22-D47 IonicContact NZ-OD1 3.83Å; K22-D47 PolarHBondContact NZ-OD1 3.08Å; K22-D47 IonicContact NZ-OD2 3.21Å; K22-D47 PolarHBondContact NZ-OD2 3.4Å; K22-D47 VanDerWaalsContact NZ-OD2 3.17Å
23	M	59.5	Low	65.5	Low	81 Å²	81	90 Å²	90	40%	0.399	52%	0.521	S	S	.	.			trans	-65.1	115.6	178	-79.4	171.5	161.8	0	0	110.6	L20 I35	L20-M23 HydrophobicContact CD2-SD 4.37Å; M23-I35 HydrophobicContact CE-CD1 3.11Å; M23-I35 HydrophobicContact CG-CD1 4.39Å; M23-I35 HydrophobicContact SD-CD1 4.5Å
24	T	71.1	Confident	68	Low	30 Å²	30	83.2 Å²	83.2	18%	0.184	49%	0.486	C	S	.	.			trans	-73	156.6	169.5	65.3	0	0	0	0	109.8	K22 L26 Q27 A28	K22-T24 PolarHBondContact O-N 3.08Å; K22-T24 VanDerWaalsContact O-N 3.13Å; T24-L26 PolarHBondContact O-N 2.61Å; T24-Q27 PolarHBondContact O-N 3.47Å; T24-A28 PolarHBondContact O-N 3.06Å
25	H	81.4	Confident	70.7	Confident	135 Å²	135	80.2 Å²	80.2	63%	0.625	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-57.8	-22	174	72.3	-81.7	0	0	0	112.9	Q27 A28 H50	H25-Q27 PolarHBondContact O-N 3.02Å; H25-A28 VanDerWaalsContact O-CB 3.23Å; H25-A28 WeakPolarHBondContact O-CB 3.48Å; H25-A28 PolarHBondContact O-N 3.28Å; H25-H50 AromaticContact CE1-CE1 3.93Å
26	L	79.9	Confident	73.2	Confident	16 Å²	16	76.9 Å²	76.9	8%	0.084	44%	0.437	C	S	.	.	G	3₁₀ helix	trans	-74.2	-12.4	176.4	-63	174.7	0	0	0	113.7	T24 L49 I53 D73 L77	T24-L26 PolarHBondContact O-N 2.61Å; L26-L49 HydrophobicContact CB-CD2 3.81Å; L26-L49 HydrophobicContact CD1-CD2 3.93Å; L26-L49 HydrophobicContact CD1-CG 4.18Å; L26-I53 HydrophobicContact CD1-CD1 3.62Å; L26-D73 HydrophobicContact CD1-CB 4.21Å; L26-D73 HydrophobicContact CD2-CB 3.72Å; L26-L77 HydrophobicContact CB-CD2 4.06Å
27	Q	83.4	Confident	75.8	Confident	5 Å²	5	70.2 Å²	70.2	2%	0.023	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-108.6	4.2	174.4	-63.8	178.5	-55.5	0	0	112	T24 H25 G29 L30 E44 L49	T24-Q27 PolarHBondContact O-N 3.47Å; H25-Q27 PolarHBondContact O-N 3.02Å; Q27-G29 PolarHBondContact O-N 3.17Å; Q27-L30 HydrophobicContact CB-CD1 4.24Å; Q27-L30 HydrophobicContact CG-CD1 4.46Å; Q27-L30 PolarHBondContact O-N 3.11Å; Q27-E44 PolarHBondContact NE2-OE1 3.45Å; Q27-L49 HydrophobicContact CG-CD2 4.28Å
28	A	85.3	Confident	78.6	Confident	64 Å²	64	62.3 Å²	62.3	53%	0.529	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	134.4	174.1	0	0	0	0	0	110.4	T24 H25	T24-A28 PolarHBondContact O-N 3.06Å; H25-A28 VanDerWaalsContact O-CB 3.23Å; H25-A28 WeakPolarHBondContact O-CB 3.48Å; H25-A28 PolarHBondContact O-N 3.28Å
29	G	85.8	Confident	81	Confident	68 Å²	68	65.8 Å²	65.8	70%	0.701	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.7	-1.6	-179.3	0	0	0	0	0	115.5	Q27	Q27-G29 PolarHBondContact O-N 3.17Å
30	L	94.3	Very high	83.4	Confident	14 Å²	14	65.6 Å²	65.6	7%	0.073	37%	0.37	C	S	.	.			trans	-86.7	139.5	171.6	-62.4	-179.4	0	0	0	112.1	Q27 T34 I35 P173 E174 I177	Q27-L30 HydrophobicContact CB-CD1 4.24Å; Q27-L30 HydrophobicContact CG-CD1 4.46Å; Q27-L30 PolarHBondContact O-N 3.11Å; L30-T34 HydrophobicContact CD2-CG2 3.87Å; L30-I35 HydrophobicContact CB-CD1 4.03Å; L30-I35 HydrophobicContact CB-CG1 3.66Å; L30-I35 HydrophobicContact CD1-CG1 3.95Å; L30-I35 HydrophobicContact CG-CG1 4.48Å; L30-P173 VanDerWaalsContact CD2-C 3.49Å; L30-P173 HydrophobicContact CD2-CB 3.53Å; L30-P173 HydrophobicContact CG-CB 4.13Å; L30-E174 WeakPolarHBondContact CA-OE1 3.49Å; L30-E174 HydrophobicContact CD2-CG 4.26Å; L30-I177 HydrophobicContact CD1-CD1 3.58Å; L30-I177 HydrophobicContact CD2-CD1 3.62Å; L30-I177 HydrophobicContact CG-CD1 4.26Å
31	S	94.3	Very high	85.7	Confident	35 Å²	35	62 Å²	62	25%	0.245	35%	0.349	C	S	.	.			trans	-71.9	156.7	168.8	95.6	0	0	0	0	111.2	E33 T34 I35 E174	S31-E33 VanDerWaalsContact CB-OE2 3.3Å; S31-E33 WeakPolarHBondContact CB-OE2 3.2Å; S31-E33 PolarHBondContact O-N 3.05Å; S31-E33 PolarHBondContact OG-N 3.31Å; S31-E33 PolarHBondContact OG-OE2 3.39Å; S31-T34 PolarHBondContact O-N 3.27Å; S31-T34 VanDerWaalsContact O-N 3.11Å; S31-T34 PolarHBondContact OG-N 2.74Å; S31-I35 WeakPolarHBondContact O-CG1 3.32Å; S31-I35 PolarHBondContact O-N 3.08Å; S31-E174 PolarHBondContact N-OE1 2.62Å
32	P	94.1	Very high	88.1	Confident	84 Å²	84	57 Å²	57	55%	0.545	31%	0.307	S	S	.	.	H	α-helix	trans	-54.7	-39.6	174.4	-26.2	35.9	0	0	0	113.2	I35 E36	P32-I35 PolarHBondContact O-N 3.02Å; P32-E36 PolarHBondContact O-N 3.35Å
33	E	95.1	Very high	90.1	Very high	138 Å²	138	56.6 Å²	56.6	65%	0.645	31%	0.31	S	S	*	.	H	α-helix	trans	-64.3	-41.7	177.7	-57.7	74.2	-160.7	0	0	111.3	S31 E36 K37	S31-E33 VanDerWaalsContact CB-OE2 3.3Å; S31-E33 WeakPolarHBondContact CB-OE2 3.2Å; S31-E33 PolarHBondContact O-N 3.05Å; S31-E33 PolarHBondContact OG-N 3.31Å; S31-E33 PolarHBondContact OG-OE2 3.39Å; E33-E36 PolarHBondContact O-N 3.36Å; E33-K37 WeakPolarHBondContact O-CB 3.24Å; E33-K37 PolarHBondContact O-N 2.97Å
34	T	96.2	Very high	91.9	Very high	9 Å²	9	52.8 Å²	52.8	6%	0.055	29%	0.291	C	S	.	.	H	α-helix	trans	-71.7	-34.1	179.6	-65.7	0	0	0	0	112.1	L30 S31 K37 A38 E174 I177	L30-T34 HydrophobicContact CD2-CG2 3.87Å; S31-T34 PolarHBondContact O-N 3.27Å; S31-T34 VanDerWaalsContact O-N 3.11Å; S31-T34 PolarHBondContact OG-N 2.74Å; T34-K37 PolarHBondContact O-N 2.84Å; T34-A38 WeakPolarHBondContact O-CB 3.36Å; T34-A38 PolarHBondContact O-N 3.48Å; T34-E174 VanDerWaalsContact CB-OE1 3.25Å; T34-E174 WeakPolarHBondContact CB-OE1 3.32Å; T34-E174 WeakPolarHBondContact CB-OE2 3.4Å; T34-E174 WeakPolarHBondContact CG2-OE2 3.42Å; T34-E174 VanDerWaalsContact OG1-CD 3.26Å; T34-E174 PolarHBondContact OG1-OE1 2.94Å; T34-E174 PolarHBondContact OG1-OE2 3.42Å; T34-I177 HydrophobicContact CG2-CB 3.87Å; T34-I177 HydrophobicContact CG2-CD1 3.55Å; T34-I177 HydrophobicContact CG2-CG1 4.32Å; T34-I177 HydrophobicContact CG2-CG2 3.82Å
35	I	95.6	Very high	93	Very high	35 Å²	35	54.5 Å²	54.5	18%	0.179	30%	0.299	C	S	.	.	H	α-helix	trans	-62.7	-47.9	171.8	-71.6	170	0	0	0	110.6	M23 L30 S31 P32 K37 A38 R39	M23-I35 HydrophobicContact CE-CD1 3.11Å; M23-I35 HydrophobicContact CG-CD1 4.39Å; M23-I35 HydrophobicContact SD-CD1 4.5Å; L30-I35 HydrophobicContact CB-CD1 4.03Å; L30-I35 HydrophobicContact CB-CG1 3.66Å; L30-I35 HydrophobicContact CD1-CG1 3.95Å; L30-I35 HydrophobicContact CG-CG1 4.48Å; S31-I35 WeakPolarHBondContact O-CG1 3.32Å; S31-I35 PolarHBondContact O-N 3.08Å; P32-I35 PolarHBondContact O-N 3.02Å; I35-K37 VanDerWaalsContact C-N 3.28Å; I35-K37 PolarHBondContact O-N 3.48Å; I35-A38 WeakPolarHBondContact O-CB 3.22Å; I35-A38 PolarHBondContact O-N 3.14Å; I35-A38 VanDerWaalsContact O-N 3.14Å; I35-R39 PolarHBondContact O-N 3.41Å
36	E	95.7	Very high	93.4	Very high	58 Å²	58	49.9 Å²	49.9	27%	0.271	28%	0.281	S	S	.	.	H	α-helix	trans	-63.9	-38.3	178.9	179.6	58.9	-175.5	0	0	111.3	P32 E33 R39 L40	P32-E36 PolarHBondContact O-N 3.35Å; E33-E36 PolarHBondContact O-N 3.36Å; E36-R39 PolarHBondContact O-N 3.36Å; E36-R39 IonicContact OE1-CZ 3.73Å; E36-R39 IonicContact OE1-NE 3.45Å; E36-R39 IonicContact OE1-NH2 3.38Å; E36-R39 PolarHBondContact OE1-NH2 3.25Å; E36-R39 IonicContact OE2-CZ 3.77Å; E36-R39 IonicContact OE2-NE 2.61Å; E36-R39 PolarHBondContact OE2-NE 2.87Å; E36-R39 IonicContact OE2-NH2 3.41Å; E36-R39 PolarHBondContact OE2-NH2 3.24Å; E36-L40 HydrophobicContact CG-CD1 3.95Å; E36-L40 HydrophobicContact CG-CG 4.46Å; E36-L40 WeakPolarHBondContact O-CB 3.12Å; E36-L40 WeakPolarHBondContact O-CG 3.45Å; E36-L40 PolarHBondContact O-N 3.45Å; E36-L40 WeakPolarHBondContact OE1-CD1 3.42Å
37	K	96.9	Very high	93.9	Very high	38 Å²	38	54.1 Å²	54.1	17%	0.165	30%	0.304	C	S	.	.	H	α-helix	trans	-61.5	-43.3	172.1	-174.7	177.5	-179.7	177.8	0	112.4	E33 T34 I35 R39 L40 E41 Y136 I177 N178	E33-K37 WeakPolarHBondContact O-CB 3.24Å; E33-K37 PolarHBondContact O-N 2.97Å; T34-K37 PolarHBondContact O-N 2.84Å; I35-K37 VanDerWaalsContact C-N 3.28Å; I35-K37 PolarHBondContact O-N 3.48Å; K37-R39 VanDerWaalsContact C-N 3.34Å; K37-L40 PolarHBondContact O-N 3.4Å; K37-E41 VanDerWaalsContact CE-OE1 3.3Å; K37-E41 WeakPolarHBondContact CE-OE1 3.49Å; K37-E41 HydrophobicContact CG-CG 4.11Å; K37-E41 VanDerWaalsContact O-CB 3.31Å; K37-E41 WeakPolarHBondContact O-CB 3.37Å; K37-E41 PolarHBondContact O-N 2.93Å; K37-Y136 PolarHBondContact NZ-O 3.3Å; K37-I177 HydrophobicContact CD-CG2 4.29Å; K37-I177 HydrophobicContact CG-CG2 4.28Å; K37-N178 WeakPolarHBondContact CD-OD1 3.41Å; K37-N178 WeakPolarHBondContact CE-OD1 3.21Å; K37-N178 PolarHBondContact NZ-OD1 2.88Å
38	A	97.4	Very high	94.4	Very high	1 Å²	1	56 Å²	56	1%	0.008	32%	0.316	C	S	.	.	H	α-helix	trans	-62.2	-43.3	176.8	0	0	0	0	0	111.5	T34 I35 L42 N43 E44 I177	T34-A38 WeakPolarHBondContact O-CB 3.36Å; T34-A38 PolarHBondContact O-N 3.48Å; I35-A38 WeakPolarHBondContact O-CB 3.22Å; I35-A38 PolarHBondContact O-N 3.14Å; I35-A38 VanDerWaalsContact O-N 3.14Å; A38-L42 HydrophobicContact CB-CD1 4.3Å; A38-L42 CarbonylContact O-C 3.58Å; A38-L42 VanDerWaalsContact O-CA 3.31Å; A38-L42 WeakPolarHBondContact O-CA 3.39Å; A38-L42 WeakPolarHBondContact O-CB 3.35Å; A38-L42 PolarHBondContact O-N 2.72Å; A38-N43 PolarHBondContact O-N 3.27Å; A38-E44 HydrophobicContact CB-CB 3.93Å; A38-E44 PolarHBondContact O-N 2.9Å; A38-I177 HydrophobicContact CB-CD1 3.78Å; A38-I177 HydrophobicContact CB-CG1 4.06Å; A38-I177 HydrophobicContact CB-CG2 4.16Å
39	R	96.9	Very high	94.9	Very high	115 Å²	115	53 Å²	53	43%	0.434	29%	0.291	S	S	.	.	H	α-helix	trans	-59.8	-48	175.8	-166.9	-169.6	68.6	76.8	-2.6	111.6	I35 E36 K37 N43	I35-R39 PolarHBondContact O-N 3.41Å; E36-R39 PolarHBondContact O-N 3.36Å; E36-R39 IonicContact OE1-CZ 3.73Å; E36-R39 IonicContact OE1-NE 3.45Å; E36-R39 IonicContact OE1-NH2 3.38Å; E36-R39 PolarHBondContact OE1-NH2 3.25Å; E36-R39 IonicContact OE2-CZ 3.77Å; E36-R39 IonicContact OE2-NE 2.61Å; E36-R39 PolarHBondContact OE2-NE 2.87Å; E36-R39 IonicContact OE2-NH2 3.41Å; E36-R39 PolarHBondContact OE2-NH2 3.24Å; K37-R39 VanDerWaalsContact C-N 3.34Å; R39-N43 WeakPolarHBondContact O-CA 3.47Å; R39-N43 PolarHBondContact O-N 3.14Å
40	L	97.4	Very high	95.3	Very high	99 Å²	99	54.1 Å²	54.1	52%	0.518	28%	0.278	S	S	.	.	H	α-helix	trans	-76	-41.6	-175.5	-71.7	175.1	0	0	0	114.1	E36 K37	E36-L40 HydrophobicContact CG-CD1 3.95Å; E36-L40 HydrophobicContact CG-CG 4.46Å; E36-L40 WeakPolarHBondContact O-CB 3.12Å; E36-L40 WeakPolarHBondContact O-CG 3.45Å; E36-L40 PolarHBondContact O-N 3.45Å; E36-L40 WeakPolarHBondContact OE1-CD1 3.42Å; K37-L40 PolarHBondContact O-N 3.4Å
41	E	96.8	Very high	95.5	Very high	69 Å²	69	59.4 Å²	59.4	32%	0.322	30%	0.302	S	S	.	.	H	α-helix	trans	-96.8	-27.3	-172.6	-65.9	-171.8	-166.2	0	0	114.1	K37 R216	K37-E41 VanDerWaalsContact CE-OE1 3.3Å; K37-E41 WeakPolarHBondContact CE-OE1 3.49Å; K37-E41 HydrophobicContact CG-CG 4.11Å; K37-E41 VanDerWaalsContact O-CB 3.31Å; K37-E41 WeakPolarHBondContact O-CB 3.37Å; K37-E41 PolarHBondContact O-N 2.93Å; E41-R216 IonicContact OE2-NH2 3.96Å; E41-R216 PolarHBondContact OE2-NH2 3.33Å; E41-R216 VanDerWaalsContact OE2-NH2 3.12Å
42	L	97.4	Very high	95.6	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-113.9	-7.5	-173	-45.6	-177	0	0	0	112.9	A38 E44 R81 K84 F85 I177	A38-L42 HydrophobicContact CB-CD1 4.3Å; A38-L42 CarbonylContact O-C 3.58Å; A38-L42 VanDerWaalsContact O-CA 3.31Å; A38-L42 WeakPolarHBondContact O-CA 3.39Å; A38-L42 WeakPolarHBondContact O-CB 3.35Å; A38-L42 PolarHBondContact O-N 2.72Å; L42-E44 PolarHBondContact O-N 3.21Å; L42-R81 HydrophobicContact CD1-CB 4.11Å; L42-R81 HydrophobicContact CD1-CG 4.22Å; L42-K84 HydrophobicContact CD2-CG 4.17Å; L42-K84 CarbonylContact O-C 3.52Å; L42-K84 WeakPolarHBondContact O-CA 3.25Å; L42-F85 HydrophobicContact CB-CD2 4.3Å; L42-F85 HydrophobicContact CB-CE2 4.49Å; L42-F85 VanDerWaalsContact O-CD2 3.25Å; L42-F85 WeakPolarHBondContact O-CD2 3.16Å; L42-I177 HydrophobicContact CD1-CB 4.31Å; L42-I177 HydrophobicContact CD1-CG1 3.95Å; L42-I177 HydrophobicContact CD1-CG2 4.11Å
43	N	97.7	Very high	95.8	Very high	94 Å²	94	54.3 Å²	54.3	50%	0.503	27%	0.268	S	S	.	.			trans	60.8	28	-172.9	-43.2	-60	0	0	0	113.1	A38 R39 N45 K84	A38-N43 PolarHBondContact O-N 3.27Å; R39-N43 WeakPolarHBondContact O-CA 3.47Å; R39-N43 PolarHBondContact O-N 3.14Å; N43-N45 PolarHBondContact O-N 3.33Å; N43-K84 PolarHBondContact ND2-O 3.45Å
44	E	96.6	Very high	96	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.009	25%	0.254	C	S	.	.			trans	-67	118.1	175.7	-175.6	160.8	152.6	0	0	109.5	Q27 A38 L42 R81 F85	Q27-E44 PolarHBondContact NE2-OE1 3.45Å; A38-E44 HydrophobicContact CB-CB 3.93Å; A38-E44 PolarHBondContact O-N 2.9Å; L42-E44 PolarHBondContact O-N 3.21Å; E44-R81 IonicContact OE1-CZ 3.8Å; E44-R81 IonicContact OE1-NE 3.22Å; E44-R81 IonicContact OE1-NH2 3.62Å; E44-R81 PolarHBondContact OE1-NH2 3.38Å; E44-R81 IonicContact OE2-CZ 2.6Å; E44-R81 IonicContact OE2-NE 2.74Å; E44-R81 PolarHBondContact OE2-NE 3.1Å; E44-R81 IonicContact OE2-NH2 3.58Å; E44-R81 PolarHBondContact OE2-NH2 2.74Å; E44-F85 HydrophobicContact CB-CD2 4.09Å; E44-F85 HydrophobicContact CB-CE1 4.46Å; E44-F85 HydrophobicContact CB-CE2 3.43Å; E44-F85 VanDerWaalsContact CB-CE2 3.43Å; E44-F85 HydrophobicContact CB-CZ 3.66Å; E44-F85 HydrophobicContact CG-CE1 4.16Å; E44-F85 HydrophobicContact CG-CE2 3.7Å; E44-F85 HydrophobicContact CG-CZ 3.38Å
45	N	94.3	Very high	96.1	Very high	66 Å²	66	55.3 Å²	55.3	35%	0.353	27%	0.271	S	S	.	.			trans	-116.6	112.7	177.4	179.3	-2.5	0	0	0	110	N43 D47 V48 L49	N43-N45 PolarHBondContact O-N 3.33Å; N45-D47 PolarHBondContact O-N 3.19Å; N45-D47 PolarHBondContact OD1-N 2.94Å; N45-V48 HydrophobicContact CB-CG2 3.73Å; N45-V48 PolarHBondContact O-N 3.11Å; N45-L49 PolarHBondContact O-N 3.45Å
46	P	90.3	Very high	96.2	Very high	38 Å²	38	53.6 Å²	53.6	25%	0.247	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-34.1	-179.9	-23.4	31.5	0	0	0	113.9	V48	P46-V48 VanDerWaalsContact C-N 3.28Å; P46-V48 PolarHBondContact O-N 2.83Å
47	D	91.2	Very high	96.3	Very high	105 Å²	105	53.7 Å²	53.7	56%	0.561	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-21.7	-173.4	-66.2	-34.7	0	0	0	112.6	K22 N45	K22-D47 IonicContact NZ-OD1 3.83Å; K22-D47 PolarHBondContact NZ-OD1 3.08Å; K22-D47 IonicContact NZ-OD2 3.21Å; K22-D47 PolarHBondContact NZ-OD2 3.4Å; K22-D47 VanDerWaalsContact NZ-OD2 3.17Å; N45-D47 PolarHBondContact O-N 3.19Å; N45-D47 PolarHBondContact OD1-N 2.94Å
48	V	94.4	Very high	96.4	Very high	45 Å²	45	56.1 Å²	56.1	27%	0.273	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.6	5	-179	-60.1	0	0	0	0	113.6	N45 P46 H50 Q51 D52	N45-V48 HydrophobicContact CB-CG2 3.73Å; N45-V48 PolarHBondContact O-N 3.11Å; P46-V48 VanDerWaalsContact C-N 3.28Å; P46-V48 PolarHBondContact O-N 2.83Å; V48-H50 VanDerWaalsContact C-N 3.32Å; V48-H50 PolarHBondContact O-N 2.9Å; V48-Q51 WeakPolarHBondContact O-CA 3.38Å; V48-Q51 WeakPolarHBondContact O-CB 3.37Å; V48-Q51 PolarHBondContact O-N 3.44Å; V48-D52 PolarHBondContact O-N 3.29Å
49	L	93.9	Very high	96.4	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-53.1	-45	-172.9	-174.8	59.1	0	0	0	113.5	L26 Q27 N45 Q51 D52 I53 L77 F85	L26-L49 HydrophobicContact CB-CD2 3.81Å; L26-L49 HydrophobicContact CD1-CD2 3.93Å; L26-L49 HydrophobicContact CD1-CG 4.18Å; Q27-L49 HydrophobicContact CG-CD2 4.28Å; N45-L49 PolarHBondContact O-N 3.45Å; L49-Q51 VanDerWaalsContact C-N 3.33Å; L49-Q51 PolarHBondContact O-N 3.38Å; L49-D52 PolarHBondContact O-N 3.42Å; L49-I53 HydrophobicContact CD1-CD1 4.48Å; L49-I53 HydrophobicContact CG-CD1 4.3Å; L49-I53 WeakPolarHBondContact O-CG1 3.49Å; L49-I53 PolarHBondContact O-N 3.35Å; L49-I53 VanDerWaalsContact O-N 3.1Å; L49-L77 HydrophobicContact CD1-CD1 3.7Å; L49-F85 HydrophobicContact CD1-CE1 3.53Å; L49-F85 HydrophobicContact CD1-CZ 3.84Å
50	H	95.5	Very high	96.4	Very high	92 Å²	92	54.2 Å²	54.2	43%	0.426	27%	0.272	S	S	.	.	H	α-helix	trans	-66.4	-33.8	177.5	-73.8	-68.1	0	0	0	112.8	H25 V48 Q54 D73	H25-H50 AromaticContact CE1-CE1 3.93Å; V48-H50 VanDerWaalsContact C-N 3.32Å; V48-H50 PolarHBondContact O-N 2.9Å; H50-Q54 WeakPolarHBondContact O-CB 3.32Å; H50-Q54 PolarHBondContact O-N 3.49Å; H50-D73 IonicContact CE1-OD2 3.07Å; H50-D73 IonicContact ND1-OD2 2.64Å; H50-D73 PolarHBondContact ND1-OD2 3.28Å
51	Q	97.2	Very high	96.4	Very high	124 Å²	124	56.6 Å²	56.6	58%	0.579	28%	0.284	S	S	*	.	H	α-helix	trans	-69.4	-40.6	176.9	-61.1	176	-2.9	0	0	110.8	V48 L49 Q54 Q55	V48-Q51 WeakPolarHBondContact O-CA 3.38Å; V48-Q51 WeakPolarHBondContact O-CB 3.37Å; V48-Q51 PolarHBondContact O-N 3.44Å; L49-Q51 VanDerWaalsContact C-N 3.33Å; L49-Q51 PolarHBondContact O-N 3.38Å; Q51-Q54 PolarHBondContact O-N 2.85Å; Q51-Q55 WeakPolarHBondContact O-CG 3.47Å; Q51-Q55 PolarHBondContact O-N 3.04Å
52	D	97.9	Very high	96.4	Very high	13 Å²	13	57.4 Å²	57.4	7%	0.07	29%	0.294	C	S	.	.	H	α-helix	trans	-63.1	-42.6	176.4	-72.2	-32.7	0	0	0	112.1	V48 L49 Q55 V56 L80 F85 Q87	V48-D52 PolarHBondContact O-N 3.29Å; L49-D52 PolarHBondContact O-N 3.42Å; D52-Q55 PolarHBondContact O-N 3.27Å; D52-V56 PolarHBondContact O-N 2.83Å; D52-L80 HydrophobicContact CB-CD1 4.12Å; D52-L80 HydrophobicContact CB-CD2 4.41Å; D52-F85 HydrophobicContact CB-CD1 4.25Å; D52-F85 WeakPolarHBondContact OD2-CD1 3.34Å; D52-Q87 PolarHBondContact OD1-NE2 3.24Å
53	I	98.3	Very high	96.4	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-62.4	-44.8	174.8	-69.4	168.5	0	0	0	110.5	L26 L49 Q55 V56 R57 D73 I76 L80	L26-I53 HydrophobicContact CD1-CD1 3.62Å; L49-I53 HydrophobicContact CD1-CD1 4.48Å; L49-I53 HydrophobicContact CG-CD1 4.3Å; L49-I53 WeakPolarHBondContact O-CG1 3.49Å; L49-I53 PolarHBondContact O-N 3.35Å; L49-I53 VanDerWaalsContact O-N 3.1Å; I53-Q55 PolarHBondContact O-N 3.12Å; I53-V56 PolarHBondContact O-N 2.67Å; I53-R57 PolarHBondContact O-N 3.14Å; I53-D73 HydrophobicContact CD1-CB 4.05Å; I53-D73 HydrophobicContact CG2-CB 4.31Å; I53-D73 WeakPolarHBondContact CG2-OD1 3.42Å; I53-I76 HydrophobicContact CB-CG2 4.43Å; I53-I76 HydrophobicContact CG1-CG2 4.39Å; I53-I76 HydrophobicContact CG2-CB 4.21Å; I53-I76 HydrophobicContact CG2-CD1 4.27Å; I53-I76 HydrophobicContact CG2-CG2 4.04Å; I53-L80 HydrophobicContact CB-CD1 4.43Å; I53-L80 HydrophobicContact CG1-CD1 3.62Å
54	Q	98.3	Very high	96.3	Very high	79 Å²	79	61.9 Å²	61.9	37%	0.369	32%	0.319	S	S	.	.	H	α-helix	trans	-63.8	-40.9	179.9	-172.1	59.5	30.4	0	0	112	H50 Q51 V56 R57 D58	H50-Q54 WeakPolarHBondContact O-CB 3.32Å; H50-Q54 PolarHBondContact O-N 3.49Å; Q51-Q54 PolarHBondContact O-N 2.85Å; Q54-V56 VanDerWaalsContact C-N 3.3Å; Q54-V56 PolarHBondContact O-N 2.98Å; Q54-R57 CarbonylContact O-C 3.5Å; Q54-R57 WeakPolarHBondContact O-CA 3.47Å; Q54-R57 WeakPolarHBondContact O-CB 3.43Å; Q54-R57 PolarHBondContact O-N 2.89Å; Q54-R57 VanDerWaalsContact O-N 3.08Å; Q54-D58 PolarHBondContact NE2-OD1 3.24Å; Q54-D58 VanDerWaalsContact O-CG 3.23Å; Q54-D58 PolarHBondContact O-N 2.98Å
55	Q	98.4	Very high	96.3	Very high	88 Å²	88	66.2 Å²	66.2	41%	0.411	34%	0.343	S	S	.	.	H	α-helix	trans	-58.8	-41.1	175.5	-76.1	177.1	71	0	0	112.4	Q51 D52 I53 R57 D58 M59 Q87	Q51-Q55 WeakPolarHBondContact O-CG 3.47Å; Q51-Q55 PolarHBondContact O-N 3.04Å; D52-Q55 PolarHBondContact O-N 3.27Å; I53-Q55 PolarHBondContact O-N 3.12Å; Q55-R57 VanDerWaalsContact C-N 3.34Å; Q55-D58 PolarHBondContact O-N 3.29Å; Q55-M59 WeakPolarHBondContact O-CE 3.46Å; Q55-M59 PolarHBondContact O-N 2.98Å; Q55-Q87 HydrophobicContact CB-CG 4.22Å
56	V	98.6	Very high	96.5	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-65.2	-40.9	175.1	175.7	0	0	0	0	111.3	D52 I53 Q54 M59 I76 L80 Q87 A90 F91 L94	D52-V56 PolarHBondContact O-N 2.83Å; I53-V56 PolarHBondContact O-N 2.67Å; Q54-V56 VanDerWaalsContact C-N 3.3Å; Q54-V56 PolarHBondContact O-N 2.98Å; V56-M59 HydrophobicContact CG2-CE 4.37Å; V56-M59 PolarHBondContact O-N 2.87Å; V56-I76 HydrophobicContact CB-CG2 3.85Å; V56-I76 HydrophobicContact CG1-CG2 3.78Å; V56-I76 HydrophobicContact CG2-CG2 4.46Å; V56-L80 HydrophobicContact CG2-CD2 3.74Å; V56-L80 HydrophobicContact CG2-CG 4.17Å; V56-Q87 HydrophobicContact CG2-CB 4.09Å; V56-A90 HydrophobicContact CG2-CB 4.11Å; V56-F91 HydrophobicContact CG1-CB 4.2Å; V56-L94 HydrophobicContact CG1-CD2 4.01Å
57	R	97.9	Very high	96.7	Very high	59 Å²	59	63.2 Å²	63.2	22%	0.223	33%	0.332	C	S	.	.	H	α-helix	trans	-63.4	-41.5	177.6	-175	177.5	-65.9	118.6	1.9	112.3	I53 Q54 Q55 M59 I60 T71 D73 I76	I53-R57 PolarHBondContact O-N 3.14Å; Q54-R57 CarbonylContact O-C 3.5Å; Q54-R57 WeakPolarHBondContact O-CA 3.47Å; Q54-R57 WeakPolarHBondContact O-CB 3.43Å; Q54-R57 PolarHBondContact O-N 2.89Å; Q54-R57 VanDerWaalsContact O-N 3.08Å; Q55-R57 VanDerWaalsContact C-N 3.34Å; R57-M59 PolarHBondContact O-N 3.34Å; R57-I60 HydrophobicContact CG-CD1 4.49Å; R57-I60 WeakPolarHBondContact O-CB 3.42Å; R57-I60 WeakPolarHBondContact O-CG1 3.26Å; R57-I60 PolarHBondContact O-N 3.26Å; R57-T71 PolarHBondContact NH2-O 3.26Å; R57-T71 VanDerWaalsContact NH2-O 3.12Å; R57-D73 IonicContact CZ-OD1 3.6Å; R57-D73 IonicContact NH1-OD1 3.59Å; R57-D73 IonicContact NH2-OD1 2.69Å; R57-D73 PolarHBondContact NH2-OD1 3.48Å; R57-I76 HydrophobicContact CB-CD1 4.1Å
58	D	98	Very high	97	Very high	90 Å²	90	60 Å²	60	48%	0.481	31%	0.313	S	S	.	.	H	α-helix	trans	-65.7	-24.5	179.7	-66.8	-20.2	0	0	0	112.3	Q54 Q55 I60 I61	Q54-D58 PolarHBondContact NE2-OD1 3.24Å; Q54-D58 VanDerWaalsContact O-CG 3.23Å; Q54-D58 PolarHBondContact O-N 2.98Å; Q55-D58 PolarHBondContact O-N 3.29Å; D58-I60 VanDerWaalsContact C-N 3.3Å; D58-I60 PolarHBondContact O-N 2.6Å; D58-I61 WeakPolarHBondContact O-CG1 3.18Å
59	M	98.4	Very high	97	Very high	48 Å²	48	65.4 Å²	65.4	24%	0.236	34%	0.339	C	S	.	.	H	α-helix	trans	-75.1	-17	174.4	-71.6	-175.5	-81.4	0	0	113.3	Q55 V56 R57 I61 T62 Q87 F91	Q55-M59 WeakPolarHBondContact O-CE 3.46Å; Q55-M59 PolarHBondContact O-N 2.98Å; V56-M59 HydrophobicContact CG2-CE 4.37Å; V56-M59 PolarHBondContact O-N 2.87Å; R57-M59 PolarHBondContact O-N 3.34Å; M59-I61 VanDerWaalsContact C-N 3.29Å; M59-I61 PolarHBondContact O-N 3.1Å; M59-T62 WeakPolarHBondContact O-CB 3.45Å; M59-T62 WeakPolarHBondContact O-CG2 3.31Å; M59-T62 PolarHBondContact O-N 3.37Å; M59-T62 PolarHBondContact O-OG1 3.46Å; M59-Q87 HydrophobicContact CE-CB 4.09Å; M59-Q87 WeakPolarHBondContact CE-O 3.11Å; M59-F91 HydrophobicContact CB-CB 4.25Å; M59-F91 HydrophobicContact CB-CD1 3.7Å; M59-F91 HydrophobicContact CB-CD2 3.69Å; M59-F91 HydrophobicContact CB-CE1 3.91Å; M59-F91 HydrophobicContact CB-CE2 3.93Å; M59-F91 HydrophobicContact CB-CG 3.58Å; M59-F91 HydrophobicContact CB-CZ 4.02Å; M59-F91 HydrophobicContact CE-CB 3.62Å; M59-F91 HydrophobicContact CE-CG 4.24Å; M59-F91 HydrophobicContact CG-CD1 4.42Å; M59-F91 HydrophobicContact CG-CG 4.45Å; M59-F91 WeakPolarHBondContact O-CE2 3.2Å; M59-F91 WeakPolarHBondContact O-CZ 3.17Å; M59-F91 HydrophobicContact SD-CB 4.02Å; M59-F91 HydrophobicContact SD-CD1 4Å; M59-F91 HydrophobicContact SD-CG 4.12Å
60	I	97.3	Very high	97.1	Very high	27 Å²	27	69.8 Å²	69.8	14%	0.138	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-59.1	-39.4	-177.6	-66.3	179.4	0	0	0	112.1	R57 D58 T62 R63 F68 T71 F91 L94	R57-I60 HydrophobicContact CG-CD1 4.49Å; R57-I60 WeakPolarHBondContact O-CB 3.42Å; R57-I60 WeakPolarHBondContact O-CG1 3.26Å; R57-I60 PolarHBondContact O-N 3.26Å; D58-I60 VanDerWaalsContact C-N 3.3Å; D58-I60 PolarHBondContact O-N 2.6Å; I60-T62 PolarHBondContact O-N 3.01Å; I60-R63 PolarHBondContact O-N 2.9Å; I60-R63 VanDerWaalsContact O-N 3.08Å; I60-F68 HydrophobicContact CG1-CD1 4.49Å; I60-F68 HydrophobicContact CG1-CE1 4.49Å; I60-F68 HydrophobicContact CG2-CB 4.23Å; I60-F68 HydrophobicContact CG2-CD1 4.33Å; I60-F68 HydrophobicContact CG2-CD2 3.47Å; I60-F68 VanDerWaalsContact CG2-CD2 3.47Å; I60-F68 HydrophobicContact CG2-CE2 3.77Å; I60-F68 HydrophobicContact CG2-CG 3.77Å; I60-F68 HydrophobicContact CG2-CZ 4.34Å; I60-T71 HydrophobicContact CD1-CG2 3.48Å; I60-T71 VanDerWaalsContact CD1-CG2 3.48Å; I60-F91 HydrophobicContact CG1-CD2 4.5Å; I60-F91 HydrophobicContact CG1-CE2 4.18Å; I60-L94 HydrophobicContact CD1-CD2 4.21Å; I60-L94 HydrophobicContact CG1-CD2 4.45Å
61	I	96.1	Very high	97.1	Very high	149 Å²	149	67.9 Å²	67.9	76%	0.764	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-62.8	-17	179.2	59.5	157.1	0	0	0	113.3	D58 M59 R63	D58-I61 WeakPolarHBondContact O-CG1 3.18Å; M59-I61 VanDerWaalsContact C-N 3.29Å; M59-I61 PolarHBondContact O-N 3.1Å; I61-R63 VanDerWaalsContact C-N 3.25Å; I61-R63 PolarHBondContact O-N 3.2Å
62	T	97.2	Very high	97.1	Very high	87 Å²	87	65 Å²	65	53%	0.534	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-77.5	-10.2	178.3	73.4	0	0	0	0	113.3	M59 I60 P64	M59-T62 WeakPolarHBondContact O-CB 3.45Å; M59-T62 WeakPolarHBondContact O-CG2 3.31Å; M59-T62 PolarHBondContact O-N 3.37Å; M59-T62 PolarHBondContact O-OG1 3.46Å; I60-T62 PolarHBondContact O-N 3.01Å; T62-P64 VanDerWaalsContact C-CD 3.45Å; T62-P64 WeakPolarHBondContact O-CD 2.78Å
63	R	97.3	Very high	97	Very high	67 Å²	67	66.3 Å²	66.3	25%	0.253	35%	0.347	S	S	.	.			trans	-126.3	65.3	-179.5	-70.7	-62.4	-56.3	-79.5	2.8	111.9	I60 I61 D65 I66 F68 F91	I60-R63 PolarHBondContact O-N 2.9Å; I60-R63 VanDerWaalsContact O-N 3.08Å; I61-R63 VanDerWaalsContact C-N 3.25Å; I61-R63 PolarHBondContact O-N 3.2Å; R63-D65 WeakPolarHBondContact CA-OD1 3.31Å; R63-D65 IonicContact CZ-OD1 3.54Å; R63-D65 IonicContact CZ-OD2 3.74Å; R63-D65 IonicContact NE-OD1 3.5Å; R63-D65 PolarHBondContact NE-OD1 3.2Å; R63-D65 IonicContact NE-OD2 2.94Å; R63-D65 PolarHBondContact NE-OD2 3.05Å; R63-D65 IonicContact NH2-OD1 3.39Å; R63-D65 IonicContact NH2-OD2 3.56Å; R63-D65 PolarHBondContact NH2-OD2 3.18Å; R63-D65 PolarHBondContact O-N 3.33Å; R63-D65 VanDerWaalsContact O-N 3.1Å; R63-I66 HydrophobicContact CB-CD1 4.27Å; R63-I66 VanDerWaalsContact CZ-CD1 3.41Å; R63-I66 VanDerWaalsContact NH2-CD1 3.27Å; R63-I66 PolarHBondContact O-N 3.1Å; R63-I66 VanDerWaalsContact O-N 3.11Å; R63-F68 HydrophobicContact CB-CE2 4.06Å; R63-F68 HydrophobicContact CB-CZ 4.16Å; R63-F91 HydrophobicContact CB-CZ 4.26Å; R63-F91 HydrophobicContact CG-CE1 4.23Å; R63-F91 HydrophobicContact CG-CZ 3.76Å
64	P	96.4	Very high	96.9	Very high	120 Å²	120	68.6 Å²	68.6	78%	0.779	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-13.1	-179.7	29.5	-36.7	0	0	0	113.6	T62 I66	T62-P64 VanDerWaalsContact C-CD 3.45Å; T62-P64 WeakPolarHBondContact O-CD 2.78Å; P64-I66 VanDerWaalsContact C-N 3.3Å
65	D	96.1	Very high	96.9	Very high	93 Å²	93	65 Å²	65	50%	0.497	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-16.2	175.2	63.2	-59	0	0	0	113.7	R63	R63-D65 WeakPolarHBondContact CA-OD1 3.31Å; R63-D65 IonicContact CZ-OD1 3.54Å; R63-D65 IonicContact CZ-OD2 3.74Å; R63-D65 IonicContact NE-OD1 3.5Å; R63-D65 PolarHBondContact NE-OD1 3.2Å; R63-D65 IonicContact NE-OD2 2.94Å; R63-D65 PolarHBondContact NE-OD2 3.05Å; R63-D65 IonicContact NH2-OD1 3.39Å; R63-D65 IonicContact NH2-OD2 3.56Å; R63-D65 PolarHBondContact NH2-OD2 3.18Å; R63-D65 PolarHBondContact O-N 3.33Å; R63-D65 VanDerWaalsContact O-N 3.1Å
66	I	97.4	Very high	96.9	Very high	11 Å²	11	60.8 Å²	60.8	6%	0.056	33%	0.328	C	S	.	.	S	Bend	trans	-101.7	130.7	-179.2	-64.1	175.4	0	0	0	110.8	R63 P64 F68 A95 F98 Q99	R63-I66 HydrophobicContact CB-CD1 4.27Å; R63-I66 VanDerWaalsContact CZ-CD1 3.41Å; R63-I66 VanDerWaalsContact NH2-CD1 3.27Å; R63-I66 PolarHBondContact O-N 3.1Å; R63-I66 VanDerWaalsContact O-N 3.11Å; P64-I66 VanDerWaalsContact C-N 3.3Å; I66-F68 HydrophobicContact CB-CD2 4.05Å; I66-F68 HydrophobicContact CB-CE2 3.55Å; I66-F68 HydrophobicContact CB-CZ 3.88Å; I66-F68 HydrophobicContact CD1-CZ 4.21Å; I66-F68 HydrophobicContact CG2-CD1 4.21Å; I66-F68 HydrophobicContact CG2-CD2 3.84Å; I66-F68 HydrophobicContact CG2-CE1 4Å; I66-F68 HydrophobicContact CG2-CE2 3.64Å; I66-F68 HydrophobicContact CG2-CG 4.14Å; I66-F68 HydrophobicContact CG2-CZ 3.71Å; I66-F68 VanDerWaalsContact O-CD2 3.24Å; I66-F68 WeakPolarHBondContact O-CD2 3.47Å; I66-F68 PolarHBondContact O-N 3.36Å; I66-A95 HydrophobicContact CD1-CB 3.67Å; I66-F98 HydrophobicContact CG2-CB 3.53Å; I66-Q99 HydrophobicContact CD1-CB 4.11Å; I66-Q99 HydrophobicContact CG1-CB 4.37Å
67	G	95.6	Very high	96.8	Very high	31 Å²	31	60.9 Å²	60.9	32%	0.32	33%	0.329	S	S	.	.			trans	-81.6	87.3	171.9	0	0	0	0	0	111.3	L69	G67-L69 PolarHBondContact O-N 2.76Å; G67-L69 VanDerWaalsContact O-N 3.11Å
68	F	96.9	Very high	96.8	Very high	37 Å²	37	58.5 Å²	58.5	16%	0.162	32%	0.32	C	S	.	.			trans	-74.4	96.7	175.1	-63	-90.9	0	0	0	110.5	I60 R63 I66 T71 F91 L94 A95 F98	I60-F68 HydrophobicContact CG1-CD1 4.49Å; I60-F68 HydrophobicContact CG1-CE1 4.49Å; I60-F68 HydrophobicContact CG2-CB 4.23Å; I60-F68 HydrophobicContact CG2-CD1 4.33Å; I60-F68 HydrophobicContact CG2-CD2 3.47Å; I60-F68 VanDerWaalsContact CG2-CD2 3.47Å; I60-F68 HydrophobicContact CG2-CE2 3.77Å; I60-F68 HydrophobicContact CG2-CG 3.77Å; I60-F68 HydrophobicContact CG2-CZ 4.34Å; R63-F68 HydrophobicContact CB-CE2 4.06Å; R63-F68 HydrophobicContact CB-CZ 4.16Å; I66-F68 HydrophobicContact CB-CD2 4.05Å; I66-F68 HydrophobicContact CB-CE2 3.55Å; I66-F68 HydrophobicContact CB-CZ 3.88Å; I66-F68 HydrophobicContact CD1-CZ 4.21Å; I66-F68 HydrophobicContact CG2-CD1 4.21Å; I66-F68 HydrophobicContact CG2-CD2 3.84Å; I66-F68 HydrophobicContact CG2-CE1 4Å; I66-F68 HydrophobicContact CG2-CE2 3.64Å; I66-F68 HydrophobicContact CG2-CG 4.14Å; I66-F68 HydrophobicContact CG2-CZ 3.71Å; I66-F68 VanDerWaalsContact O-CD2 3.24Å; I66-F68 WeakPolarHBondContact O-CD2 3.47Å; I66-F68 PolarHBondContact O-N 3.36Å; F68-T71 HydrophobicContact CB-CG2 4.05Å; F68-F91 HydrophobicContact CE1-CE2 4.36Å; F68-F91 HydrophobicContact CZ-CE2 4.03Å; F68-L94 HydrophobicContact CD1-CG 4.25Å; F68-L94 HydrophobicContact CE1-CD2 4.46Å; F68-L94 HydrophobicContact CE1-CG 4.12Å; F68-A95 HydrophobicContact CE1-CB 4.39Å; F68-A95 HydrophobicContact CZ-CB 4.28Å; F68-F98 HydrophobicContact CB-CD2 4.33Å; F68-F98 HydrophobicContact CB-CE2 4.31Å; F68-F98 AromaticContact CD1-CD2 3.46Å; F68-F98 HydrophobicContact CD1-CD2 3.46Å; F68-F98 VanDerWaalsContact CD1-CD2 3.46Å; F68-F98 AromaticContact CD1-CE2 3.89Å; F68-F98 HydrophobicContact CD1-CE2 3.89Å; F68-F98 HydrophobicContact CD1-CG 4.36Å; F68-F98 HydrophobicContact CE1-CD2 4.15Å; F68-F98 HydrophobicContact CG-CD2 4.19Å
69	L	93.9	Very high	96.9	Very high	158 Å²	158	54.2 Å²	54.2	83%	0.827	30%	0.297	S	S	*	.			trans	-80.8	-13.9	-174.4	-59.3	175.2	0	0	0	114	G67 F98	G67-L69 PolarHBondContact O-N 2.76Å; G67-L69 VanDerWaalsContact O-N 3.11Å; L69-F98 HydrophobicContact CB-CE1 3.87Å; L69-F98 HydrophobicContact CG-CE1 4.41Å
70	R	95.6	Very high	96.9	Very high	93 Å²	93	51.9 Å²	51.9	35%	0.351	29%	0.286	S	S	.	.			trans	-151.4	128.6	-177.2	-172.9	175.9	175.9	-176.7	-1.9	111.1	D72 F75 F98	R70-D72 WeakPolarHBondContact CD-OD2 3.48Å; R70-D72 WeakPolarHBondContact CG-OD2 3.03Å; R70-D72 IonicContact CZ-OD1 2.7Å; R70-D72 IonicContact CZ-OD2 2.59Å; R70-D72 IonicContact NE-OD1 3.57Å; R70-D72 IonicContact NE-OD2 3.47Å; R70-D72 PolarHBondContact NE-OD2 3.02Å; R70-D72 IonicContact NH2-OD1 3.38Å; R70-D72 PolarHBondContact NH2-OD1 2.9Å; R70-D72 IonicContact NH2-OD2 3.71Å; R70-F75 HydrophobicContact CB-CD1 4.08Å; R70-F75 HydrophobicContact CB-CE1 4.13Å; R70-F75 HydrophobicContact CB-CG 4.34Å; R70-F75 HydrophobicContact CB-CZ 4.45Å; R70-F75 HydrophobicContact CG-CB 3.98Å; R70-F75 HydrophobicContact CG-CD1 3.89Å; R70-F75 HydrophobicContact CG-CD2 4.08Å; R70-F75 HydrophobicContact CG-CE1 4.38Å; R70-F75 HydrophobicContact CG-CG 3.71Å; R70-F75 WeakPolarHBondContact O-CD1 3.44Å; R70-F75 VanDerWaalsContact O-CE1 3.26Å; R70-F75 WeakPolarHBondContact O-CE1 3.47Å; R70-F98 HydrophobicContact CB-CZ 4.15Å; R70-F98 WeakPolarHBondContact O-CZ 3.48Å
71	T	96.4	Very high	97	Very high	51 Å²	51	50.7 Å²	50.7	31%	0.313	28%	0.28	S	S	.	.			trans	-148.1	20.3	-172.8	62.7	0	0	0	0	113.5	R57 I60 F68 I76	R57-T71 PolarHBondContact NH2-O 3.26Å; R57-T71 VanDerWaalsContact NH2-O 3.12Å; I60-T71 HydrophobicContact CD1-CG2 3.48Å; I60-T71 VanDerWaalsContact CD1-CG2 3.48Å; F68-T71 HydrophobicContact CB-CG2 4.05Å; T71-I76 VanDerWaalsContact O-CD1 3.31Å; T71-I76 WeakPolarHBondContact O-CD1 3.44Å
72	D	96.7	Very high	97	Very high	63 Å²	63	44 Å²	44	34%	0.337	25%	0.246	S	C	.	.			trans	-64.8	158.3	173.1	58	102.3	0	0	0	111.8	R70 A74 F75 I76	R70-D72 WeakPolarHBondContact CD-OD2 3.48Å; R70-D72 WeakPolarHBondContact CG-OD2 3.03Å; R70-D72 IonicContact CZ-OD1 2.7Å; R70-D72 IonicContact CZ-OD2 2.59Å; R70-D72 IonicContact NE-OD1 3.57Å; R70-D72 IonicContact NE-OD2 3.47Å; R70-D72 PolarHBondContact NE-OD2 3.02Å; R70-D72 IonicContact NH2-OD1 3.38Å; R70-D72 PolarHBondContact NH2-OD1 2.9Å; R70-D72 IonicContact NH2-OD2 3.71Å; D72-A74 VanDerWaalsContact C-N 3.33Å; D72-A74 PolarHBondContact O-N 3.34Å; D72-F75 PolarHBondContact O-N 3.25Å; D72-F75 VanDerWaalsContact O-N 3.1Å; D72-F75 PolarHBondContact OD1-N 2.82Å; D72-F75 VanDerWaalsContact OD1-N 3.1Å; D72-F75 WeakPolarHBondContact OD2-CB 3.36Å; D72-I76 PolarHBondContact O-N 3.09Å
73	D	96.9	Very high	97.1	Very high	42 Å²	42	42.3 Å²	42.3	23%	0.225	23%	0.23	C	C	.	.	H	α-helix	trans	-53.9	-47.9	-175.8	-76.8	14.3	0	0	0	112.1	L26 H50 I53 R57 F75 I76 L77	L26-D73 HydrophobicContact CD1-CB 4.21Å; L26-D73 HydrophobicContact CD2-CB 3.72Å; H50-D73 IonicContact CE1-OD2 3.07Å; H50-D73 IonicContact ND1-OD2 2.64Å; H50-D73 PolarHBondContact ND1-OD2 3.28Å; I53-D73 HydrophobicContact CD1-CB 4.05Å; I53-D73 HydrophobicContact CG2-CB 4.31Å; I53-D73 WeakPolarHBondContact CG2-OD1 3.42Å; R57-D73 IonicContact CZ-OD1 3.6Å; R57-D73 IonicContact NH1-OD1 3.59Å; R57-D73 IonicContact NH2-OD1 2.69Å; R57-D73 PolarHBondContact NH2-OD1 3.48Å; D73-F75 VanDerWaalsContact C-N 3.3Å; D73-F75 PolarHBondContact O-N 3Å; D73-I76 PolarHBondContact O-N 3.31Å; D73-L77 VanDerWaalsContact O-CB 3.26Å; D73-L77 WeakPolarHBondContact O-CB 3.32Å; D73-L77 PolarHBondContact O-N 2.99Å
74	A	95.3	Very high	97.1	Very high	47 Å²	47	43.4 Å²	43.4	39%	0.388	24%	0.236	S	C	.	.	H	α-helix	trans	-63.2	-36.8	-179.9	0	0	0	0	0	112.2	D72	D72-A74 VanDerWaalsContact C-N 3.33Å; D72-A74 PolarHBondContact O-N 3.34Å
75	F	97.8	Very high	97.2	Very high	3 Å²	3	38.1 Å²	38.1	1%	0.013	20%	0.201	C	C	.	.	H	α-helix	trans	-69.1	-48.5	176	-173.1	-106.6	0	0	0	112.4	R70 D72 D73 L77 R78 F79 L94 Y97 F98	R70-F75 HydrophobicContact CB-CD1 4.08Å; R70-F75 HydrophobicContact CB-CE1 4.13Å; R70-F75 HydrophobicContact CB-CG 4.34Å; R70-F75 HydrophobicContact CB-CZ 4.45Å; R70-F75 HydrophobicContact CG-CB 3.98Å; R70-F75 HydrophobicContact CG-CD1 3.89Å; R70-F75 HydrophobicContact CG-CD2 4.08Å; R70-F75 HydrophobicContact CG-CE1 4.38Å; R70-F75 HydrophobicContact CG-CG 3.71Å; R70-F75 WeakPolarHBondContact O-CD1 3.44Å; R70-F75 VanDerWaalsContact O-CE1 3.26Å; R70-F75 WeakPolarHBondContact O-CE1 3.47Å; D72-F75 PolarHBondContact O-N 3.25Å; D72-F75 VanDerWaalsContact O-N 3.1Å; D72-F75 PolarHBondContact OD1-N 2.82Å; D72-F75 VanDerWaalsContact OD1-N 3.1Å; D72-F75 WeakPolarHBondContact OD2-CB 3.36Å; D73-F75 VanDerWaalsContact C-N 3.3Å; D73-F75 PolarHBondContact O-N 3Å; F75-L77 VanDerWaalsContact C-N 3.26Å; F75-L77 PolarHBondContact O-N 3.23Å; F75-R78 WeakPolarHBondContact O-CB 3.43Å; F75-R78 WeakPolarHBondContact O-CG 3.48Å; F75-R78 PolarHBondContact O-N 3.46Å; F75-F79 AromaticContact CD1-CE2 3.98Å; F75-F79 HydrophobicContact CD1-CE2 3.98Å; F75-F79 AromaticContact CE1-CE2 3.57Å; F75-F79 HydrophobicContact CE1-CE2 3.57Å; F75-F79 HydrophobicContact CE1-CZ 4.07Å; F75-F79 HydrophobicContact CE2-CE2 4.17Å; F75-F79 HydrophobicContact CG-CE2 4.44Å; F75-F79 AromaticContact CZ-CE2 3.68Å; F75-F79 HydrophobicContact CZ-CE2 3.68Å; F75-F79 AromaticContact CZ-CZ 3.9Å; F75-F79 HydrophobicContact CZ-CZ 3.9Å; F75-F79 VanDerWaalsContact O-CD2 3.23Å; F75-F79 WeakPolarHBondContact O-CD2 3.04Å; F75-F79 WeakPolarHBondContact O-CE2 3.5Å; F75-L94 HydrophobicContact CD1-CD1 4.28Å; F75-L94 HydrophobicContact CE1-CD1 3.68Å; F75-Y97 HydrophobicContact CE2-CE1 4.43Å; F75-Y97 HydrophobicContact CZ-CD1 4.17Å; F75-Y97 AromaticContact CZ-CE1 3.65Å; F75-Y97 HydrophobicContact CZ-CE1 3.65Å; F75-Y97 AromaticContact CZ-CZ 3.85Å; F75-F98 AromaticContact CE1-CE2 3.8Å; F75-F98 HydrophobicContact CE1-CE2 3.8Å; F75-F98 AromaticContact CE1-CZ 3.67Å; F75-F98 HydrophobicContact CE1-CZ 3.67Å; F75-F98 HydrophobicContact CZ-CE2 4.35Å; F75-F98 AromaticContact CZ-CZ 3.96Å; F75-F98 HydrophobicContact CZ-CZ 3.96Å
76	I	98.4	Very high	97.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.1	-37.5	178	-69.8	178.4	0	0	0	111	I53 V56 R57 T71 D72 D73 R78 F79 L80 L94	I53-I76 HydrophobicContact CB-CG2 4.43Å; I53-I76 HydrophobicContact CG1-CG2 4.39Å; I53-I76 HydrophobicContact CG2-CB 4.21Å; I53-I76 HydrophobicContact CG2-CD1 4.27Å; I53-I76 HydrophobicContact CG2-CG2 4.04Å; V56-I76 HydrophobicContact CB-CG2 3.85Å; V56-I76 HydrophobicContact CG1-CG2 3.78Å; V56-I76 HydrophobicContact CG2-CG2 4.46Å; R57-I76 HydrophobicContact CB-CD1 4.1Å; T71-I76 VanDerWaalsContact O-CD1 3.31Å; T71-I76 WeakPolarHBondContact O-CD1 3.44Å; D72-I76 PolarHBondContact O-N 3.09Å; D73-I76 PolarHBondContact O-N 3.31Å; I76-R78 PolarHBondContact O-N 3.46Å; I76-F79 WeakPolarHBondContact O-CB 3.36Å; I76-F79 PolarHBondContact O-N 3.3Å; I76-L80 HydrophobicContact CG2-CD1 4.19Å; I76-L80 PolarHBondContact O-N 3.42Å; I76-L94 HydrophobicContact CG1-CD2 4.49Å
77	L	97.9	Very high	97.4	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-57.5	-32.9	179.7	-175.7	53.9	0	0	0	113.2	L26 L49 D73 F75 F79 L80 R81 F85	L26-L77 HydrophobicContact CB-CD2 4.06Å; L49-L77 HydrophobicContact CD1-CD1 3.7Å; D73-L77 VanDerWaalsContact O-CB 3.26Å; D73-L77 WeakPolarHBondContact O-CB 3.32Å; D73-L77 PolarHBondContact O-N 2.99Å; F75-L77 VanDerWaalsContact C-N 3.26Å; F75-L77 PolarHBondContact O-N 3.23Å; L77-F79 PolarHBondContact O-N 2.97Å; L77-L80 HydrophobicContact CD1-CB 4.43Å; L77-L80 PolarHBondContact O-N 2.86Å; L77-R81 HydrophobicContact CD1-CG 4.15Å; L77-R81 HydrophobicContact CG-CG 4.43Å; L77-R81 WeakPolarHBondContact O-CB 3.37Å; L77-R81 WeakPolarHBondContact O-CG 3.38Å; L77-R81 PolarHBondContact O-N 3.1Å; L77-F85 HydrophobicContact CD1-CE1 4.32Å; L77-F85 HydrophobicContact CD1-CZ 3.78Å
78	R	98.3	Very high	97.5	Very high	9 Å²	9	42.3 Å²	42.3	3%	0.034	22%	0.221	C	C	.	.	H	α-helix	trans	-54.8	-43	173.6	-58.6	170.8	-174.1	-168	-3.7	111.1	F75 I76 A82 E167 E171 Q176 P214	F75-R78 WeakPolarHBondContact O-CB 3.43Å; F75-R78 WeakPolarHBondContact O-CG 3.48Å; F75-R78 PolarHBondContact O-N 3.46Å; I76-R78 PolarHBondContact O-N 3.46Å; R78-A82 VanDerWaalsContact O-CB 3.27Å; R78-A82 WeakPolarHBondContact O-CB 3.27Å; R78-A82 PolarHBondContact O-N 3.22Å; R78-E167 IonicContact NH1-OE2 3.78Å; R78-E171 IonicContact NH2-OE1 3.55Å; R78-Q176 HydrophobicContact CG-CG 4.36Å; R78-P214 HydrophobicContact CB-CB 4.11Å; R78-P214 HydrophobicContact CB-CG 4.07Å
79	F	98.8	Very high	97.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-74.6	-40.3	-177.5	-62.3	-92.6	0	0	0	112.2	F75 I76 L77 A82 R83 A90 L93 L94 Y97 P214	F75-F79 AromaticContact CD1-CE2 3.98Å; F75-F79 HydrophobicContact CD1-CE2 3.98Å; F75-F79 AromaticContact CE1-CE2 3.57Å; F75-F79 HydrophobicContact CE1-CE2 3.57Å; F75-F79 HydrophobicContact CE1-CZ 4.07Å; F75-F79 HydrophobicContact CE2-CE2 4.17Å; F75-F79 HydrophobicContact CG-CE2 4.44Å; F75-F79 AromaticContact CZ-CE2 3.68Å; F75-F79 HydrophobicContact CZ-CE2 3.68Å; F75-F79 AromaticContact CZ-CZ 3.9Å; F75-F79 HydrophobicContact CZ-CZ 3.9Å; F75-F79 VanDerWaalsContact O-CD2 3.23Å; F75-F79 WeakPolarHBondContact O-CD2 3.04Å; F75-F79 WeakPolarHBondContact O-CE2 3.5Å; I76-F79 WeakPolarHBondContact O-CB 3.36Å; I76-F79 PolarHBondContact O-N 3.3Å; L77-F79 PolarHBondContact O-N 2.97Å; F79-A82 PolarHBondContact O-N 3.34Å; F79-R83 WeakPolarHBondContact O-CB 3.49Å; F79-R83 PolarHBondContact O-N 3.06Å; F79-A90 HydrophobicContact CB-CB 4.26Å; F79-L93 HydrophobicContact CD1-CB 4.02Å; F79-L93 HydrophobicContact CD1-CD2 3.84Å; F79-L93 HydrophobicContact CD1-CG 3.63Å; F79-L93 HydrophobicContact CE1-CD2 4.48Å; F79-L93 HydrophobicContact CE1-CG 4.03Å; F79-L94 HydrophobicContact CD1-CB 3.85Å; F79-L94 HydrophobicContact CD1-CD1 4.3Å; F79-L94 HydrophobicContact CD2-CB 4.49Å; F79-L94 HydrophobicContact CD2-CD1 3.82Å; F79-L94 VanDerWaalsContact CE1-CA 3.49Å; F79-L94 HydrophobicContact CE1-CB 4.15Å; F79-L94 HydrophobicContact CE1-CD1 4.05Å; F79-L94 HydrophobicContact CE2-CD1 3.52Å; F79-L94 HydrophobicContact CG-CB 4.06Å; F79-L94 HydrophobicContact CG-CD1 4.22Å; F79-L94 HydrophobicContact CZ-CD1 3.64Å; F79-Y97 HydrophobicContact CE1-CD2 4.12Å; F79-Y97 HydrophobicContact CE1-CG 4.02Å; F79-Y97 HydrophobicContact CZ-CD1 4.25Å; F79-Y97 AromaticContact CZ-CD2 3.82Å; F79-Y97 HydrophobicContact CZ-CD2 3.82Å; F79-Y97 HydrophobicContact CZ-CE2 4.36Å; F79-Y97 AromaticContact CZ-CG 3.76Å; F79-Y97 HydrophobicContact CZ-CG 3.76Å; F79-P214 HydrophobicContact CD1-CB 4.01Å; F79-P214 HydrophobicContact CD1-CG 4.43Å; F79-P214 HydrophobicContact CE1-CB 4.02Å; F79-P214 HydrophobicContact CE1-CG 3.97Å; F79-P214 HydrophobicContact CE2-CG 4.26Å; F79-P214 HydrophobicContact CG-CB 4.29Å; F79-P214 HydrophobicContact CZ-CB 4.35Å; F79-P214 HydrophobicContact CZ-CG 3.89Å
80	L	98.7	Very high	97.8	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.2	-50.5	173.2	-76.9	167.5	0	0	0	111	D52 I53 V56 I76 L77 A82 R83 K84 F85 Q87 A90	D52-L80 HydrophobicContact CB-CD1 4.12Å; D52-L80 HydrophobicContact CB-CD2 4.41Å; I53-L80 HydrophobicContact CB-CD1 4.43Å; I53-L80 HydrophobicContact CG1-CD1 3.62Å; V56-L80 HydrophobicContact CG2-CD2 3.74Å; V56-L80 HydrophobicContact CG2-CG 4.17Å; I76-L80 HydrophobicContact CG2-CD1 4.19Å; I76-L80 PolarHBondContact O-N 3.42Å; L77-L80 HydrophobicContact CD1-CB 4.43Å; L77-L80 PolarHBondContact O-N 2.86Å; L80-A82 PolarHBondContact O-N 2.97Å; L80-R83 CarbonylContact O-C 3.49Å; L80-R83 VanDerWaalsContact O-C 3.29Å; L80-R83 PolarHBondContact O-N 2.9Å; L80-K84 PolarHBondContact O-N 2.82Å; L80-F85 HydrophobicContact CB-CD1 4.26Å; L80-F85 HydrophobicContact CB-CE1 4.18Å; L80-F85 HydrophobicContact CB-CE2 4.45Å; L80-F85 HydrophobicContact CB-CG 4.43Å; L80-F85 HydrophobicContact CB-CZ 4.27Å; L80-F85 HydrophobicContact CD1-CE1 4.37Å; L80-F85 HydrophobicContact CD2-CD1 4.4Å; L80-F85 PolarHBondContact O-N 3.2Å; L80-Q87 HydrophobicContact CD2-CG 4.37Å; L80-A90 HydrophobicContact CD2-CB 3.9Å; L80-A90 HydrophobicContact CG-CB 4.25Å
81	R	98.3	Very high	97.9	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.008	18%	0.176	C	C	.	.	H	α-helix	trans	-59.5	-43.8	176.2	-74.8	174.9	170.6	158.1	3.8	112.1	L42 E44 L77 R83 K84 F85	L42-R81 HydrophobicContact CD1-CB 4.11Å; L42-R81 HydrophobicContact CD1-CG 4.22Å; E44-R81 IonicContact OE1-CZ 3.8Å; E44-R81 IonicContact OE1-NE 3.22Å; E44-R81 IonicContact OE1-NH2 3.62Å; E44-R81 PolarHBondContact OE1-NH2 3.38Å; E44-R81 IonicContact OE2-CZ 2.6Å; E44-R81 IonicContact OE2-NE 2.74Å; E44-R81 PolarHBondContact OE2-NE 3.1Å; E44-R81 IonicContact OE2-NH2 3.58Å; E44-R81 PolarHBondContact OE2-NH2 2.74Å; L77-R81 HydrophobicContact CD1-CG 4.15Å; L77-R81 HydrophobicContact CG-CG 4.43Å; L77-R81 WeakPolarHBondContact O-CB 3.37Å; L77-R81 WeakPolarHBondContact O-CG 3.38Å; L77-R81 PolarHBondContact O-N 3.1Å; R81-R83 PolarHBondContact O-N 2.83Å; R81-K84 PolarHBondContact O-N 3.41Å; R81-F85 HydrophobicContact CG-CE2 3.93Å; R81-F85 HydrophobicContact CG-CZ 4.35Å
82	A	98.1	Very high	98	Very high	7 Å²	7	35.9 Å²	35.9	6%	0.058	18%	0.183	C	C	.	.	H	α-helix	trans	-63.7	-20.7	176.9	0	0	0	0	0	113.9	R78 F79 L80 L93 P214	R78-A82 VanDerWaalsContact O-CB 3.27Å; R78-A82 WeakPolarHBondContact O-CB 3.27Å; R78-A82 PolarHBondContact O-N 3.22Å; F79-A82 PolarHBondContact O-N 3.34Å; L80-A82 PolarHBondContact O-N 2.97Å; A82-L93 HydrophobicContact CB-CD2 3.87Å; A82-P214 HydrophobicContact CB-CB 4.02Å; A82-P214 WeakPolarHBondContact CB-O 3.44Å
83	R	98.2	Very high	98.1	Very high	52 Å²	52	33 Å²	33	20%	0.196	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.7	21.8	-178.5	-63	-63.9	179.4	-95.5	3.1	113.6	F79 L80 R81 F85 H86 D89 A90 L93	F79-R83 WeakPolarHBondContact O-CB 3.49Å; F79-R83 PolarHBondContact O-N 3.06Å; L80-R83 CarbonylContact O-C 3.49Å; L80-R83 VanDerWaalsContact O-C 3.29Å; L80-R83 PolarHBondContact O-N 2.9Å; R81-R83 PolarHBondContact O-N 2.83Å; R83-F85 PolarHBondContact O-N 3.49Å; R83-H86 WeakPolarHBondContact O-CB 3.4Å; R83-H86 PolarHBondContact O-CD2 3.42Å; R83-H86 PolarHBondContact O-N 3.17Å; R83-D89 HydrophobicContact CB-CB 4.02Å; R83-D89 HydrophobicContact CG-CB 4.11Å; R83-A90 HydrophobicContact CB-CB 4.19Å; R83-L93 HydrophobicContact CG-CB 4.38Å; R83-L93 HydrophobicContact CG-CD2 4.12Å
84	K	97.9	Very high	98.2	Very high	90 Å²	90	31 Å²	31	39%	0.391	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	40.3	174.5	-53.9	-176.1	170.1	-162.2	0	112.9	L42 N43 L80 R81 H86	L42-K84 HydrophobicContact CD2-CG 4.17Å; L42-K84 CarbonylContact O-C 3.52Å; L42-K84 WeakPolarHBondContact O-CA 3.25Å; N43-K84 PolarHBondContact ND2-O 3.45Å; L80-K84 PolarHBondContact O-N 2.82Å; R81-K84 PolarHBondContact O-N 3.41Å; K84-H86 PolarHBondContact O-N 3.34Å; K84-H86 VanDerWaalsContact O-N 3.1Å
85	F	98.1	Very high	98.4	Very high	10 Å²	10	28.9 Å²	28.9	4%	0.044	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	18.1	179.5	-73.9	-105.9	0	0	0	114.8	L42 E44 L49 D52 L77 L80 R81 R83 Q87	L42-F85 HydrophobicContact CB-CD2 4.3Å; L42-F85 HydrophobicContact CB-CE2 4.49Å; L42-F85 VanDerWaalsContact O-CD2 3.25Å; L42-F85 WeakPolarHBondContact O-CD2 3.16Å; E44-F85 HydrophobicContact CB-CD2 4.09Å; E44-F85 HydrophobicContact CB-CE1 4.46Å; E44-F85 HydrophobicContact CB-CE2 3.43Å; E44-F85 VanDerWaalsContact CB-CE2 3.43Å; E44-F85 HydrophobicContact CB-CZ 3.66Å; E44-F85 HydrophobicContact CG-CE1 4.16Å; E44-F85 HydrophobicContact CG-CE2 3.7Å; E44-F85 HydrophobicContact CG-CZ 3.38Å; L49-F85 HydrophobicContact CD1-CE1 3.53Å; L49-F85 HydrophobicContact CD1-CZ 3.84Å; D52-F85 HydrophobicContact CB-CD1 4.25Å; D52-F85 WeakPolarHBondContact OD2-CD1 3.34Å; L77-F85 HydrophobicContact CD1-CE1 4.32Å; L77-F85 HydrophobicContact CD1-CZ 3.78Å; L80-F85 HydrophobicContact CB-CD1 4.26Å; L80-F85 HydrophobicContact CB-CE1 4.18Å; L80-F85 HydrophobicContact CB-CE2 4.45Å; L80-F85 HydrophobicContact CB-CG 4.43Å; L80-F85 HydrophobicContact CB-CZ 4.27Å; L80-F85 HydrophobicContact CD1-CE1 4.37Å; L80-F85 HydrophobicContact CD2-CD1 4.4Å; L80-F85 PolarHBondContact O-N 3.2Å; R81-F85 HydrophobicContact CG-CE2 3.93Å; R81-F85 HydrophobicContact CG-CZ 4.35Å; R83-F85 PolarHBondContact O-N 3.49Å; F85-Q87 VanDerWaalsContact O-CD 3.23Å; F85-Q87 PolarHBondContact O-N 2.79Å; F85-Q87 PolarHBondContact O-NE2 2.94Å; F85-Q87 PolarHBondContact O-OE1 3.2Å
86	H	98.4	Very high	98.4	Very high	103 Å²	103	31 Å²	31	48%	0.477	15%	0.15	S	C	.	.			trans	-75.7	100.9	163.3	-66.1	-64.5	0	0	0	109.4	R83 K84 A88 D89 A90	R83-H86 WeakPolarHBondContact O-CB 3.4Å; R83-H86 PolarHBondContact O-CD2 3.42Å; R83-H86 PolarHBondContact O-N 3.17Å; K84-H86 PolarHBondContact O-N 3.34Å; K84-H86 VanDerWaalsContact O-N 3.1Å; H86-A88 PolarHBondContact O-N 2.95Å; H86-D89 HydrophobicContact CB-CB 4.04Å; H86-D89 PolarHBondContact O-N 3.37Å; H86-D89 VanDerWaalsContact O-N 3.14Å; H86-A90 WeakPolarHBondContact O-CB 3.19Å; H86-A90 PolarHBondContact O-N 3.41Å
87	Q	98.5	Very high	98.4	Very high	52 Å²	52	31.7 Å²	31.7	24%	0.243	15%	0.153	C	C	.	.	H	α-helix	trans	-58.9	-45.6	-169.5	-58.9	80.7	-4.3	0	0	111.8	D52 Q55 V56 M59 L80 F85 D89 A90 F91	D52-Q87 PolarHBondContact OD1-NE2 3.24Å; Q55-Q87 HydrophobicContact CB-CG 4.22Å; V56-Q87 HydrophobicContact CG2-CB 4.09Å; M59-Q87 HydrophobicContact CE-CB 4.09Å; M59-Q87 WeakPolarHBondContact CE-O 3.11Å; L80-Q87 HydrophobicContact CD2-CG 4.37Å; F85-Q87 VanDerWaalsContact O-CD 3.23Å; F85-Q87 PolarHBondContact O-N 2.79Å; F85-Q87 PolarHBondContact O-NE2 2.94Å; F85-Q87 PolarHBondContact O-OE1 3.2Å; Q87-D89 VanDerWaalsContact C-N 3.33Å; Q87-D89 PolarHBondContact O-N 3.36Å; Q87-A90 WeakPolarHBondContact O-CB 3.42Å; Q87-A90 PolarHBondContact O-N 3.19Å; Q87-F91 PolarHBondContact O-N 3.19Å
88	A	98.4	Very high	98.5	Very high	67 Å²	67	32 Å²	32	55%	0.554	15%	0.154	S	C	*	.	H	α-helix	trans	-62.3	-39.6	178.7	0	0	0	0	0	112.5	H86 R92	H86-A88 PolarHBondContact O-N 2.95Å; A88-R92 WeakPolarHBondContact O-CB 3.38Å; A88-R92 PolarHBondContact O-N 3.42Å
89	D	98.5	Very high	98.4	Very high	58 Å²	58	34.7 Å²	34.7	31%	0.31	17%	0.167	S	C	.	.	H	α-helix	trans	-71.8	-36.8	176.4	-83.6	-35.4	0	0	0	112.5	R83 H86 Q87 R92 L93	R83-D89 HydrophobicContact CB-CB 4.02Å; R83-D89 HydrophobicContact CG-CB 4.11Å; H86-D89 HydrophobicContact CB-CB 4.04Å; H86-D89 PolarHBondContact O-N 3.37Å; H86-D89 VanDerWaalsContact O-N 3.14Å; Q87-D89 VanDerWaalsContact C-N 3.33Å; Q87-D89 PolarHBondContact O-N 3.36Å; D89-R92 PolarHBondContact O-N 3.42Å; D89-R92 IonicContact OD1-CZ 3.47Å; D89-R92 IonicContact OD1-NE 3.43Å; D89-R92 PolarHBondContact OD1-NE 3.37Å; D89-R92 IonicContact OD1-NH2 2.8Å; D89-R92 PolarHBondContact OD1-NH2 2.92Å; D89-L93 PolarHBondContact O-N 2.66Å
90	A	98.7	Very high	98.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.2	-47.2	173.8	0	0	0	0	0	110.8	V56 F79 L80 R83 H86 Q87 R92 L93 L94	V56-A90 HydrophobicContact CG2-CB 4.11Å; F79-A90 HydrophobicContact CB-CB 4.26Å; L80-A90 HydrophobicContact CD2-CB 3.9Å; L80-A90 HydrophobicContact CG-CB 4.25Å; R83-A90 HydrophobicContact CB-CB 4.19Å; H86-A90 WeakPolarHBondContact O-CB 3.19Å; H86-A90 PolarHBondContact O-N 3.41Å; Q87-A90 WeakPolarHBondContact O-CB 3.42Å; Q87-A90 PolarHBondContact O-N 3.19Å; A90-R92 PolarHBondContact O-N 3.36Å; A90-L93 PolarHBondContact O-N 3.37Å; A90-L94 WeakPolarHBondContact O-CB 3.2Å; A90-L94 PolarHBondContact O-N 2.99Å
91	F	98.8	Very high	98.4	Very high	22 Å²	22	37 Å²	37	10%	0.096	18%	0.176	C	C	.	.	H	α-helix	trans	-60.4	-44.5	174.3	172.5	-114.3	0	0	0	112	V56 M59 I60 R63 F68 Q87 L93 L94 A95	V56-F91 HydrophobicContact CG1-CB 4.2Å; M59-F91 HydrophobicContact CB-CB 4.25Å; M59-F91 HydrophobicContact CB-CD1 3.7Å; M59-F91 HydrophobicContact CB-CD2 3.69Å; M59-F91 HydrophobicContact CB-CE1 3.91Å; M59-F91 HydrophobicContact CB-CE2 3.93Å; M59-F91 HydrophobicContact CB-CG 3.58Å; M59-F91 HydrophobicContact CB-CZ 4.02Å; M59-F91 HydrophobicContact CE-CB 3.62Å; M59-F91 HydrophobicContact CE-CG 4.24Å; M59-F91 HydrophobicContact CG-CD1 4.42Å; M59-F91 HydrophobicContact CG-CG 4.45Å; M59-F91 WeakPolarHBondContact O-CE2 3.2Å; M59-F91 WeakPolarHBondContact O-CZ 3.17Å; M59-F91 HydrophobicContact SD-CB 4.02Å; M59-F91 HydrophobicContact SD-CD1 4Å; M59-F91 HydrophobicContact SD-CG 4.12Å; I60-F91 HydrophobicContact CG1-CD2 4.5Å; I60-F91 HydrophobicContact CG1-CE2 4.18Å; R63-F91 HydrophobicContact CB-CZ 4.26Å; R63-F91 HydrophobicContact CG-CE1 4.23Å; R63-F91 HydrophobicContact CG-CZ 3.76Å; F68-F91 HydrophobicContact CE1-CE2 4.36Å; F68-F91 HydrophobicContact CZ-CE2 4.03Å; Q87-F91 PolarHBondContact O-N 3.19Å; F91-L93 VanDerWaalsContact C-N 3.29Å; F91-L93 PolarHBondContact O-N 2.87Å; F91-L94 WeakPolarHBondContact O-CB 3.44Å; F91-L94 PolarHBondContact O-N 3.41Å; F91-L94 VanDerWaalsContact O-N 3.14Å; F91-A95 WeakPolarHBondContact O-CB 3.44Å; F91-A95 PolarHBondContact O-N 3.3Å
92	R	98.6	Very high	98.3	Very high	124 Å²	124	40.7 Å²	40.7	47%	0.468	19%	0.193	S	C	.	.	H	α-helix	trans	-59.6	-39.3	176.9	-179.4	172.4	63.4	117.5	-2.9	112.2	A88 D89 A90 Q96	A88-R92 WeakPolarHBondContact O-CB 3.38Å; A88-R92 PolarHBondContact O-N 3.42Å; D89-R92 PolarHBondContact O-N 3.42Å; D89-R92 IonicContact OD1-CZ 3.47Å; D89-R92 IonicContact OD1-NE 3.43Å; D89-R92 PolarHBondContact OD1-NE 3.37Å; D89-R92 IonicContact OD1-NH2 2.8Å; D89-R92 PolarHBondContact OD1-NH2 2.92Å; A90-R92 PolarHBondContact O-N 3.36Å; R92-Q96 VanDerWaalsContact CG-NE2 3.29Å; R92-Q96 WeakPolarHBondContact O-CB 3.28Å; R92-Q96 VanDerWaalsContact O-CG 3.31Å; R92-Q96 WeakPolarHBondContact O-CG 3.46Å; R92-Q96 PolarHBondContact O-N 3.29Å
93	L	98.8	Very high	98.2	Very high	3 Å²	3	46.5 Å²	46.5	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-68.1	-42	173.7	-178.6	58.8	0	0	0	112.1	F79 A82 R83 D89 A90 F91 A95 Q96 Y97 D211 P214	F79-L93 HydrophobicContact CD1-CB 4.02Å; F79-L93 HydrophobicContact CD1-CD2 3.84Å; F79-L93 HydrophobicContact CD1-CG 3.63Å; F79-L93 HydrophobicContact CE1-CD2 4.48Å; F79-L93 HydrophobicContact CE1-CG 4.03Å; A82-L93 HydrophobicContact CB-CD2 3.87Å; R83-L93 HydrophobicContact CG-CB 4.38Å; R83-L93 HydrophobicContact CG-CD2 4.12Å; D89-L93 PolarHBondContact O-N 2.66Å; A90-L93 PolarHBondContact O-N 3.37Å; F91-L93 VanDerWaalsContact C-N 3.29Å; F91-L93 PolarHBondContact O-N 2.87Å; L93-A95 VanDerWaalsContact C-N 3.35Å; L93-Q96 PolarHBondContact O-N 2.91Å; L93-Y97 WeakPolarHBondContact O-CB 3.49Å; L93-Y97 PolarHBondContact O-N 2.92Å; L93-D211 WeakPolarHBondContact CD1-O 3.25Å; L93-P214 HydrophobicContact CD2-CB 4.1Å
94	L	98.8	Very high	98.1	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60	-45	176.2	178.6	64.8	0	0	0	111.6	V56 I60 F68 F75 I76 F79 A90 F91 Y97 F98	V56-L94 HydrophobicContact CG1-CD2 4.01Å; I60-L94 HydrophobicContact CD1-CD2 4.21Å; I60-L94 HydrophobicContact CG1-CD2 4.45Å; F68-L94 HydrophobicContact CD1-CG 4.25Å; F68-L94 HydrophobicContact CE1-CD2 4.46Å; F68-L94 HydrophobicContact CE1-CG 4.12Å; F75-L94 HydrophobicContact CD1-CD1 4.28Å; F75-L94 HydrophobicContact CE1-CD1 3.68Å; I76-L94 HydrophobicContact CG1-CD2 4.49Å; F79-L94 HydrophobicContact CD1-CB 3.85Å; F79-L94 HydrophobicContact CD1-CD1 4.3Å; F79-L94 HydrophobicContact CD2-CB 4.49Å; F79-L94 HydrophobicContact CD2-CD1 3.82Å; F79-L94 VanDerWaalsContact CE1-CA 3.49Å; F79-L94 HydrophobicContact CE1-CB 4.15Å; F79-L94 HydrophobicContact CE1-CD1 4.05Å; F79-L94 HydrophobicContact CE2-CD1 3.52Å; F79-L94 HydrophobicContact CG-CB 4.06Å; F79-L94 HydrophobicContact CG-CD1 4.22Å; F79-L94 HydrophobicContact CZ-CD1 3.64Å; A90-L94 WeakPolarHBondContact O-CB 3.2Å; A90-L94 PolarHBondContact O-N 2.99Å; F91-L94 WeakPolarHBondContact O-CB 3.44Å; F91-L94 PolarHBondContact O-N 3.41Å; F91-L94 VanDerWaalsContact O-N 3.14Å; L94-Y97 WeakPolarHBondContact O-CB 3.5Å; L94-Y97 PolarHBondContact O-N 2.93Å; L94-F98 HydrophobicContact CD1-CD2 4.1Å; L94-F98 HydrophobicContact CD1-CE2 3.67Å; L94-F98 HydrophobicContact CG-CD2 4.5Å; L94-F98 HydrophobicContact CG-CE2 4.41Å; L94-F98 WeakPolarHBondContact O-CD2 3.26Å; L94-F98 PolarHBondContact O-N 3.14Å
95	A	98.6	Very high	98	Very high	3 Å²	3	47.4 Å²	47.4	3%	0.025	24%	0.235	C	C	.	.	H	α-helix	trans	-61.5	-46.4	174.4	0	0	0	0	0	111.4	I66 F68 F91 L93 Y97 F98 Q99	I66-A95 HydrophobicContact CD1-CB 3.67Å; F68-A95 HydrophobicContact CE1-CB 4.39Å; F68-A95 HydrophobicContact CZ-CB 4.28Å; F91-A95 WeakPolarHBondContact O-CB 3.44Å; F91-A95 PolarHBondContact O-N 3.3Å; L93-A95 VanDerWaalsContact C-N 3.35Å; A95-Y97 VanDerWaalsContact C-N 3.32Å; A95-Y97 PolarHBondContact O-N 3.07Å; A95-F98 PolarHBondContact O-N 3.17Å; A95-Q99 WeakPolarHBondContact O-CB 3.35Å; A95-Q99 PolarHBondContact O-N 2.96Å
96	Q	98.4	Very high	97.7	Very high	47 Å²	47	53.9 Å²	53.9	22%	0.22	27%	0.27	C	S	.	.	H	α-helix	trans	-61.4	-39.2	176.4	-77.3	170.8	42.1	0	0	112.3	R92 L93 F98 Q99 Y100 D211	R92-Q96 VanDerWaalsContact CG-NE2 3.29Å; R92-Q96 WeakPolarHBondContact O-CB 3.28Å; R92-Q96 VanDerWaalsContact O-CG 3.31Å; R92-Q96 WeakPolarHBondContact O-CG 3.46Å; R92-Q96 PolarHBondContact O-N 3.29Å; L93-Q96 PolarHBondContact O-N 2.91Å; Q96-F98 PolarHBondContact O-N 3.05Å; Q96-Q99 PolarHBondContact O-N 3.17Å; Q96-Y100 WeakPolarHBondContact O-CB 3.08Å; Q96-Y100 PolarHBondContact O-N 3.02Å; Q96-D211 PolarHBondContact OE1-O 2.96Å
97	Y	98.7	Very high	97.6	Very high	15 Å²	15	49.4 Å²	49.4	6%	0.059	25%	0.249	C	C	.	.	H	α-helix	trans	-57	-47.8	177.1	174.3	-80.6	0	0	0	112.7	F75 F79 L93 L94 A95 R101 E167 S212 F213	F75-Y97 HydrophobicContact CE2-CE1 4.43Å; F75-Y97 HydrophobicContact CZ-CD1 4.17Å; F75-Y97 AromaticContact CZ-CE1 3.65Å; F75-Y97 HydrophobicContact CZ-CE1 3.65Å; F75-Y97 AromaticContact CZ-CZ 3.85Å; F79-Y97 HydrophobicContact CE1-CD2 4.12Å; F79-Y97 HydrophobicContact CE1-CG 4.02Å; F79-Y97 HydrophobicContact CZ-CD1 4.25Å; F79-Y97 AromaticContact CZ-CD2 3.82Å; F79-Y97 HydrophobicContact CZ-CD2 3.82Å; F79-Y97 HydrophobicContact CZ-CE2 4.36Å; F79-Y97 AromaticContact CZ-CG 3.76Å; F79-Y97 HydrophobicContact CZ-CG 3.76Å; L93-Y97 WeakPolarHBondContact O-CB 3.49Å; L93-Y97 PolarHBondContact O-N 2.92Å; L94-Y97 WeakPolarHBondContact O-CB 3.5Å; L94-Y97 PolarHBondContact O-N 2.93Å; A95-Y97 VanDerWaalsContact C-N 3.32Å; A95-Y97 PolarHBondContact O-N 3.07Å; Y97-R101 VanDerWaalsContact CE1-NH1 3.31Å; Y97-R101 VanDerWaalsContact CG-NH1 3.25Å; Y97-R101 PolarHBondContact O-NH1 3.45Å; Y97-R101 VanDerWaalsContact OH-CZ 3.28Å; Y97-R101 PolarHBondContact OH-NH2 3.04Å; Y97-E167 WeakPolarHBondContact CE2-OE1 3.49Å; Y97-E167 VanDerWaalsContact CZ-OE1 3.27Å; Y97-E167 VanDerWaalsContact OH-CD 3.28Å; Y97-E167 PolarHBondContact OH-OE1 2.83Å; Y97-E167 PolarHBondContact OH-OE2 3.3Å; Y97-S212 VanDerWaalsContact CA-O 3.25Å; Y97-S212 WeakPolarHBondContact CA-O 2.95Å; Y97-S212 WeakPolarHBondContact CB-O 3.23Å; Y97-S212 WeakPolarHBondContact CD2-O 3.41Å; Y97-F213 HydrophobicContact CE2-CD2 4.45Å
98	F	98.4	Very high	97.4	Very high	9 Å²	9	48.4 Å²	48.4	4%	0.039	24%	0.244	C	C	.	.	H	α-helix	trans	-77.7	-39.9	179.2	-75.3	-66.7	0	0	0	112.1	I66 F68 L69 R70 F75 L94 A95 Q96 Y100 R101 Q102	I66-F98 HydrophobicContact CG2-CB 3.53Å; F68-F98 HydrophobicContact CB-CD2 4.33Å; F68-F98 HydrophobicContact CB-CE2 4.31Å; F68-F98 AromaticContact CD1-CD2 3.46Å; F68-F98 HydrophobicContact CD1-CD2 3.46Å; F68-F98 VanDerWaalsContact CD1-CD2 3.46Å; F68-F98 AromaticContact CD1-CE2 3.89Å; F68-F98 HydrophobicContact CD1-CE2 3.89Å; F68-F98 HydrophobicContact CD1-CG 4.36Å; F68-F98 HydrophobicContact CE1-CD2 4.15Å; F68-F98 HydrophobicContact CG-CD2 4.19Å; L69-F98 HydrophobicContact CB-CE1 3.87Å; L69-F98 HydrophobicContact CG-CE1 4.41Å; R70-F98 HydrophobicContact CB-CZ 4.15Å; R70-F98 WeakPolarHBondContact O-CZ 3.48Å; F75-F98 AromaticContact CE1-CE2 3.8Å; F75-F98 HydrophobicContact CE1-CE2 3.8Å; F75-F98 AromaticContact CE1-CZ 3.67Å; F75-F98 HydrophobicContact CE1-CZ 3.67Å; F75-F98 HydrophobicContact CZ-CE2 4.35Å; F75-F98 AromaticContact CZ-CZ 3.96Å; F75-F98 HydrophobicContact CZ-CZ 3.96Å; L94-F98 HydrophobicContact CD1-CD2 4.1Å; L94-F98 HydrophobicContact CD1-CE2 3.67Å; L94-F98 HydrophobicContact CG-CD2 4.5Å; L94-F98 HydrophobicContact CG-CE2 4.41Å; L94-F98 WeakPolarHBondContact O-CD2 3.26Å; L94-F98 PolarHBondContact O-N 3.14Å; A95-F98 PolarHBondContact O-N 3.17Å; Q96-F98 PolarHBondContact O-N 3.05Å; F98-Y100 VanDerWaalsContact C-N 3.32Å; F98-Y100 PolarHBondContact O-N 2.89Å; F98-R101 WeakPolarHBondContact O-CB 3.33Å; F98-R101 PolarHBondContact O-N 3.33Å; F98-R101 VanDerWaalsContact O-N 3.08Å; F98-Q102 WeakPolarHBondContact O-CG 3.45Å; F98-Q102 PolarHBondContact O-N 3.38Å
99	Q	98	Very high	97.1	Very high	65 Å²	65	51.8 Å²	51.8	30%	0.304	25%	0.247	S	C	.	.	H	α-helix	trans	-60.7	-42.2	177.1	-173.1	172.6	42.7	0	0	111.6	I66 A95 Q96 R101 Q102 L103	I66-Q99 HydrophobicContact CD1-CB 4.11Å; I66-Q99 HydrophobicContact CG1-CB 4.37Å; A95-Q99 WeakPolarHBondContact O-CB 3.35Å; A95-Q99 PolarHBondContact O-N 2.96Å; Q96-Q99 PolarHBondContact O-N 3.17Å; Q99-R101 VanDerWaalsContact C-N 3.26Å; Q99-R101 PolarHBondContact O-N 3.2Å; Q99-Q102 PolarHBondContact O-N 3.23Å; Q99-L103 HydrophobicContact CG-CD1 3.94Å; Q99-L103 HydrophobicContact CG-CG 4.33Å; Q99-L103 WeakPolarHBondContact O-CB 3.44Å; Q99-L103 VanDerWaalsContact O-CG 3.32Å; Q99-L103 WeakPolarHBondContact O-CG 3.46Å; Q99-L103 PolarHBondContact O-N 3.21Å
100	Y	98.1	Very high	96.8	Very high	12 Å²	12	54.4 Å²	54.4	5%	0.047	26%	0.26	C	S	.	.	H	α-helix	trans	-58	-39.1	174.8	-179.5	-96.2	0	0	0	111.8	Q96 F98 N104 F108 L163 L204 E207 S212	Q96-Y100 WeakPolarHBondContact O-CB 3.08Å; Q96-Y100 PolarHBondContact O-N 3.02Å; F98-Y100 VanDerWaalsContact C-N 3.32Å; F98-Y100 PolarHBondContact O-N 2.89Å; Y100-N104 WeakPolarHBondContact O-CB 3.27Å; Y100-N104 PolarHBondContact O-N 3.24Å; Y100-N104 VanDerWaalsContact O-N 3.14Å; Y100-N104 PolarHBondContact O-ND2 2.61Å; Y100-F108 AromaticContact CD1-CE2 3.66Å; Y100-F108 HydrophobicContact CD1-CE2 3.66Å; Y100-F108 AromaticContact CD1-CZ 3.69Å; Y100-F108 HydrophobicContact CD1-CZ 3.69Å; Y100-F108 AromaticContact CE1-CE2 3.57Å; Y100-F108 HydrophobicContact CE1-CE2 3.57Å; Y100-F108 AromaticContact CE1-CZ 3.54Å; Y100-F108 HydrophobicContact CE1-CZ 3.54Å; Y100-L163 HydrophobicContact CE1-CD1 4.43Å; Y100-L204 HydrophobicContact CE2-CD1 3.94Å; Y100-L204 VanDerWaalsContact OH-CD1 3.27Å; Y100-L204 WeakPolarHBondContact OH-CD1 3.3Å; Y100-L204 PolarHBondContact OH-O 3.23Å; Y100-L204 VanDerWaalsContact OH-O 3.06Å; Y100-E207 HydrophobicContact CD2-CB 4.31Å; Y100-E207 HydrophobicContact CE2-CB 4Å; Y100-S212 WeakPolarHBondContact CB-OG 3.5Å
101	R	97.7	Very high	96.7	Very high	37 Å²	37	56.4 Å²	56.4	14%	0.14	27%	0.269	C	S	.	.	H	α-helix	trans	-68.6	-43.1	175.8	-72.5	170.3	173.1	66	5.4	112.3	Y97 F98 Q99 L103 N104 L105 F108 E167	Y97-R101 VanDerWaalsContact CE1-NH1 3.31Å; Y97-R101 VanDerWaalsContact CG-NH1 3.25Å; Y97-R101 PolarHBondContact O-NH1 3.45Å; Y97-R101 VanDerWaalsContact OH-CZ 3.28Å; Y97-R101 PolarHBondContact OH-NH2 3.04Å; F98-R101 WeakPolarHBondContact O-CB 3.33Å; F98-R101 PolarHBondContact O-N 3.33Å; F98-R101 VanDerWaalsContact O-N 3.08Å; Q99-R101 VanDerWaalsContact C-N 3.26Å; Q99-R101 PolarHBondContact O-N 3.2Å; R101-L103 VanDerWaalsContact C-N 3.31Å; R101-L103 PolarHBondContact O-N 3.38Å; R101-N104 CarbonylContact O-C 3.56Å; R101-N104 PolarHBondContact O-N 3.17Å; R101-L105 PolarHBondContact O-N 2.98Å; R101-F108 HydrophobicContact CB-CD2 4Å; R101-F108 HydrophobicContact CB-CE2 4.21Å; R101-F108 HydrophobicContact CB-CG 4.32Å; R101-F108 HydrophobicContact CG-CD1 3.93Å; R101-F108 HydrophobicContact CG-CD2 3.71Å; R101-F108 HydrophobicContact CG-CE1 3.85Å; R101-F108 HydrophobicContact CG-CE2 3.64Å; R101-F108 HydrophobicContact CG-CG 3.84Å; R101-F108 HydrophobicContact CG-CZ 3.68Å; R101-E167 IonicContact CZ-OE1 3.36Å; R101-E167 IonicContact NH2-OE1 3.49Å; R101-E167 PolarHBondContact NH2-OE1 3.35Å
102	Q	96.3	Very high	96.6	Very high	78 Å²	78	61.9 Å²	61.9	36%	0.364	29%	0.293	S	S	.	.	H	α-helix	trans	-65.2	-33.9	177.7	-70.2	178.2	-70.6	0	0	112.7	F98 Q99 L105	F98-Q102 WeakPolarHBondContact O-CG 3.45Å; F98-Q102 PolarHBondContact O-N 3.38Å; Q99-Q102 PolarHBondContact O-N 3.23Å; Q102-L105 WeakPolarHBondContact O-CG 3.47Å
103	L	96.7	Very high	96.5	Very high	130 Å²	130	56.8 Å²	56.8	68%	0.681	28%	0.278	S	S	*	.	H	α-helix	trans	-79.3	-21	177.6	-68.1	174.5	0	0	0	113	Q99 R101	Q99-L103 HydrophobicContact CG-CD1 3.94Å; Q99-L103 HydrophobicContact CG-CG 4.33Å; Q99-L103 WeakPolarHBondContact O-CB 3.44Å; Q99-L103 VanDerWaalsContact O-CG 3.32Å; Q99-L103 WeakPolarHBondContact O-CG 3.46Å; Q99-L103 PolarHBondContact O-N 3.21Å; R101-L103 VanDerWaalsContact C-N 3.31Å; R101-L103 PolarHBondContact O-N 3.38Å
104	N	96.8	Very high	96.2	Very high	42 Å²	42	61.1 Å²	61.1	23%	0.225	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.9	44.4	-175.8	-59.5	-76.4	0	0	0	111.8	Y100 R101 D106 M107 F108 L204	Y100-N104 WeakPolarHBondContact O-CB 3.27Å; Y100-N104 PolarHBondContact O-N 3.24Å; Y100-N104 VanDerWaalsContact O-N 3.14Å; Y100-N104 PolarHBondContact O-ND2 2.61Å; R101-N104 CarbonylContact O-C 3.56Å; R101-N104 PolarHBondContact O-N 3.17Å; N104-D106 PolarHBondContact O-N 3.02Å; N104-D106 VanDerWaalsContact O-N 3.09Å; N104-M107 HydrophobicContact CB-CB 4.42Å; N104-M107 HydrophobicContact CB-CG 4.28Å; N104-M107 HydrophobicContact CB-SD 4.07Å; N104-M107 WeakPolarHBondContact O-CB 3.47Å; N104-M107 PolarHBondContact O-N 3.11Å; N104-F108 HydrophobicContact CB-CD2 4.44Å; N104-F108 HydrophobicContact CB-CE2 4.28Å; N104-F108 WeakPolarHBondContact O-CD2 3.5Å; N104-L204 VanDerWaalsContact OD1-CD1 3.32Å; N104-L204 WeakPolarHBondContact OD1-CD1 3.47Å
105	L	95.1	Very high	96.1	Very high	118 Å²	118	62.2 Å²	62.2	62%	0.618	31%	0.306	S	S	*	.	H	α-helix	trans	-51.8	-37.7	-173.3	-70.5	172.6	0	0	0	113.6	R101 Q102 M107 F108 K109	R101-L105 PolarHBondContact O-N 2.98Å; Q102-L105 WeakPolarHBondContact O-CG 3.47Å; L105-M107 PolarHBondContact O-N 2.83Å; L105-F108 CarbonylContact O-C 3.59Å; L105-F108 PolarHBondContact O-N 3.14Å; L105-K109 PolarHBondContact O-N 2.92Å
106	D	92.6	Very high	95.9	Very high	147 Å²	147	66.5 Å²	66.5	79%	0.786	33%	0.334	S	S	*	.	H	α-helix	trans	-60.9	-32.7	179.1	-67.8	-32.1	0	0	0	112.7	N104 F108	N104-D106 PolarHBondContact O-N 3.02Å; N104-D106 VanDerWaalsContact O-N 3.09Å; D106-F108 VanDerWaalsContact C-N 3.33Å
107	M	94.8	Very high	95.7	Very high	8 Å²	8	64.7 Å²	64.7	4%	0.039	33%	0.328	C	S	.	.	H	α-helix	trans	-70.3	-30.6	174.9	-68.3	-174.3	62.3	0	0	112.9	N104 L105 T156 L159 R160 L163 L204	N104-M107 HydrophobicContact CB-CB 4.42Å; N104-M107 HydrophobicContact CB-CG 4.28Å; N104-M107 HydrophobicContact CB-SD 4.07Å; N104-M107 WeakPolarHBondContact O-CB 3.47Å; N104-M107 PolarHBondContact O-N 3.11Å; L105-M107 PolarHBondContact O-N 2.83Å; M107-T156 HydrophobicContact CE-CG2 4.45Å; M107-T156 HydrophobicContact CG-CG2 3.73Å; M107-T156 HydrophobicContact SD-CG2 4.41Å; M107-L159 HydrophobicContact CE-CB 4.33Å; M107-L159 HydrophobicContact CE-CD2 3.51Å; M107-L159 HydrophobicContact CE-CG 3.71Å; M107-R160 HydrophobicContact CB-CG 4.24Å; M107-R160 HydrophobicContact CE-CG 4.37Å; M107-R160 WeakPolarHBondContact O-CD 3.46Å; M107-R160 VanDerWaalsContact O-CG 3.31Å; M107-R160 WeakPolarHBondContact O-CG 3.43Å; M107-R160 PolarHBondContact O-NE 3.07Å; M107-L163 HydrophobicContact CE-CD1 4.07Å; M107-L204 HydrophobicContact CE-CD2 4.49Å; M107-L204 HydrophobicContact SD-CD1 3.91Å; M107-L204 HydrophobicContact SD-CD2 3.62Å; M107-L204 HydrophobicContact SD-CG 3.93Å
108	F	95.5	Very high	95.6	Very high	31 Å²	31	64 Å²	64	14%	0.136	33%	0.325	C	S	.	.	H	α-helix	trans	-105	1.9	-172.6	-64.2	-77.8	0	0	0	113.2	Y100 R101 N104 L105 D106 F111 L163	Y100-F108 AromaticContact CD1-CE2 3.66Å; Y100-F108 HydrophobicContact CD1-CE2 3.66Å; Y100-F108 AromaticContact CD1-CZ 3.69Å; Y100-F108 HydrophobicContact CD1-CZ 3.69Å; Y100-F108 AromaticContact CE1-CE2 3.57Å; Y100-F108 HydrophobicContact CE1-CE2 3.57Å; Y100-F108 AromaticContact CE1-CZ 3.54Å; Y100-F108 HydrophobicContact CE1-CZ 3.54Å; R101-F108 HydrophobicContact CB-CD2 4Å; R101-F108 HydrophobicContact CB-CE2 4.21Å; R101-F108 HydrophobicContact CB-CG 4.32Å; R101-F108 HydrophobicContact CG-CD1 3.93Å; R101-F108 HydrophobicContact CG-CD2 3.71Å; R101-F108 HydrophobicContact CG-CE1 3.85Å; R101-F108 HydrophobicContact CG-CE2 3.64Å; R101-F108 HydrophobicContact CG-CG 3.84Å; R101-F108 HydrophobicContact CG-CZ 3.68Å; N104-F108 HydrophobicContact CB-CD2 4.44Å; N104-F108 HydrophobicContact CB-CE2 4.28Å; N104-F108 WeakPolarHBondContact O-CD2 3.5Å; L105-F108 CarbonylContact O-C 3.59Å; L105-F108 PolarHBondContact O-N 3.14Å; D106-F108 VanDerWaalsContact C-N 3.33Å; F108-F111 HydrophobicContact CD1-CD1 4.39Å; F108-F111 HydrophobicContact CD1-CD2 4.01Å; F108-F111 HydrophobicContact CD1-CE1 4.45Å; F108-F111 HydrophobicContact CD1-CE2 4.08Å; F108-F111 HydrophobicContact CD1-CG 4.16Å; F108-F111 HydrophobicContact CD1-CZ 4.28Å; F108-F111 HydrophobicContact CE1-CE2 4.23Å; F108-F111 HydrophobicContact CE1-CZ 4.18Å; F108-F111 WeakPolarHBondContact O-CB 3.17Å; F108-L163 HydrophobicContact CE1-CD1 4.32Å; F108-L163 HydrophobicContact CZ-CD1 4.06Å
109	K	91.7	Very high	95.5	Very high	139 Å²	139	66 Å²	66	60%	0.604	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	135.1	168.3	-171.4	176	-178.7	179.6	0	109.4	L105 F111 R160	L105-K109 PolarHBondContact O-N 2.92Å; K109-F111 PolarHBondContact O-N 3.41Å; K109-F111 VanDerWaalsContact O-N 3.14Å; K109-R160 PolarHBondContact O-NH2 2.7Å
110	N	92.6	Very high	95.4	Very high	112 Å²	112	67.7 Å²	67.7	60%	0.599	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.3	42.9	-178.8	-62.2	-18.8	0	0	0	112.8	K112 D115	N110-K112 PolarHBondContact O-N 3.04Å; N110-D115 WeakPolarHBondContact O-CB 3.45Å
111	F	96.3	Very high	95.3	Very high	43 Å²	43	67.1 Å²	67.1	19%	0.189	34%	0.336	C	S	.	.			trans	-72.4	77.2	-174.2	-165.4	-110.7	0	0	0	112.1	F108 K109 I118 R160 L163 L164 E167	F108-F111 HydrophobicContact CD1-CD1 4.39Å; F108-F111 HydrophobicContact CD1-CD2 4.01Å; F108-F111 HydrophobicContact CD1-CE1 4.45Å; F108-F111 HydrophobicContact CD1-CE2 4.08Å; F108-F111 HydrophobicContact CD1-CG 4.16Å; F108-F111 HydrophobicContact CD1-CZ 4.28Å; F108-F111 HydrophobicContact CE1-CE2 4.23Å; F108-F111 HydrophobicContact CE1-CZ 4.18Å; F108-F111 WeakPolarHBondContact O-CB 3.17Å; K109-F111 PolarHBondContact O-N 3.41Å; K109-F111 VanDerWaalsContact O-N 3.14Å; F111-I118 HydrophobicContact CD2-CD1 4Å; F111-I118 HydrophobicContact CE2-CD1 4.36Å; F111-R160 HydrophobicContact CE2-CB 4.17Å; F111-R160 WeakPolarHBondContact CE2-O 3.25Å; F111-L163 HydrophobicContact CE2-CB 4.4Å; F111-L163 HydrophobicContact CZ-CB 3.82Å; F111-L164 HydrophobicContact CD1-CD1 3.82Å; F111-L164 HydrophobicContact CE1-CB 3.95Å; F111-L164 HydrophobicContact CE1-CD1 3.7Å; F111-L164 HydrophobicContact CE1-CG 4.46Å; F111-L164 HydrophobicContact CE2-CB 4.21Å; F111-L164 HydrophobicContact CZ-CB 3.7Å; F111-L164 HydrophobicContact CZ-CD1 4.31Å; F111-L164 VanDerWaalsContact CZ-N 3.31Å; F111-E167 HydrophobicContact CE1-CG 4.17Å
112	K	96.2	Very high	95.2	Very high	136 Å²	136	65.4 Å²	65.4	59%	0.591	33%	0.329	S	S	*	.	S	Bend	trans	-142.3	158.4	-176.5	-65.1	-175.3	178.9	-176.3	0	109.8	N110 D114 D115 I118	N110-K112 PolarHBondContact O-N 3.04Å; K112-D114 WeakPolarHBondContact CB-OD1 3.31Å; K112-D114 PolarHBondContact O-N 3.39Å; K112-D115 WeakPolarHBondContact O-CB 3.38Å; K112-D115 PolarHBondContact O-N 2.6Å; K112-I118 WeakPolarHBondContact O-CD1 3.35Å
113	A	95.8	Very high	95.1	Very high	18 Å²	18	62.3 Å²	62.3	15%	0.149	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-29.3	-176.7	0	0	0	0	0	112.9	D115 K119 L122 L164 L287 L288	A113-D115 VanDerWaalsContact C-N 3.34Å; A113-K119 WeakPolarHBondContact O-CA 3.47Å; A113-K119 WeakPolarHBondContact O-CB 3.38Å; A113-K119 PolarHBondContact O-N 3.41Å; A113-L122 HydrophobicContact CB-CD1 4.32Å; A113-L164 HydrophobicContact CB-CD2 4.06Å; A113-L287 HydrophobicContact CB-CB 4.1Å; A113-L288 HydrophobicContact CB-CD2 3.95Å; A113-L288 WeakPolarHBondContact O-CD2 3.39Å
114	D	93.1	Very high	95	Very high	94 Å²	94	56.8 Å²	56.8	50%	0.503	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-5.3	-179.3	64.3	-19.6	0	0	0	114.4	K112	K112-D114 WeakPolarHBondContact CB-OD1 3.31Å; K112-D114 PolarHBondContact O-N 3.39Å
115	D	96.1	Very high	94.9	Very high	22 Å²	22	54.8 Å²	54.8	12%	0.118	28%	0.275	C	S	.	.	S	Bend	trans	-57.3	132.1	170.6	173.3	-84.7	0	0	0	110.1	N110 K112 A113 G117 I118 K119 R160	N110-D115 WeakPolarHBondContact O-CB 3.45Å; K112-D115 WeakPolarHBondContact O-CB 3.38Å; K112-D115 PolarHBondContact O-N 2.6Å; A113-D115 VanDerWaalsContact C-N 3.34Å; D115-G117 VanDerWaalsContact C-N 3.25Å; D115-G117 PolarHBondContact O-N 2.91Å; D115-G117 VanDerWaalsContact O-N 3.1Å; D115-G117 PolarHBondContact OD1-N 3.11Å; D115-I118 HydrophobicContact CB-CB 4.13Å; D115-I118 HydrophobicContact CB-CD1 4.1Å; D115-I118 HydrophobicContact CB-CG1 4.22Å; D115-I118 PolarHBondContact O-N 3.06Å; D115-I118 VanDerWaalsContact O-N 3.14Å; D115-I118 PolarHBondContact OD1-N 2.96Å; D115-K119 WeakPolarHBondContact O-CB 3.33Å; D115-K119 PolarHBondContact O-N 3.13Å; D115-R160 IonicContact OD1-CZ 3.17Å; D115-R160 IonicContact OD1-NH1 2.7Å; D115-R160 PolarHBondContact OD1-NH1 3.15Å; D115-R160 IonicContact OD1-NH2 2.98Å; D115-R160 PolarHBondContact OD1-NH2 3.44Å; D115-R160 IonicContact OD2-CZ 3.64Å; D115-R160 IonicContact OD2-NH1 2.8Å; D115-R160 IonicContact OD2-NH2 3.48Å; D115-R160 PolarHBondContact OD2-NH2 2.96Å
116	P	94.5	Very high	94.9	Very high	94 Å²	94	49.4 Å²	49.4	61%	0.61	25%	0.247	S	C	*	.	H	α-helix	trans	-56.1	-34.9	-172.3	-28.8	35.2	0	0	0	115.1	R120	P116-R120 VanDerWaalsContact O-CB 3.28Å; P116-R120 WeakPolarHBondContact O-CB 3.34Å; P116-R120 PolarHBondContact O-N 3.31Å
117	G	95.1	Very high	95.2	Very high	9 Å²	9	42.5 Å²	42.5	9%	0.093	21%	0.21	C	C	.	.	H	α-helix	trans	-75.3	-46.3	178.8	0	0	0	0	0	111.6	D115 A121	D115-G117 VanDerWaalsContact C-N 3.25Å; D115-G117 PolarHBondContact O-N 2.91Å; D115-G117 VanDerWaalsContact O-N 3.1Å; D115-G117 PolarHBondContact OD1-N 3.11Å; G117-A121 WeakPolarHBondContact O-CB 3.31Å; G117-A121 PolarHBondContact O-N 2.91Å
118	I	97.1	Very high	95.3	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64.4	-49.5	177.5	-65	175.2	0	0	0	110.8	F111 K112 D115 R120 A121 L122 R160 A161 L164	F111-I118 HydrophobicContact CD2-CD1 4Å; F111-I118 HydrophobicContact CE2-CD1 4.36Å; K112-I118 WeakPolarHBondContact O-CD1 3.35Å; D115-I118 HydrophobicContact CB-CB 4.13Å; D115-I118 HydrophobicContact CB-CD1 4.1Å; D115-I118 HydrophobicContact CB-CG1 4.22Å; D115-I118 PolarHBondContact O-N 3.06Å; D115-I118 VanDerWaalsContact O-N 3.14Å; D115-I118 PolarHBondContact OD1-N 2.96Å; I118-R120 VanDerWaalsContact C-N 3.29Å; I118-R120 PolarHBondContact O-N 3.38Å; I118-A121 PolarHBondContact O-N 3.18Å; I118-L122 HydrophobicContact CG2-CD1 3.79Å; I118-L122 HydrophobicContact CG2-CG 4.2Å; I118-L122 WeakPolarHBondContact O-CG 3.44Å; I118-L122 PolarHBondContact O-N 3.28Å; I118-R160 HydrophobicContact CD1-CB 3.99Å; I118-R160 HydrophobicContact CG1-CB 3.76Å; I118-A161 HydrophobicContact CG2-CB 4.12Å; I118-L164 HydrophobicContact CD1-CD2 4.45Å; I118-L164 HydrophobicContact CG2-CD2 3.67Å
119	K	95.7	Very high	95.5	Very high	52 Å²	52	40.8 Å²	40.8	23%	0.226	20%	0.203	C	C	.	.	H	α-helix	trans	-53.5	-47.5	178.5	-177.3	168.8	-174.9	170.4	0	111.2	A113 D115 L122 I123 L288 D291	A113-K119 WeakPolarHBondContact O-CA 3.47Å; A113-K119 WeakPolarHBondContact O-CB 3.38Å; A113-K119 PolarHBondContact O-N 3.41Å; D115-K119 WeakPolarHBondContact O-CB 3.33Å; D115-K119 PolarHBondContact O-N 3.13Å; K119-L122 PolarHBondContact O-N 3.23Å; K119-I123 HydrophobicContact CG-CD1 3.87Å; K119-I123 VanDerWaalsContact O-CG1 3.27Å; K119-I123 WeakPolarHBondContact O-CG1 3.28Å; K119-I123 PolarHBondContact O-N 3.16Å; K119-L288 HydrophobicContact CD-CD1 4.45Å; K119-L288 HydrophobicContact CD-CD2 4.13Å; K119-L288 HydrophobicContact CG-CD1 3.9Å; K119-L288 HydrophobicContact CG-CD2 4.03Å; K119-D291 PolarHBondContact NZ-O 3Å
120	R	94.9	Very high	95.8	Very high	100 Å²	100	34.6 Å²	34.6	38%	0.377	18%	0.176	S	C	.	.	H	α-helix	trans	-65.9	-44.3	179.5	-170.3	-178.6	-59.2	144.9	5.2	112	P116 I118 L122 I123 D124 R152 N153	P116-R120 VanDerWaalsContact O-CB 3.28Å; P116-R120 WeakPolarHBondContact O-CB 3.34Å; P116-R120 PolarHBondContact O-N 3.31Å; I118-R120 VanDerWaalsContact C-N 3.29Å; I118-R120 PolarHBondContact O-N 3.38Å; R120-L122 VanDerWaalsContact C-N 3.34Å; R120-L122 PolarHBondContact O-N 3.43Å; R120-I123 PolarHBondContact O-N 3.46Å; R120-D124 WeakPolarHBondContact O-CB 3.32Å; R120-D124 VanDerWaalsContact O-CG 3.26Å; R120-D124 PolarHBondContact O-N 3.5Å; R120-R152 WeakPolarHBondContact CD-O 3.48Å; R120-R152 PolarHBondContact NH1-O 3.14Å; R120-N153 WeakPolarHBondContact CB-OD1 3.46Å; R120-N153 WeakPolarHBondContact CD-OD1 3.3Å; R120-N153 VanDerWaalsContact CG-OD1 3.25Å; R120-N153 WeakPolarHBondContact CG-OD1 3.5Å
121	A	96.4	Very high	95.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60	-43.9	175.8	0	0	0	0	0	111.8	G117 I118 D124 G125 F126 N153 I158 A161	G117-A121 WeakPolarHBondContact O-CB 3.31Å; G117-A121 PolarHBondContact O-N 2.91Å; I118-A121 PolarHBondContact O-N 3.18Å; A121-D124 CarbonylContact O-C 3.55Å; A121-D124 PolarHBondContact O-N 3.13Å; A121-G125 PolarHBondContact O-N 3.48Å; A121-F126 CarbonylContact C-O 3.53Å; A121-F126 HydrophobicContact CB-CB 4.34Å; A121-F126 WeakPolarHBondContact O-CA 3.32Å; A121-F126 WeakPolarHBondContact O-CB 3.47Å; A121-F126 PolarHBondContact O-N 2.87Å; A121-N153 PolarHBondContact N-OD1 3.36Å; A121-I158 HydrophobicContact CB-CG1 4.3Å; A121-A161 HydrophobicContact CB-CB 3.83Å
122	L	96.4	Very high	95.8	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61	-47.2	176.4	-70.3	171.7	0	0	0	112	A113 I118 K119 R120 D124 G125 A161 A284 L287	A113-L122 HydrophobicContact CB-CD1 4.32Å; I118-L122 HydrophobicContact CG2-CD1 3.79Å; I118-L122 HydrophobicContact CG2-CG 4.2Å; I118-L122 WeakPolarHBondContact O-CG 3.44Å; I118-L122 PolarHBondContact O-N 3.28Å; K119-L122 PolarHBondContact O-N 3.23Å; R120-L122 VanDerWaalsContact C-N 3.34Å; R120-L122 PolarHBondContact O-N 3.43Å; L122-D124 VanDerWaalsContact C-N 3.28Å; L122-D124 PolarHBondContact O-N 2.86Å; L122-G125 PolarHBondContact O-N 2.82Å; L122-A161 HydrophobicContact CD2-CB 4.13Å; L122-A161 HydrophobicContact CG-CB 4.16Å; L122-A284 HydrophobicContact CB-CB 4.03Å; L122-L287 HydrophobicContact CD1-CB 4.4Å; L122-L287 HydrophobicContact CD1-CD1 3.78Å; L122-L287 HydrophobicContact CD2-CD1 3.9Å
123	I	93.8	Very high	95.9	Very high	14 Å²	14	36 Å²	36	7%	0.072	18%	0.181	C	C	.	.	H	α-helix	trans	-62.3	-37.1	177.7	-69.2	167	0	0	0	111.4	K119 R120 G125 A284 L288 Y292 N296	K119-I123 HydrophobicContact CG-CD1 3.87Å; K119-I123 VanDerWaalsContact O-CG1 3.27Å; K119-I123 WeakPolarHBondContact O-CG1 3.28Å; K119-I123 PolarHBondContact O-N 3.16Å; R120-I123 PolarHBondContact O-N 3.46Å; I123-G125 PolarHBondContact O-N 2.94Å; I123-A284 HydrophobicContact CG1-CB 4.15Å; I123-L288 HydrophobicContact CG1-CD1 4.34Å; I123-Y292 HydrophobicContact CG1-CD2 4.48Å; I123-Y292 HydrophobicContact CG1-CE2 4.19Å; I123-N296 HydrophobicContact CG2-CB 4.19Å
124	D	93.5	Very high	95.9	Very high	13 Å²	13	35.4 Å²	35.4	7%	0.07	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	4.1	176.8	-66.3	-11.9	0	0	0	112.6	R120 A121 L122 F126 R152 N153	R120-D124 WeakPolarHBondContact O-CB 3.32Å; R120-D124 VanDerWaalsContact O-CG 3.26Å; R120-D124 PolarHBondContact O-N 3.5Å; A121-D124 CarbonylContact O-C 3.55Å; A121-D124 PolarHBondContact O-N 3.13Å; L122-D124 VanDerWaalsContact C-N 3.28Å; L122-D124 PolarHBondContact O-N 2.86Å; D124-F126 HydrophobicContact CB-CD2 4.2Å; D124-R152 IonicContact OD1-CZ 2.82Å; D124-R152 IonicContact OD1-NE 3.48Å; D124-R152 IonicContact OD1-NH2 3.12Å; D124-R152 PolarHBondContact OD1-NH2 3.25Å; D124-R152 IonicContact OD2-CZ 2.87Å; D124-R152 IonicContact OD2-NE 3.73Å; D124-R152 PolarHBondContact OD2-NE 3.49Å; D124-R152 IonicContact OD2-NH2 3.71Å; D124-R152 PolarHBondContact OD2-NH2 2.82Å; D124-N153 PolarHBondContact OD2-ND2 3.26Å
125	G	94.8	Very high	96	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.7	23.5	174.7	0	0	0	0	0	114.9	A121 L122 I123 P127 G128	A121-G125 PolarHBondContact O-N 3.48Å; L122-G125 PolarHBondContact O-N 2.82Å; I123-G125 PolarHBondContact O-N 2.94Å; G125-P127 CarbonylContact O-C 3.54Å; G125-G128 PolarHBondContact O-N 2.99Å
126	F	96.1	Very high	96	Very high	6 Å²	6	38.6 Å²	38.6	3%	0.026	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.2	106.5	-178.9	-66.4	-65.1	0	0	0	113.3	A121 D124 L143 F144 N147 W148 I158 A161	A121-F126 CarbonylContact C-O 3.53Å; A121-F126 HydrophobicContact CB-CB 4.34Å; A121-F126 WeakPolarHBondContact O-CA 3.32Å; A121-F126 WeakPolarHBondContact O-CB 3.47Å; A121-F126 PolarHBondContact O-N 2.87Å; D124-F126 HydrophobicContact CB-CD2 4.2Å; F126-L143 HydrophobicContact CD1-CD2 3.92Å; F126-F144 WeakPolarHBondContact CE1-O 3.4Å; F126-F144 WeakPolarHBondContact CZ-O 3.45Å; F126-N147 HydrophobicContact CE2-CB 3.83Å; F126-N147 HydrophobicContact CZ-CB 3.63Å; F126-W148 HydrophobicContact CE2-CB 4.22Å; F126-W148 HydrophobicContact CZ-CB 3.88Å; F126-I158 HydrophobicContact CB-CB 4.48Å; F126-I158 HydrophobicContact CB-CG1 4.05Å; F126-I158 HydrophobicContact CB-CG2 4.04Å; F126-I158 HydrophobicContact CD1-CG2 4.32Å; F126-I158 HydrophobicContact CD2-CD1 4.01Å; F126-I158 HydrophobicContact CD2-CG1 4.11Å; F126-I158 HydrophobicContact CE2-CD1 4.23Å; F126-I158 HydrophobicContact CG-CD1 4.15Å; F126-I158 HydrophobicContact CG-CG1 4.04Å; F126-I158 HydrophobicContact CG-CG2 4.26Å; F126-A161 VanDerWaalsContact O-CB 3.22Å; F126-A161 WeakPolarHBondContact O-CB 3.29Å
127	P	97.8	Very high	96.2	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.006	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	cis	-78.1	159.3	-15.8	34.8	-33.8	0	0	0	111.7	G125 V129 L141 L143 I162 S165	G125-P127 CarbonylContact O-C 3.54Å; P127-V129 HydrophobicContact CG-CG2 4.45Å; P127-L141 HydrophobicContact CB-CD2 4.36Å; P127-L141 HydrophobicContact CG-CD2 4.31Å; P127-L143 HydrophobicContact CB-CD2 3.89Å; P127-I162 HydrophobicContact CB-CG1 4.14Å; P127-I162 HydrophobicContact CG-CG1 4.1Å; P127-S165 WeakPolarHBondContact CD-OG 3.25Å; P127-S165 WeakPolarHBondContact CG-OG 3.25Å
128	G	98.1	Very high	96.3	Very high	0 Å²	0	36 Å²	36	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	147.4	154.6	0	0	0	0	0	110	G125 L141 L142 Y278	G125-G128 PolarHBondContact O-N 2.99Å; G128-L141 CarbonylContact O-C 3.5Å; G128-L141 WeakPolarHBondContact O-CA 3.43Å; G128-L142 PolarHBondContact N-O 2.69Å; G128-L142 PolarHBondContact O-N 3.43Å; G128-Y278 VanDerWaalsContact CA-OH 3.32Å; G128-Y278 WeakPolarHBondContact CA-OH 3.46Å
129	V	98.4	Very high	96.4	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.024	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	124.5	174.9	179.7	0	0	0	0	108.4	P127 K139 L141 L169 Y278 W283	P127-V129 HydrophobicContact CG-CG2 4.45Å; V129-K139 HydrophobicContact CG1-CD 4.34Å; V129-K139 VanDerWaalsContact CG1-CE 3.43Å; V129-K139 HydrophobicContact CG1-CG 4.16Å; V129-L141 HydrophobicContact CG2-CG 4.35Å; V129-L169 HydrophobicContact CG1-CD1 4.16Å; V129-L169 HydrophobicContact CG1-CD2 4.25Å; V129-L169 HydrophobicContact CG2-CD1 4.21Å; V129-Y278 PolarHBondContact N-OH 3.29Å; V129-Y278 WeakPolarHBondContact O-CE2 3.23Å; V129-Y278 PolarHBondContact O-OH 3.2Å; V129-W283 HydrophobicContact CB-CB 4.18Å; V129-W283 HydrophobicContact CB-CD2 3.65Å; V129-W283 HydrophobicContact CB-CE3 3.73Å; V129-W283 HydrophobicContact CB-CG 3.84Å; V129-W283 HydrophobicContact CB-CZ3 4.38Å; V129-W283 HydrophobicContact CG1-CD2 4.37Å; V129-W283 HydrophobicContact CG1-CE3 4.06Å; V129-W283 HydrophobicContact CG1-CZ3 4.24Å; V129-W283 HydrophobicContact CG2-CB 4.3Å; V129-W283 HydrophobicContact CG2-CD2 3.46Å; V129-W283 VanDerWaalsContact CG2-CD2 3.46Å; V129-W283 HydrophobicContact CG2-CE3 4Å; V129-W283 HydrophobicContact CG2-CG 3.57Å; V129-W283 HydrophobicContact CG2-CZ2 4.19Å
130	L	98.1	Very high	96.5	Very high	8 Å²	8	34.8 Å²	34.8	4%	0.042	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	140.1	174.3	-64.6	-171.7	0	0	0	110.7	K139 I140 L142 F266 P268 Y278	L130-K139 WeakPolarHBondContact O-CE 3.48Å; L130-K139 PolarHBondContact O-NZ 3.35Å; L130-I140 HydrophobicContact CB-CB 4.24Å; L130-I140 HydrophobicContact CD1-CB 3.87Å; L130-I140 HydrophobicContact CD1-CD1 3.9Å; L130-I140 HydrophobicContact CD1-CG2 3.82Å; L130-I140 HydrophobicContact CG-CB 4.17Å; L130-I140 HydrophobicContact CG-CG2 4.26Å; L130-I140 PolarHBondContact N-O 3.33Å; L130-L142 HydrophobicContact CD2-CD1 3.64Å; L130-L142 HydrophobicContact CD2-CG 4.4Å; L130-L142 HydrophobicContact CG-CD1 4.04Å; L130-L142 HydrophobicContact CG-CG 4.27Å; L130-F266 VanDerWaalsContact CD1-O 3.29Å; L130-F266 WeakPolarHBondContact CD1-O 3.23Å; L130-P268 HydrophobicContact CD1-CG 4.28Å; L130-P268 HydrophobicContact CD2-CG 3.68Å; L130-Y278 HydrophobicContact CD2-CD2 3.48Å; L130-Y278 VanDerWaalsContact CD2-CD2 3.48Å; L130-Y278 HydrophobicContact CD2-CE2 3.72Å; L130-Y278 HydrophobicContact CD2-CG 4.49Å
131	E	95.1	Very high	96.7	Very high	165 Å²	165	30.1 Å²	30.1	77%	0.771	14%	0.14	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-61.8	-48.1	176.5	-174.7	174.8	-175.4	0	0	110.8	K139	E131-K139 PolarHBondContact O-NZ 2.94Å
132	N	95.1	Very high	96.8	Very high	82 Å²	82	30.1 Å²	30.1	44%	0.439	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	152.1	179.5	-63.9	-30	0	0	0	112.3
133	R	97.4	Very high	96.9	Very high	73 Å²	73	31.1 Å²	31.1	28%	0.275	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	158.7	167.7	-62.8	169.4	-179.1	-178.8	6.3	109.1	G137 R138 K139 D172 E174 F266	R133-G137 WeakPolarHBondContact CD-O 3.26Å; R133-R138 CarbonylContact C-O 3.6Å; R133-R138 WeakPolarHBondContact CA-O 3.35Å; R133-R138 WeakPolarHBondContact CB-O 3.47Å; R133-K139 HydrophobicContact CG-CD 4.39Å; R133-D172 IonicContact CZ-OD2 3.98Å; R133-D172 IonicContact NH2-OD1 3.39Å; R133-D172 PolarHBondContact NH2-OD1 3.26Å; R133-D172 IonicContact NH2-OD2 3.46Å; R133-D172 PolarHBondContact NH2-OD2 2.86Å; R133-E174 IonicContact NH1-OE2 3.84Å; R133-E174 PolarHBondContact NH1-OE2 2.92Å; R133-E174 VanDerWaalsContact NH2-CB 3.29Å; R133-F266 WeakPolarHBondContact O-CD1 3.41Å
134	D	97.3	Very high	97.1	Very high	6 Å²	6	30.5 Å²	30.5	3%	0.032	14%	0.142	C	C	.	.			trans	-73.8	-179.6	173.2	78.6	-4.1	0	0	0	112.9	Y136 G137 R138 I140 I262	D134-Y136 PolarHBondContact O-N 3.4Å; D134-Y136 WeakPolarHBondContact OD1-CA 3.33Å; D134-Y136 WeakPolarHBondContact OD1-CB 3.43Å; D134-Y136 PolarHBondContact OD1-N 2.65Å; D134-G137 PolarHBondContact O-N 3.12Å; D134-G137 PolarHBondContact OD1-N 2.95Å; D134-R138 PolarHBondContact N-O 3.39Å; D134-R138 WeakPolarHBondContact OD1-CB 3.2Å; D134-R138 PolarHBondContact OD1-N 2.82Å; D134-R138 IonicContact OD1-NE 3.59Å; D134-R138 IonicContact OD2-CZ 3.57Å; D134-R138 IonicContact OD2-NE 3.74Å; D134-R138 PolarHBondContact OD2-NE 2.94Å; D134-R138 IonicContact OD2-NH2 3.6Å; D134-R138 PolarHBondContact OD2-NH2 2.98Å; D134-I140 HydrophobicContact CB-CD1 4.03Å; D134-I140 HydrophobicContact CB-CG1 4.34Å; D134-I262 HydrophobicContact CB-CG2 4.41Å
135	H	95.3	Very high	97.1	Very high	58 Å²	58	30.4 Å²	30.4	27%	0.269	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-7.9	179	59	-69.9	0	0	0	115.2	L261 H263 F266	H135-L261 PolarHBondContact CE1-O 3.37Å; H135-H263 AromaticContact CD2-CE1 3.91Å; H135-H263 AromaticContact CD2-NE2 3.71Å; H135-H263 AromaticContact CE1-CD2 3.73Å; H135-H263 AromaticContact CE1-NE2 3.98Å; H135-H263 AromaticContact CG-CE1 3.96Å; H135-H263 AromaticContact ND1-CD2 3.92Å; H135-H263 AromaticContact ND1-CG 3.98Å; H135-H263 AromaticContact NE2-CD2 3.87Å; H135-H263 AromaticContact NE2-NE2 3.66Å; H135-F266 HydrophobicContact CB-CD2 4.46Å; H135-F266 HydrophobicContact CB-CE2 3.63Å; H135-F266 HydrophobicContact CB-CZ 4.07Å
136	Y	96.1	Very high	97.1	Very high	126 Å²	126	31.8 Å²	31.8	49%	0.494	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	8.3	172.4	-63.5	-66.1	0	0	0	113.2	K37 D134 R138 N178	K37-Y136 PolarHBondContact NZ-O 3.3Å; D134-Y136 PolarHBondContact O-N 3.4Å; D134-Y136 WeakPolarHBondContact OD1-CA 3.33Å; D134-Y136 WeakPolarHBondContact OD1-CB 3.43Å; D134-Y136 PolarHBondContact OD1-N 2.65Å; Y136-R138 VanDerWaalsContact C-N 3.31Å; Y136-N178 PolarHBondContact O-OD1 3.19Å
137	G	97.3	Very high	96.9	Very high	16 Å²	16	33 Å²	33	17%	0.165	16%	0.161	C	C	.	.	S	Bend	trans	75.8	15.5	-177.6	0	0	0	0	0	113.8	R133 D134 N178	R133-G137 WeakPolarHBondContact CD-O 3.26Å; D134-G137 PolarHBondContact O-N 3.12Å; D134-G137 PolarHBondContact OD1-N 2.95Å; G137-N178 WeakPolarHBondContact O-CB 3.44Å
138	R	98.4	Very high	96.8	Very high	31 Å²	31	33.9 Å²	33.9	12%	0.117	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-84.2	142.1	-178.9	-56.7	178.7	-67.2	-171.7	7.2	110.6	R133 D134 Y136 N178 G179 I181	R133-R138 CarbonylContact C-O 3.6Å; R133-R138 WeakPolarHBondContact CA-O 3.35Å; R133-R138 WeakPolarHBondContact CB-O 3.47Å; D134-R138 PolarHBondContact N-O 3.39Å; D134-R138 WeakPolarHBondContact OD1-CB 3.2Å; D134-R138 PolarHBondContact OD1-N 2.82Å; D134-R138 IonicContact OD1-NE 3.59Å; D134-R138 IonicContact OD2-CZ 3.57Å; D134-R138 IonicContact OD2-NE 3.74Å; D134-R138 PolarHBondContact OD2-NE 2.94Å; D134-R138 IonicContact OD2-NH2 3.6Å; D134-R138 PolarHBondContact OD2-NH2 2.98Å; Y136-R138 VanDerWaalsContact C-N 3.31Å; R138-N178 WeakPolarHBondContact CG-O 3.25Å; R138-G179 VanDerWaalsContact CA-O 3.26Å; R138-G179 WeakPolarHBondContact CA-O 3.34Å; R138-I181 HydrophobicContact CB-CG1 4.15Å
139	K	98.6	Very high	96.5	Very high	27 Å²	27	37.1 Å²	37.1	12%	0.117	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	132.7	172.6	-162.6	66.6	164.1	175.8	0	110.4	V129 L130 E131 R133 L169 L175 G179 F180 I181	V129-K139 HydrophobicContact CG1-CD 4.34Å; V129-K139 VanDerWaalsContact CG1-CE 3.43Å; V129-K139 HydrophobicContact CG1-CG 4.16Å; L130-K139 WeakPolarHBondContact O-CE 3.48Å; L130-K139 PolarHBondContact O-NZ 3.35Å; E131-K139 PolarHBondContact O-NZ 2.94Å; R133-K139 HydrophobicContact CG-CD 4.39Å; K139-L169 HydrophobicContact CG-CD1 4.24Å; K139-L169 HydrophobicContact CG-CD2 4.17Å; K139-L175 HydrophobicContact CB-CD1 3.8Å; K139-L175 HydrophobicContact CB-CD2 3.84Å; K139-L175 HydrophobicContact CB-CG 4.49Å; K139-L175 HydrophobicContact CD-CD1 4.43Å; K139-L175 HydrophobicContact CG-CD1 4.13Å; K139-G179 PolarHBondContact N-O 3.21Å; K139-F180 HydrophobicContact CB-CD1 3.81Å; K139-F180 HydrophobicContact CB-CE1 4.05Å; K139-F180 CarbonylContact O-C 3.54Å; K139-F180 VanDerWaalsContact O-CA 3.29Å; K139-F180 WeakPolarHBondContact O-CA 3.37Å; K139-I181 PolarHBondContact O-N 2.84Å
140	I	98.7	Very high	96	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	121.2	-178.7	-55.6	167.8	0	0	0	109.4	L130 D134 L142 I181 I183 I262 F266 L267	L130-I140 HydrophobicContact CB-CB 4.24Å; L130-I140 HydrophobicContact CD1-CB 3.87Å; L130-I140 HydrophobicContact CD1-CD1 3.9Å; L130-I140 HydrophobicContact CD1-CG2 3.82Å; L130-I140 HydrophobicContact CG-CB 4.17Å; L130-I140 HydrophobicContact CG-CG2 4.26Å; L130-I140 PolarHBondContact N-O 3.33Å; D134-I140 HydrophobicContact CB-CD1 4.03Å; D134-I140 HydrophobicContact CB-CG1 4.34Å; I140-L142 HydrophobicContact CG2-CD2 3.87Å; I140-I181 HydrophobicContact CG1-CB 4.32Å; I140-I181 HydrophobicContact CG2-CG2 4.37Å; I140-I183 HydrophobicContact CG2-CD1 3.8Å; I140-I183 HydrophobicContact CG2-CG1 4.12Å; I140-I262 HydrophobicContact CD1-CG2 4.23Å; I140-F266 HydrophobicContact CD1-CB 4.2Å; I140-L267 HydrophobicContact CD1-CD2 4.44Å
141	L	98.7	Very high	95.6	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	141.9	170.5	-75	74.5	0	0	0	109.5	P127 G128 V129 L166 L169 F180 I181 L182 I183	P127-L141 HydrophobicContact CB-CD2 4.36Å; P127-L141 HydrophobicContact CG-CD2 4.31Å; G128-L141 CarbonylContact O-C 3.5Å; G128-L141 WeakPolarHBondContact O-CA 3.43Å; V129-L141 HydrophobicContact CG2-CG 4.35Å; L141-L166 HydrophobicContact CD1-CD2 4.46Å; L141-L166 HydrophobicContact CD2-CD2 3.9Å; L141-L166 HydrophobicContact CD2-CG 4.32Å; L141-L169 HydrophobicContact CD1-CD1 4.2Å; L141-F180 HydrophobicContact CD1-CB 4.45Å; L141-F180 HydrophobicContact CD1-CD1 3.71Å; L141-I181 PolarHBondContact N-O 3.04Å; L141-L182 HydrophobicContact CB-CD1 3.87Å; L141-I183 PolarHBondContact O-N 3.39Å
142	L	98.6	Very high	95.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	138.9	-178.6	-55.7	-179.1	0	0	0	110.4	G128 L130 I140 F144 I183 P268 F271 Y278	G128-L142 PolarHBondContact N-O 2.69Å; G128-L142 PolarHBondContact O-N 3.43Å; L130-L142 HydrophobicContact CD2-CD1 3.64Å; L130-L142 HydrophobicContact CD2-CG 4.4Å; L130-L142 HydrophobicContact CG-CD1 4.04Å; L130-L142 HydrophobicContact CG-CG 4.27Å; I140-L142 HydrophobicContact CG2-CD2 3.87Å; L142-F144 HydrophobicContact CB-CD2 4.48Å; L142-F144 HydrophobicContact CB-CE2 3.95Å; L142-F144 HydrophobicContact CD1-CE2 4.01Å; L142-F144 HydrophobicContact CD1-CZ 4.22Å; L142-I183 CarbonylContact C-O 3.6Å; L142-I183 WeakPolarHBondContact CA-O 3.29Å; L142-I183 HydrophobicContact CD2-CB 3.88Å; L142-I183 HydrophobicContact CD2-CD1 4.06Å; L142-I183 HydrophobicContact CD2-CG1 4.26Å; L142-P268 HydrophobicContact CD1-CG 4.16Å; L142-F271 HydrophobicContact CD1-CE2 3.94Å; L142-F271 HydrophobicContact CD2-CD2 4.43Å; L142-F271 HydrophobicContact CD2-CE2 3.68Å; L142-F271 HydrophobicContact CD2-CZ 4Å; L142-F271 HydrophobicContact CG-CE2 4.36Å; L142-Y278 HydrophobicContact CD1-CD1 4.13Å; L142-Y278 HydrophobicContact CD1-CD2 3.94Å; L142-Y278 HydrophobicContact CD1-CE2 4.41Å; L142-Y278 HydrophobicContact CD1-CG 3.8Å
143	L	98.1	Very high	95	Very high	21 Å²	21	35.9 Å²	35.9	11%	0.11	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	111.2	169.2	-62.8	178.2	0	0	0	109	F126 P127 A145 I162 L182 I183 I184 D185	F126-L143 HydrophobicContact CD1-CD2 3.92Å; P127-L143 HydrophobicContact CB-CD2 3.89Å; L143-A145 PolarHBondContact O-N 2.62Å; L143-I162 HydrophobicContact CD1-CD1 4.14Å; L143-I162 HydrophobicContact CD2-CD1 3.98Å; L143-I162 HydrophobicContact CD2-CG1 4.35Å; L143-L182 HydrophobicContact CD1-CD1 3.88Å; L143-L182 HydrophobicContact CD1-CD2 4.32Å; L143-L182 HydrophobicContact CG-CD1 3.89Å; L143-I183 PolarHBondContact N-O 2.78Å; L143-I184 HydrophobicContact CB-CB 4.49Å; L143-I184 HydrophobicContact CB-CG1 4.35Å; L143-I184 HydrophobicContact CB-CG2 4.14Å; L143-I184 HydrophobicContact CD1-CD1 4.32Å; L143-I184 HydrophobicContact CD1-CG1 4.18Å; L143-I184 CarbonylContact O-C 3.47Å; L143-I184 WeakPolarHBondContact O-CA 3.31Å; L143-D185 PolarHBondContact O-N 2.94Å
144	F	97.1	Very high	94.9	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.009	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	93.2	171.4	-64.3	-88.1	0	0	0	108.6	F126 L142 A146 N147 D185 E270 F271 Y278 M280 Y303	F126-F144 WeakPolarHBondContact CE1-O 3.4Å; F126-F144 WeakPolarHBondContact CZ-O 3.45Å; L142-F144 HydrophobicContact CB-CD2 4.48Å; L142-F144 HydrophobicContact CB-CE2 3.95Å; L142-F144 HydrophobicContact CD1-CE2 4.01Å; L142-F144 HydrophobicContact CD1-CZ 4.22Å; F144-A146 PolarHBondContact O-N 3.39Å; F144-A146 VanDerWaalsContact O-N 3.14Å; F144-N147 WeakPolarHBondContact O-CB 3.38Å; F144-N147 PolarHBondContact O-N 2.8Å; F144-D185 HydrophobicContact CD1-CB 3.93Å; F144-D185 HydrophobicContact CE1-CB 4.4Å; F144-E270 HydrophobicContact CE1-CB 4.13Å; F144-E270 HydrophobicContact CE1-CG 4.07Å; F144-E270 HydrophobicContact CZ-CG 4.4Å; F144-F271 HydrophobicContact CE1-CE2 4.06Å; F144-F271 AromaticContact CE1-CZ 3.76Å; F144-F271 HydrophobicContact CE1-CZ 3.76Å; F144-F271 AromaticContact CZ-CE2 3.74Å; F144-F271 HydrophobicContact CZ-CE2 3.74Å; F144-F271 AromaticContact CZ-CZ 3.8Å; F144-F271 HydrophobicContact CZ-CZ 3.8Å; F144-Y278 AromaticContact CE2-CD1 3.87Å; F144-Y278 HydrophobicContact CE2-CD1 3.87Å; F144-Y278 HydrophobicContact CE2-CG 4.41Å; F144-M280 HydrophobicContact CB-CE 4.48Å; F144-M280 HydrophobicContact CD1-CE 4.15Å; F144-M280 HydrophobicContact CD2-CE 3.36Å; F144-M280 HydrophobicContact CD2-SD 3.5Å; F144-M280 WeakPolarHBondContact CD2-SD 3.38Å; F144-M280 HydrophobicContact CE1-CE 4.18Å; F144-M280 HydrophobicContact CE2-CE 3.4Å; F144-M280 HydrophobicContact CE2-SD 3.76Å; F144-M280 HydrophobicContact CG-CE 3.75Å; F144-M280 HydrophobicContact CG-SD 4.27Å; F144-M280 HydrophobicContact CZ-CE 3.8Å; F144-Y303 AromaticContact CD1-CE2 3.77Å; F144-Y303 HydrophobicContact CD1-CE2 3.77Å; F144-Y303 HydrophobicContact CE1-CE2 4.12Å
145	A	95.1	Very high	94.7	Very high	10 Å²	10	36.7 Å²	36.7	8%	0.083	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-61.1	-30.2	-167.1	0	0	0	0	0	113.1	L143 N147 W148 D185 W186 F189	L143-A145 PolarHBondContact O-N 2.62Å; A145-N147 PolarHBondContact O-N 2.8Å; A145-W148 WeakPolarHBondContact O-CB 3.45Å; A145-W148 PolarHBondContact O-N 3.2Å; A145-D185 VanDerWaalsContact CB-O 3.24Å; A145-D185 WeakPolarHBondContact CB-O 3.38Å; A145-D185 PolarHBondContact N-O 3.13Å; A145-W186 HydrophobicContact CB-CD2 4.44Å; A145-W186 HydrophobicContact CB-CE3 4.11Å; A145-W186 HydrophobicContact CB-CZ3 4.49Å; A145-F189 HydrophobicContact CB-CB 4.35Å; A145-F189 HydrophobicContact CB-CD2 3.53Å; A145-F189 HydrophobicContact CB-CE2 4Å; A145-F189 HydrophobicContact CB-CG 4.14Å; A145-F189 WeakPolarHBondContact O-CD2 3.46Å
146	A	93.6	Very high	94.8	Very high	29 Å²	29	36 Å²	36	24%	0.24	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-61.6	-27.4	176	0	0	0	0	0	113.8	F144 W148 S187 N188 Q193	F144-A146 PolarHBondContact O-N 3.39Å; F144-A146 VanDerWaalsContact O-N 3.14Å; A146-W148 PolarHBondContact O-N 3Å; A146-W148 VanDerWaalsContact O-N 3.13Å; A146-S187 VanDerWaalsContact CB-O 3.23Å; A146-S187 WeakPolarHBondContact CB-O 3.32Å; A146-N188 HydrophobicContact CB-CB 4.01Å; A146-Q193 PolarHBondContact O-NE2 2.93Å
147	N	92.8	Very high	94.8	Very high	33 Å²	33	31.4 Å²	31.4	18%	0.176	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-69.4	-8.7	179.4	-64.9	0.6	0	0	0	112.5	F126 F144 A145 D149	F126-N147 HydrophobicContact CE2-CB 3.83Å; F126-N147 HydrophobicContact CZ-CB 3.63Å; F144-N147 WeakPolarHBondContact O-CB 3.38Å; F144-N147 PolarHBondContact O-N 2.8Å; A145-N147 PolarHBondContact O-N 2.8Å; N147-D149 PolarHBondContact O-N 3.23Å
148	W	94.7	Very high	94.8	Very high	18 Å²	18	31.1 Å²	31.1	7%	0.068	17%	0.171	C	C	.	.			trans	-74.2	93.2	-177.8	179.3	29.1	0	0	0	111.5	F126 A145 A146 Q150 N153 F155 I158 F189 Q193 K196 L197	F126-W148 HydrophobicContact CE2-CB 4.22Å; F126-W148 HydrophobicContact CZ-CB 3.88Å; A145-W148 WeakPolarHBondContact O-CB 3.45Å; A145-W148 PolarHBondContact O-N 3.2Å; A146-W148 PolarHBondContact O-N 3Å; A146-W148 VanDerWaalsContact O-N 3.13Å; W148-Q150 HydrophobicContact CD2-CG 4.08Å; W148-Q150 HydrophobicContact CH2-CG 4.15Å; W148-Q150 HydrophobicContact CZ2-CG 3.64Å; W148-Q150 PolarHBondContact O-N 3.28Å; W148-N153 PolarHBondContact NE1-O 2.92Å; W148-F155 HydrophobicContact CH2-CB 4.3Å; W148-F155 HydrophobicContact CH2-CD2 4.27Å; W148-F155 HydrophobicContact CZ2-CB 3.91Å; W148-F155 HydrophobicContact CZ2-CD2 4.46Å; W148-I158 HydrophobicContact CB-CD1 4.34Å; W148-I158 HydrophobicContact CD2-CD1 4.37Å; W148-I158 HydrophobicContact CG-CD1 3.78Å; W148-F189 HydrophobicContact CE3-CE2 4.07Å; W148-F189 HydrophobicContact CE3-CZ 4.36Å; W148-F189 HydrophobicContact CZ3-CZ 4.43Å; W148-Q193 HydrophobicContact CE3-CB 4.1Å; W148-Q193 HydrophobicContact CE3-CG 4.35Å; W148-Q193 HydrophobicContact CZ3-CB 4.32Å; W148-Q193 PolarHBondContact O-NE2 3.33Å; W148-K196 HydrophobicContact CH2-CB 3.79Å; W148-K196 HydrophobicContact CZ3-CB 4.46Å; W148-L197 HydrophobicContact CH2-CD2 3.9Å; W148-L197 HydrophobicContact CZ3-CD2 3.7Å; W148-L197 HydrophobicContact CZ3-CG 4.12Å
149	D	91.9	Very high	94.7	Very high	69 Å²	69	29.8 Å²	29.8	37%	0.369	17%	0.166	S	C	.	.			trans	-83.4	105.3	165.4	-174.3	-7.1	0	0	0	110.6	N147 S151 R152 N153	N147-D149 PolarHBondContact O-N 3.23Å; D149-S151 VanDerWaalsContact CG-OG 3.22Å; D149-S151 PolarHBondContact O-N 2.77Å; D149-S151 WeakPolarHBondContact OD1-CB 3.23Å; D149-S151 PolarHBondContact OD1-N 3.02Å; D149-S151 PolarHBondContact OD1-OG 3.4Å; D149-S151 PolarHBondContact OD2-OG 3.27Å; D149-R152 HydrophobicContact CB-CB 4.2Å; D149-R152 HydrophobicContact CB-CG 4.23Å; D149-R152 PolarHBondContact O-N 3.32Å; D149-R152 WeakPolarHBondContact OD2-CD 3.49Å; D149-R152 WeakPolarHBondContact OD2-CG 3.38Å; D149-N153 PolarHBondContact O-N 3.28Å
150	Q	89.1	Confident	94.7	Very high	53 Å²	53	29.4 Å²	29.4	25%	0.248	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-18.5	179	-68	156.3	46.9	0	0	114	W148 R152 K196	W148-Q150 HydrophobicContact CD2-CG 4.08Å; W148-Q150 HydrophobicContact CH2-CG 4.15Å; W148-Q150 HydrophobicContact CZ2-CG 3.64Å; W148-Q150 PolarHBondContact O-N 3.28Å; Q150-R152 VanDerWaalsContact C-N 3.3Å; Q150-K196 HydrophobicContact CG-CG 4.45Å
151	S	89.4	Confident	94.7	Very high	105 Å²	105	29.4 Å²	29.4	73%	0.734	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-21.9	175.1	73.7	0	0	0	0	112.2	D149	D149-S151 VanDerWaalsContact CG-OG 3.22Å; D149-S151 PolarHBondContact O-N 2.77Å; D149-S151 WeakPolarHBondContact OD1-CB 3.23Å; D149-S151 PolarHBondContact OD1-N 3.02Å; D149-S151 PolarHBondContact OD1-OG 3.4Å; D149-S151 PolarHBondContact OD2-OG 3.27Å
152	R	88.3	Confident	94.7	Very high	74 Å²	74	30 Å²	30	28%	0.279	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-45	-177.4	-71	174.5	60.2	119.1	-3.1	112.7	R120 D124 D149 Q150	R120-R152 WeakPolarHBondContact CD-O 3.48Å; R120-R152 PolarHBondContact NH1-O 3.14Å; D124-R152 IonicContact OD1-CZ 2.82Å; D124-R152 IonicContact OD1-NE 3.48Å; D124-R152 IonicContact OD1-NH2 3.12Å; D124-R152 PolarHBondContact OD1-NH2 3.25Å; D124-R152 IonicContact OD2-CZ 2.87Å; D124-R152 IonicContact OD2-NE 3.73Å; D124-R152 PolarHBondContact OD2-NE 3.49Å; D124-R152 IonicContact OD2-NH2 3.71Å; D124-R152 PolarHBondContact OD2-NH2 2.82Å; D149-R152 HydrophobicContact CB-CB 4.2Å; D149-R152 HydrophobicContact CB-CG 4.23Å; D149-R152 PolarHBondContact O-N 3.32Å; D149-R152 WeakPolarHBondContact OD2-CD 3.49Å; D149-R152 WeakPolarHBondContact OD2-CG 3.38Å; Q150-R152 VanDerWaalsContact C-N 3.3Å
153	N	89.4	Confident	94.7	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	17%	0.168	C	C	.	.			trans	-129	130.6	-175.5	-57.2	-64.3	0	0	0	111.3	R120 A121 D124 W148 D149 I158	R120-N153 WeakPolarHBondContact CB-OD1 3.46Å; R120-N153 WeakPolarHBondContact CD-OD1 3.3Å; R120-N153 VanDerWaalsContact CG-OD1 3.25Å; R120-N153 WeakPolarHBondContact CG-OD1 3.5Å; A121-N153 PolarHBondContact N-OD1 3.36Å; D124-N153 PolarHBondContact OD2-ND2 3.26Å; W148-N153 PolarHBondContact NE1-O 2.92Å; D149-N153 PolarHBondContact O-N 3.28Å; N153-I158 HydrophobicContact CB-CG1 4.34Å
154	S	94	Very high	94.7	Very high	51 Å²	51	30 Å²	30	36%	0.357	17%	0.167	S	C	.	.			trans	-70.4	156.9	164.9	74.4	0	0	0	0	109.8	T156 D157 I158	S154-T156 PolarHBondContact O-N 3.46Å; S154-T156 PolarHBondContact OG-N 2.89Å; S154-D157 WeakPolarHBondContact CB-OD2 3.49Å; S154-D157 PolarHBondContact N-OD2 2.9Å; S154-D157 VanDerWaalsContact N-OD2 3.13Å; S154-D157 PolarHBondContact O-N 2.71Å; S154-D157 VanDerWaalsContact O-N 3.14Å; S154-D157 PolarHBondContact OG-N 3.28Å; S154-D157 PolarHBondContact OG-OD2 2.93Å; S154-I158 PolarHBondContact O-N 3.36Å
155	F	94.6	Very high	94.8	Very high	44 Å²	44	29.9 Å²	29.9	19%	0.193	17%	0.167	C	C	.	.	H	α-helix	trans	-59.3	-32.8	170.6	-176.1	-82.9	0	0	0	111.1	W148 D157 I158 L159 L197 I201 A205	W148-F155 HydrophobicContact CH2-CB 4.3Å; W148-F155 HydrophobicContact CH2-CD2 4.27Å; W148-F155 HydrophobicContact CZ2-CB 3.91Å; W148-F155 HydrophobicContact CZ2-CD2 4.46Å; F155-D157 VanDerWaalsContact C-N 3.34Å; F155-D157 PolarHBondContact O-N 3.03Å; F155-I158 PolarHBondContact O-N 2.91Å; F155-L159 HydrophobicContact CE1-CB 4.41Å; F155-L159 WeakPolarHBondContact O-CB 3.42Å; F155-L159 PolarHBondContact O-N 3.38Å; F155-L197 HydrophobicContact CD2-CD2 3.53Å; F155-L197 HydrophobicContact CE2-CD2 3.54Å; F155-I201 HydrophobicContact CB-CG1 4.1Å; F155-I201 HydrophobicContact CD1-CB 4.39Å; F155-I201 HydrophobicContact CD1-CD1 3.95Å; F155-I201 HydrophobicContact CD1-CG1 3.17Å; F155-I201 HydrophobicContact CD1-CG2 4.42Å; F155-I201 HydrophobicContact CE1-CG1 3.73Å; F155-I201 HydrophobicContact CG-CG1 3.83Å; F155-A205 HydrophobicContact CE1-CB 4.03Å; F155-A205 HydrophobicContact CZ-CB 4.18Å
156	T	95.4	Very high	94.9	Very high	43 Å²	43	29.5 Å²	29.5	26%	0.264	16%	0.163	S	C	.	.	H	α-helix	trans	-62	-41	175.9	-53.3	0	0	0	0	111.6	M107 S154 L159 R160	M107-T156 HydrophobicContact CE-CG2 4.45Å; M107-T156 HydrophobicContact CG-CG2 3.73Å; M107-T156 HydrophobicContact SD-CG2 4.41Å; S154-T156 PolarHBondContact O-N 3.46Å; S154-T156 PolarHBondContact OG-N 2.89Å; T156-L159 PolarHBondContact O-N 3.13Å; T156-R160 HydrophobicContact CG2-CG 4.44Å; T156-R160 WeakPolarHBondContact O-CB 3.45Å; T156-R160 VanDerWaalsContact O-CG 3.23Å; T156-R160 WeakPolarHBondContact O-CG 3.38Å; T156-R160 PolarHBondContact O-N 3.08Å
157	D	96.3	Very high	95.1	Very high	30 Å²	30	29.3 Å²	29.3	16%	0.16	16%	0.158	C	C	.	.	H	α-helix	trans	-63.6	-42	176.5	-62.3	-48.1	0	0	0	111.8	S154 F155 R160 A161	S154-D157 WeakPolarHBondContact CB-OD2 3.49Å; S154-D157 PolarHBondContact N-OD2 2.9Å; S154-D157 VanDerWaalsContact N-OD2 3.13Å; S154-D157 PolarHBondContact O-N 2.71Å; S154-D157 VanDerWaalsContact O-N 3.14Å; S154-D157 PolarHBondContact OG-N 3.28Å; S154-D157 PolarHBondContact OG-OD2 2.93Å; F155-D157 VanDerWaalsContact C-N 3.34Å; F155-D157 PolarHBondContact O-N 3.03Å; D157-R160 WeakPolarHBondContact O-CB 3.47Å; D157-R160 PolarHBondContact O-N 3.34Å; D157-R160 IonicContact OD1-NH1 3.33Å; D157-A161 PolarHBondContact O-N 3.44Å
158	I	97.4	Very high	95.4	Very high	11 Å²	11	30.6 Å²	30.6	6%	0.056	17%	0.166	C	C	.	.	H	α-helix	trans	-60.1	-46.7	173.4	-69.6	170.7	0	0	0	110.6	A121 F126 W148 N153 S154 F155 R160 A161 I162	A121-I158 HydrophobicContact CB-CG1 4.3Å; F126-I158 HydrophobicContact CB-CB 4.48Å; F126-I158 HydrophobicContact CB-CG1 4.05Å; F126-I158 HydrophobicContact CB-CG2 4.04Å; F126-I158 HydrophobicContact CD1-CG2 4.32Å; F126-I158 HydrophobicContact CD2-CD1 4.01Å; F126-I158 HydrophobicContact CD2-CG1 4.11Å; F126-I158 HydrophobicContact CE2-CD1 4.23Å; F126-I158 HydrophobicContact CG-CD1 4.15Å; F126-I158 HydrophobicContact CG-CG1 4.04Å; F126-I158 HydrophobicContact CG-CG2 4.26Å; W148-I158 HydrophobicContact CB-CD1 4.34Å; W148-I158 HydrophobicContact CD2-CD1 4.37Å; W148-I158 HydrophobicContact CG-CD1 3.78Å; N153-I158 HydrophobicContact CB-CG1 4.34Å; S154-I158 PolarHBondContact O-N 3.36Å; F155-I158 PolarHBondContact O-N 2.91Å; I158-R160 VanDerWaalsContact C-N 3.34Å; I158-R160 PolarHBondContact O-N 2.97Å; I158-A161 PolarHBondContact O-N 2.94Å; I158-I162 HydrophobicContact CG2-CD1 3.83Å; I158-I162 HydrophobicContact CG2-CG1 4.48Å; I158-I162 VanDerWaalsContact O-CG1 3.3Å; I158-I162 WeakPolarHBondContact O-CG1 3.33Å; I158-I162 PolarHBondContact O-N 3.41Å
159	L	97.6	Very high	95.6	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.016	17%	0.167	C	C	.	.	H	α-helix	trans	-63.9	-39.2	177.8	-179.4	58.3	0	0	0	111.9	M107 F155 T156 I162 L163 L204 A205	M107-L159 HydrophobicContact CE-CB 4.33Å; M107-L159 HydrophobicContact CE-CD2 3.51Å; M107-L159 HydrophobicContact CE-CG 3.71Å; F155-L159 HydrophobicContact CE1-CB 4.41Å; F155-L159 WeakPolarHBondContact O-CB 3.42Å; F155-L159 PolarHBondContact O-N 3.38Å; T156-L159 PolarHBondContact O-N 3.13Å; L159-I162 PolarHBondContact O-N 3.45Å; L159-L163 HydrophobicContact CD1-CD1 4.24Å; L159-L163 HydrophobicContact CD1-CG 4.18Å; L159-L163 HydrophobicContact CG-CD1 4.13Å; L159-L163 WeakPolarHBondContact O-CB 3.38Å; L159-L163 WeakPolarHBondContact O-CG 3.26Å; L159-L163 PolarHBondContact O-N 2.86Å; L159-L204 HydrophobicContact CD2-CD2 4.29Å; L159-L204 HydrophobicContact CD2-CG 4.09Å; L159-A205 HydrophobicContact CD1-CB 4Å; L159-A205 HydrophobicContact CD2-CB 4Å
160	R	98.1	Very high	95.8	Very high	18 Å²	18	27.1 Å²	27.1	7%	0.068	15%	0.149	C	C	.	.	H	α-helix	trans	-60	-46.3	173.9	-71.6	170.5	77.5	-142	0.7	110.6	M107 K109 F111 D115 I118 T156 D157 I158 L163 L164	M107-R160 HydrophobicContact CB-CG 4.24Å; M107-R160 HydrophobicContact CE-CG 4.37Å; M107-R160 WeakPolarHBondContact O-CD 3.46Å; M107-R160 VanDerWaalsContact O-CG 3.31Å; M107-R160 WeakPolarHBondContact O-CG 3.43Å; M107-R160 PolarHBondContact O-NE 3.07Å; K109-R160 PolarHBondContact O-NH2 2.7Å; F111-R160 HydrophobicContact CE2-CB 4.17Å; F111-R160 WeakPolarHBondContact CE2-O 3.25Å; D115-R160 IonicContact OD1-CZ 3.17Å; D115-R160 IonicContact OD1-NH1 2.7Å; D115-R160 PolarHBondContact OD1-NH1 3.15Å; D115-R160 IonicContact OD1-NH2 2.98Å; D115-R160 PolarHBondContact OD1-NH2 3.44Å; D115-R160 IonicContact OD2-CZ 3.64Å; D115-R160 IonicContact OD2-NH1 2.8Å; D115-R160 IonicContact OD2-NH2 3.48Å; D115-R160 PolarHBondContact OD2-NH2 2.96Å; I118-R160 HydrophobicContact CD1-CB 3.99Å; I118-R160 HydrophobicContact CG1-CB 3.76Å; T156-R160 HydrophobicContact CG2-CG 4.44Å; T156-R160 WeakPolarHBondContact O-CB 3.45Å; T156-R160 VanDerWaalsContact O-CG 3.23Å; T156-R160 WeakPolarHBondContact O-CG 3.38Å; T156-R160 PolarHBondContact O-N 3.08Å; D157-R160 WeakPolarHBondContact O-CB 3.47Å; D157-R160 PolarHBondContact O-N 3.34Å; D157-R160 IonicContact OD1-NH1 3.33Å; I158-R160 VanDerWaalsContact C-N 3.34Å; I158-R160 PolarHBondContact O-N 2.97Å; R160-L163 PolarHBondContact O-N 3.29Å; R160-L164 WeakPolarHBondContact O-CB 3.46Å; R160-L164 PolarHBondContact O-N 2.91Å
161	A	98.3	Very high	96.1	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.8	-40.2	177.3	0	0	0	0	0	112.8	I118 A121 L122 F126 D157 I158 L164 S165	I118-A161 HydrophobicContact CG2-CB 4.12Å; A121-A161 HydrophobicContact CB-CB 3.83Å; L122-A161 HydrophobicContact CD2-CB 4.13Å; L122-A161 HydrophobicContact CG-CB 4.16Å; F126-A161 VanDerWaalsContact O-CB 3.22Å; F126-A161 WeakPolarHBondContact O-CB 3.29Å; D157-A161 PolarHBondContact O-N 3.44Å; I158-A161 PolarHBondContact O-N 2.94Å; A161-L164 PolarHBondContact O-N 3.4Å; A161-S165 WeakPolarHBondContact O-CB 3.49Å; A161-S165 PolarHBondContact O-N 3.26Å; A161-S165 PolarHBondContact O-OG 3.13Å
162	I	98.5	Very high	96.5	Very high	16 Å²	16	27.7 Å²	27.7	8%	0.082	14%	0.142	C	C	.	.	H	α-helix	trans	-62.3	-49.4	174.4	-67.8	165.7	0	0	0	110.7	P127 L143 I158 L159 L164 S165 L166 L209	P127-I162 HydrophobicContact CB-CG1 4.14Å; P127-I162 HydrophobicContact CG-CG1 4.1Å; L143-I162 HydrophobicContact CD1-CD1 4.14Å; L143-I162 HydrophobicContact CD2-CD1 3.98Å; L143-I162 HydrophobicContact CD2-CG1 4.35Å; I158-I162 HydrophobicContact CG2-CD1 3.83Å; I158-I162 HydrophobicContact CG2-CG1 4.48Å; I158-I162 VanDerWaalsContact O-CG1 3.3Å; I158-I162 WeakPolarHBondContact O-CG1 3.33Å; I158-I162 PolarHBondContact O-N 3.41Å; L159-I162 PolarHBondContact O-N 3.45Å; I162-L164 VanDerWaalsContact C-N 3.33Å; I162-L164 PolarHBondContact O-N 3Å; I162-S165 PolarHBondContact O-N 3.23Å; I162-L166 HydrophobicContact CG2-CD1 4.11Å; I162-L166 WeakPolarHBondContact O-CG 3.33Å; I162-L166 PolarHBondContact O-N 3.37Å; I162-L209 HydrophobicContact CG2-CD2 4.06Å
163	L	98.4	Very high	96.8	Very high	3 Å²	3	25.7 Å²	25.7	2%	0.016	14%	0.138	C	C	.	.	H	α-helix	trans	-62.8	-39.9	179.5	-70.8	172	0	0	0	111.5	Y100 M107 F108 F111 L159 R160 L166 E167 L209 F213	Y100-L163 HydrophobicContact CE1-CD1 4.43Å; M107-L163 HydrophobicContact CE-CD1 4.07Å; F108-L163 HydrophobicContact CE1-CD1 4.32Å; F108-L163 HydrophobicContact CZ-CD1 4.06Å; F111-L163 HydrophobicContact CE2-CB 4.4Å; F111-L163 HydrophobicContact CZ-CB 3.82Å; L159-L163 HydrophobicContact CD1-CD1 4.24Å; L159-L163 HydrophobicContact CD1-CG 4.18Å; L159-L163 HydrophobicContact CG-CD1 4.13Å; L159-L163 WeakPolarHBondContact O-CB 3.38Å; L159-L163 WeakPolarHBondContact O-CG 3.26Å; L159-L163 PolarHBondContact O-N 2.86Å; R160-L163 PolarHBondContact O-N 3.29Å; L163-L166 PolarHBondContact O-N 3.25Å; L163-E167 WeakPolarHBondContact O-CG 3.35Å; L163-E167 PolarHBondContact O-N 2.9Å; L163-L209 HydrophobicContact CD2-CD2 4Å; L163-F213 HydrophobicContact CD2-CD2 4.38Å
164	L	98.6	Very high	97.2	Very high	17 Å²	17	26.3 Å²	26.3	9%	0.089	14%	0.141	C	C	.	.	H	α-helix	trans	-64.8	-44.1	177	-178.4	70.9	0	0	0	110.9	F111 A113 I118 R160 A161 I162 L166 E167 V168	F111-L164 HydrophobicContact CD1-CD1 3.82Å; F111-L164 HydrophobicContact CE1-CB 3.95Å; F111-L164 HydrophobicContact CE1-CD1 3.7Å; F111-L164 HydrophobicContact CE1-CG 4.46Å; F111-L164 HydrophobicContact CE2-CB 4.21Å; F111-L164 HydrophobicContact CZ-CB 3.7Å; F111-L164 HydrophobicContact CZ-CD1 4.31Å; F111-L164 VanDerWaalsContact CZ-N 3.31Å; A113-L164 HydrophobicContact CB-CD2 4.06Å; I118-L164 HydrophobicContact CD1-CD2 4.45Å; I118-L164 HydrophobicContact CG2-CD2 3.67Å; R160-L164 WeakPolarHBondContact O-CB 3.46Å; R160-L164 PolarHBondContact O-N 2.91Å; A161-L164 PolarHBondContact O-N 3.4Å; I162-L164 VanDerWaalsContact C-N 3.33Å; I162-L164 PolarHBondContact O-N 3Å; L164-L166 VanDerWaalsContact C-N 3.27Å; L164-L166 PolarHBondContact O-N 3.45Å; L164-E167 WeakPolarHBondContact O-CB 3.4Å; L164-E167 PolarHBondContact O-N 3.17Å; L164-E167 VanDerWaalsContact O-N 3.15Å; L164-V168 PolarHBondContact O-N 3.39Å
165	S	98.7	Very high	97.4	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-59.1	-42.4	176.9	-57.4	0	0	0	0	111	P127 A161 I162 V168 L169 W283	P127-S165 WeakPolarHBondContact CD-OG 3.25Å; P127-S165 WeakPolarHBondContact CG-OG 3.25Å; A161-S165 WeakPolarHBondContact O-CB 3.49Å; A161-S165 PolarHBondContact O-N 3.26Å; A161-S165 PolarHBondContact O-OG 3.13Å; I162-S165 PolarHBondContact O-N 3.23Å; S165-V168 PolarHBondContact O-N 2.84Å; S165-L169 WeakPolarHBondContact O-CB 3.19Å; S165-L169 WeakPolarHBondContact O-CD1 3.46Å; S165-L169 WeakPolarHBondContact O-CG 3.31Å; S165-L169 PolarHBondContact O-N 3.5Å; S165-W283 PolarHBondContact OG-NE1 3.46Å
166	L	98.6	Very high	97.6	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-66.9	-38.3	175.8	-69.8	171.2	0	0	0	112.5	L141 I162 L163 L164 V168 L169 I170 F180 L209 F213 F217	L141-L166 HydrophobicContact CD1-CD2 4.46Å; L141-L166 HydrophobicContact CD2-CD2 3.9Å; L141-L166 HydrophobicContact CD2-CG 4.32Å; I162-L166 HydrophobicContact CG2-CD1 4.11Å; I162-L166 WeakPolarHBondContact O-CG 3.33Å; I162-L166 PolarHBondContact O-N 3.37Å; L163-L166 PolarHBondContact O-N 3.25Å; L164-L166 VanDerWaalsContact C-N 3.27Å; L164-L166 PolarHBondContact O-N 3.45Å; L166-V168 VanDerWaalsContact C-N 3.3Å; L166-V168 PolarHBondContact O-N 2.94Å; L166-L169 PolarHBondContact O-N 3.3Å; L166-I170 WeakPolarHBondContact O-CB 3.3Å; L166-I170 VanDerWaalsContact O-CG2 3.29Å; L166-I170 WeakPolarHBondContact O-CG2 3.24Å; L166-I170 PolarHBondContact O-N 3.41Å; L166-F180 HydrophobicContact CD2-CD1 3.94Å; L166-F180 HydrophobicContact CD2-CE1 3.97Å; L166-F180 HydrophobicContact CD2-CG 4.22Å; L166-F180 HydrophobicContact CD2-CZ 4.28Å; L166-L209 HydrophobicContact CD1-CD2 3.47Å; L166-L209 VanDerWaalsContact CD1-CD2 3.47Å; L166-F213 VanDerWaalsContact C-CZ 3.43Å; L166-F213 HydrophobicContact CB-CD1 4.37Å; L166-F213 HydrophobicContact CB-CE1 3.65Å; L166-F213 HydrophobicContact CB-CE2 3.96Å; L166-F213 HydrophobicContact CB-CZ 3.43Å; L166-F213 VanDerWaalsContact CB-CZ 3.43Å; L166-F213 HydrophobicContact CD1-CD1 4.42Å; L166-F213 HydrophobicContact CD1-CE1 4.44Å; L166-F213 HydrophobicContact CG-CE1 4.5Å; L166-F213 WeakPolarHBondContact O-CZ 3.41Å; L166-F217 HydrophobicContact CD1-CZ 4.09Å; L166-F217 HydrophobicContact CD2-CZ 4.39Å
167	E	98.1	Very high	97.7	Very high	26 Å²	26	20.3 Å²	20.3	12%	0.121	11%	0.105	C	C	.	.	H	α-helix	trans	-59.1	-41.4	174.7	-76.1	-64.4	165.7	0	0	112.1	R78 Y97 R101 F111 L163 L164 I170 E171 F213	R78-E167 IonicContact NH1-OE2 3.78Å; Y97-E167 WeakPolarHBondContact CE2-OE1 3.49Å; Y97-E167 VanDerWaalsContact CZ-OE1 3.27Å; Y97-E167 VanDerWaalsContact OH-CD 3.28Å; Y97-E167 PolarHBondContact OH-OE1 2.83Å; Y97-E167 PolarHBondContact OH-OE2 3.3Å; R101-E167 IonicContact CZ-OE1 3.36Å; R101-E167 IonicContact NH2-OE1 3.49Å; R101-E167 PolarHBondContact NH2-OE1 3.35Å; F111-E167 HydrophobicContact CE1-CG 4.17Å; L163-E167 WeakPolarHBondContact O-CG 3.35Å; L163-E167 PolarHBondContact O-N 2.9Å; L164-E167 WeakPolarHBondContact O-CB 3.4Å; L164-E167 PolarHBondContact O-N 3.17Å; L164-E167 VanDerWaalsContact O-N 3.15Å; E167-I170 WeakPolarHBondContact O-CG2 3.47Å; E167-E171 WeakPolarHBondContact O-CG 3.37Å; E167-F213 HydrophobicContact CG-CE2 3.96Å; E167-F213 VanDerWaalsContact OE1-CE2 3.32Å; E167-F213 WeakPolarHBondContact OE1-CE2 3.3Å
168	V	98.1	Very high	97.8	Very high	60 Å²	60	19.3 Å²	19.3	36%	0.364	10%	0.1	S	C	.	.	H	α-helix	trans	-70.1	-46.2	176.7	175	0	0	0	0	110.9	L164 S165 L166 I170 E171 W283 L287	L164-V168 PolarHBondContact O-N 3.39Å; S165-V168 PolarHBondContact O-N 2.84Å; L166-V168 VanDerWaalsContact C-N 3.3Å; L166-V168 PolarHBondContact O-N 2.94Å; V168-I170 PolarHBondContact O-N 3.45Å; V168-E171 WeakPolarHBondContact O-CB 3.12Å; V168-E171 WeakPolarHBondContact O-CG 3.38Å; V168-E171 PolarHBondContact O-N 3.26Å; V168-W283 HydrophobicContact CG1-CH2 4.36Å; V168-L287 HydrophobicContact CB-CD2 4.19Å; V168-L287 HydrophobicContact CG1-CD2 3.91Å; V168-L287 HydrophobicContact CG2-CD2 3.9Å
169	L	98.5	Very high	97.8	Very high	14 Å²	14	18.8 Å²	18.8	7%	0.073	10%	0.097	C	C	.	.	H	α-helix	trans	-67.1	-36.3	-176.9	-69.6	168.5	0	0	0	112.6	V129 K139 L141 S165 L166 E171 D172 L175 F180 W283	V129-L169 HydrophobicContact CG1-CD1 4.16Å; V129-L169 HydrophobicContact CG1-CD2 4.25Å; V129-L169 HydrophobicContact CG2-CD1 4.21Å; K139-L169 HydrophobicContact CG-CD1 4.24Å; K139-L169 HydrophobicContact CG-CD2 4.17Å; L141-L169 HydrophobicContact CD1-CD1 4.2Å; S165-L169 WeakPolarHBondContact O-CB 3.19Å; S165-L169 WeakPolarHBondContact O-CD1 3.46Å; S165-L169 WeakPolarHBondContact O-CG 3.31Å; S165-L169 PolarHBondContact O-N 3.5Å; L166-L169 PolarHBondContact O-N 3.3Å; L169-E171 PolarHBondContact O-N 3.25Å; L169-D172 WeakPolarHBondContact O-CB 3.46Å; L169-D172 PolarHBondContact O-N 2.77Å; L169-L175 HydrophobicContact CB-CD1 4.13Å; L169-L175 HydrophobicContact CD2-CD1 4.39Å; L169-L175 WeakPolarHBondContact O-CD1 3.05Å; L169-F180 HydrophobicContact CB-CE1 3.75Å; L169-F180 HydrophobicContact CB-CZ 4.14Å; L169-F180 HydrophobicContact CD1-CE1 4.11Å; L169-W283 HydrophobicContact CD1-CZ2 4.47Å; L169-W283 HydrophobicContact CD2-CH2 3.73Å; L169-W283 HydrophobicContact CD2-CZ2 4.37Å; L169-W283 HydrophobicContact CD2-CZ3 4.27Å; L169-W283 HydrophobicContact CG-CH2 4Å; L169-W283 HydrophobicContact CG-CZ2 4.17Å
170	I	97.4	Very high	97.9	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-6.8	-177.4	-158.7	159.3	0	0	0	113.6	L166 E167 V168 D172 Q176 F180 F213 P214	L166-I170 WeakPolarHBondContact O-CB 3.3Å; L166-I170 VanDerWaalsContact O-CG2 3.29Å; L166-I170 WeakPolarHBondContact O-CG2 3.24Å; L166-I170 PolarHBondContact O-N 3.41Å; E167-I170 WeakPolarHBondContact O-CG2 3.47Å; V168-I170 PolarHBondContact O-N 3.45Å; I170-D172 PolarHBondContact O-N 3.06Å; I170-Q176 HydrophobicContact CG1-CG 3.76Å; I170-Q176 WeakPolarHBondContact O-CG 3.28Å; I170-Q176 PolarHBondContact O-NE2 3.4Å; I170-F180 HydrophobicContact CB-CZ 4.44Å; I170-F213 HydrophobicContact CB-CE1 4.4Å; I170-F213 HydrophobicContact CB-CZ 4.34Å; I170-F213 HydrophobicContact CD1-CE1 3.71Å; I170-F213 HydrophobicContact CD1-CZ 4.28Å; I170-F213 HydrophobicContact CG2-CE1 4.4Å; I170-F213 HydrophobicContact CG2-CZ 3.91Å; I170-P214 HydrophobicContact CD1-CB 4.3Å; I170-P214 HydrophobicContact CD1-CG 3.92Å; I170-P214 VanDerWaalsContact CD1-O 3.23Å; I170-P214 WeakPolarHBondContact CD1-O 3.37Å
171	E	95.6	Very high	97.9	Very high	113 Å²	113	17.8 Å²	17.8	53%	0.528	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-28.9	170.5	-55.8	-152.6	132.3	0	0	111.8	R78 E167 V168 L169 P173	R78-E171 IonicContact NH2-OE1 3.55Å; E167-E171 WeakPolarHBondContact O-CG 3.37Å; V168-E171 WeakPolarHBondContact O-CB 3.12Å; V168-E171 WeakPolarHBondContact O-CG 3.38Å; V168-E171 PolarHBondContact O-N 3.26Å; L169-E171 PolarHBondContact O-N 3.25Å; E171-P173 VanDerWaalsContact O-CD 3.26Å; E171-P173 WeakPolarHBondContact O-CD 3.47Å
172	D	96.3	Very high	97.9	Very high	56 Å²	56	18.8 Å²	18.8	30%	0.299	10%	0.098	S	C	.	.	S	Bend	trans	-68.3	113.6	171.8	-174.1	-13.7	0	0	0	110.9	R133 L169 I170 E174 L175 Q176	R133-D172 IonicContact CZ-OD2 3.98Å; R133-D172 IonicContact NH2-OD1 3.39Å; R133-D172 PolarHBondContact NH2-OD1 3.26Å; R133-D172 IonicContact NH2-OD2 3.46Å; R133-D172 PolarHBondContact NH2-OD2 2.86Å; L169-D172 WeakPolarHBondContact O-CB 3.46Å; L169-D172 PolarHBondContact O-N 2.77Å; I170-D172 PolarHBondContact O-N 3.06Å; D172-E174 PolarHBondContact O-N 3.26Å; D172-E174 VanDerWaalsContact OD1-CB 3.29Å; D172-E174 WeakPolarHBondContact OD1-CB 3.3Å; D172-E174 PolarHBondContact OD1-N 2.77Å; D172-L175 HydrophobicContact CB-CB 4.33Å; D172-L175 HydrophobicContact CB-CD1 4.2Å; D172-L175 HydrophobicContact CB-CG 4.04Å; D172-L175 PolarHBondContact O-N 3.4Å; D172-Q176 PolarHBondContact O-N 3.46Å
173	P	96.1	Very high	97.9	Very high	32 Å²	32	18 Å²	18	21%	0.208	9%	0.094	C	C	.	.	H	α-helix	trans	-58.1	-31.1	-178.6	-26.1	37.2	0	0	0	113.4	L30 E171 L175 Q176 I177	L30-P173 VanDerWaalsContact CD2-C 3.49Å; L30-P173 HydrophobicContact CD2-CB 3.53Å; L30-P173 HydrophobicContact CG-CB 4.13Å; E171-P173 VanDerWaalsContact O-CD 3.26Å; E171-P173 WeakPolarHBondContact O-CD 3.47Å; P173-L175 VanDerWaalsContact C-N 3.29Å; P173-L175 PolarHBondContact O-N 2.86Å; P173-Q176 WeakPolarHBondContact O-CB 3.34Å; P173-Q176 PolarHBondContact O-N 3.14Å; P173-I177 PolarHBondContact O-N 2.93Å
174	E	97.3	Very high	97.9	Very high	14 Å²	14	18.9 Å²	18.9	7%	0.065	10%	0.099	C	C	.	.	H	α-helix	trans	-62.4	-38.4	176.5	-74	-79.7	149.4	0	0	111.6	L30 S31 T34 R133 D172 Q176 I177 N178	L30-E174 WeakPolarHBondContact CA-OE1 3.49Å; L30-E174 HydrophobicContact CD2-CG 4.26Å; S31-E174 PolarHBondContact N-OE1 2.62Å; T34-E174 VanDerWaalsContact CB-OE1 3.25Å; T34-E174 WeakPolarHBondContact CB-OE1 3.32Å; T34-E174 WeakPolarHBondContact CB-OE2 3.4Å; T34-E174 WeakPolarHBondContact CG2-OE2 3.42Å; T34-E174 VanDerWaalsContact OG1-CD 3.26Å; T34-E174 PolarHBondContact OG1-OE1 2.94Å; T34-E174 PolarHBondContact OG1-OE2 3.42Å; R133-E174 IonicContact NH1-OE2 3.84Å; R133-E174 PolarHBondContact NH1-OE2 2.92Å; R133-E174 VanDerWaalsContact NH2-CB 3.29Å; D172-E174 PolarHBondContact O-N 3.26Å; D172-E174 VanDerWaalsContact OD1-CB 3.29Å; D172-E174 WeakPolarHBondContact OD1-CB 3.3Å; D172-E174 PolarHBondContact OD1-N 2.77Å; E174-Q176 VanDerWaalsContact C-N 3.33Å; E174-I177 PolarHBondContact O-N 3.43Å; E174-N178 VanDerWaalsContact O-CB 3.31Å; E174-N178 WeakPolarHBondContact O-CB 3.38Å; E174-N178 PolarHBondContact O-N 3.49Å; E174-N178 PolarHBondContact O-ND2 2.77Å; E174-N178 PolarHBondContact OE2-ND2 3.05Å
175	L	97.9	Very high	97.9	Very high	3 Å²	3	18.1 Å²	18.1	2%	0.016	10%	0.095	C	C	.	.	H	α-helix	trans	-76.7	-22.2	-178.4	-62.2	-171.9	0	0	0	112.5	K139 L169 D172 P173 I177 G179 F180	K139-L175 HydrophobicContact CB-CD1 3.8Å; K139-L175 HydrophobicContact CB-CD2 3.84Å; K139-L175 HydrophobicContact CB-CG 4.49Å; K139-L175 HydrophobicContact CD-CD1 4.43Å; K139-L175 HydrophobicContact CG-CD1 4.13Å; L169-L175 HydrophobicContact CB-CD1 4.13Å; L169-L175 HydrophobicContact CD2-CD1 4.39Å; L169-L175 WeakPolarHBondContact O-CD1 3.05Å; D172-L175 HydrophobicContact CB-CB 4.33Å; D172-L175 HydrophobicContact CB-CD1 4.2Å; D172-L175 HydrophobicContact CB-CG 4.04Å; D172-L175 PolarHBondContact O-N 3.4Å; P173-L175 VanDerWaalsContact C-N 3.29Å; P173-L175 PolarHBondContact O-N 2.86Å; L175-I177 PolarHBondContact O-N 3.4Å; L175-G179 WeakPolarHBondContact O-CA 3.41Å; L175-G179 PolarHBondContact O-N 3.3Å; L175-F180 HydrophobicContact CB-CE1 4.43Å; L175-F180 HydrophobicContact CB-CZ 3.97Å; L175-F180 HydrophobicContact CD1-CE1 4.1Å; L175-F180 HydrophobicContact CD1-CZ 4.36Å
176	Q	98.1	Very high	97.7	Very high	10 Å²	10	19 Å²	19	5%	0.047	10%	0.098	C	C	.	.	H	α-helix	trans	-64.9	-33.7	170.1	-59.3	170.1	17	0	0	111.4	R78 I170 D172 P173 E174 R216	R78-Q176 HydrophobicContact CG-CG 4.36Å; I170-Q176 HydrophobicContact CG1-CG 3.76Å; I170-Q176 WeakPolarHBondContact O-CG 3.28Å; I170-Q176 PolarHBondContact O-NE2 3.4Å; D172-Q176 PolarHBondContact O-N 3.46Å; P173-Q176 WeakPolarHBondContact O-CB 3.34Å; P173-Q176 PolarHBondContact O-N 3.14Å; E174-Q176 VanDerWaalsContact C-N 3.33Å; Q176-R216 WeakPolarHBondContact O-CD 3.33Å
177	I	98.1	Very high	97.6	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-90.4	-53.3	-179.5	-64.1	158.1	0	0	0	110.4	L30 T34 K37 A38 L42 P173 E174 L175 R216	L30-I177 HydrophobicContact CD1-CD1 3.58Å; L30-I177 HydrophobicContact CD2-CD1 3.62Å; L30-I177 HydrophobicContact CG-CD1 4.26Å; T34-I177 HydrophobicContact CG2-CB 3.87Å; T34-I177 HydrophobicContact CG2-CD1 3.55Å; T34-I177 HydrophobicContact CG2-CG1 4.32Å; T34-I177 HydrophobicContact CG2-CG2 3.82Å; K37-I177 HydrophobicContact CD-CG2 4.29Å; K37-I177 HydrophobicContact CG-CG2 4.28Å; A38-I177 HydrophobicContact CB-CD1 3.78Å; A38-I177 HydrophobicContact CB-CG1 4.06Å; A38-I177 HydrophobicContact CB-CG2 4.16Å; L42-I177 HydrophobicContact CD1-CB 4.31Å; L42-I177 HydrophobicContact CD1-CG1 3.95Å; L42-I177 HydrophobicContact CD1-CG2 4.11Å; P173-I177 PolarHBondContact O-N 2.93Å; E174-I177 PolarHBondContact O-N 3.43Å; L175-I177 PolarHBondContact O-N 3.4Å; I177-R216 PolarHBondContact O-NH1 3.21Å
178	N	98.2	Very high	97.4	Very high	9 Å²	9	22.9 Å²	22.9	5%	0.048	12%	0.122	C	C	.	.	H	α-helix	trans	-74.3	-41.4	-174.7	-66.4	-41	0	0	0	111.9	K37 Y136 G137 R138 E174	K37-N178 WeakPolarHBondContact CD-OD1 3.41Å; K37-N178 WeakPolarHBondContact CE-OD1 3.21Å; K37-N178 PolarHBondContact NZ-OD1 2.88Å; Y136-N178 PolarHBondContact O-OD1 3.19Å; G137-N178 WeakPolarHBondContact O-CB 3.44Å; R138-N178 WeakPolarHBondContact CG-O 3.25Å; E174-N178 VanDerWaalsContact O-CB 3.31Å; E174-N178 WeakPolarHBondContact O-CB 3.38Å; E174-N178 PolarHBondContact O-N 3.49Å; E174-N178 PolarHBondContact O-ND2 2.77Å; E174-N178 PolarHBondContact OE2-ND2 3.05Å
179	G	98.1	Very high	97.2	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.107	C	C	.	.			trans	89.8	-155.2	176.2	0	0	0	0	0	114.2	R138 K139 L175 R216	R138-G179 VanDerWaalsContact CA-O 3.26Å; R138-G179 WeakPolarHBondContact CA-O 3.34Å; K139-G179 PolarHBondContact N-O 3.21Å; L175-G179 WeakPolarHBondContact O-CA 3.41Å; L175-G179 PolarHBondContact O-N 3.3Å; G179-R216 CarbonylContact C-O 3.51Å; G179-R216 WeakPolarHBondContact CA-O 3.47Å
180	F	98.6	Very high	96.9	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	155.1	-166.5	-58.9	-90	0	0	0	112	K139 L141 L166 L169 I170 L175 A215 R216 F217 G218	K139-F180 HydrophobicContact CB-CD1 3.81Å; K139-F180 HydrophobicContact CB-CE1 4.05Å; K139-F180 CarbonylContact O-C 3.54Å; K139-F180 VanDerWaalsContact O-CA 3.29Å; K139-F180 WeakPolarHBondContact O-CA 3.37Å; L141-F180 HydrophobicContact CD1-CB 4.45Å; L141-F180 HydrophobicContact CD1-CD1 3.71Å; L166-F180 HydrophobicContact CD2-CD1 3.94Å; L166-F180 HydrophobicContact CD2-CE1 3.97Å; L166-F180 HydrophobicContact CD2-CG 4.22Å; L166-F180 HydrophobicContact CD2-CZ 4.28Å; L169-F180 HydrophobicContact CB-CE1 3.75Å; L169-F180 HydrophobicContact CB-CZ 4.14Å; L169-F180 HydrophobicContact CD1-CE1 4.11Å; I170-F180 HydrophobicContact CB-CZ 4.44Å; L175-F180 HydrophobicContact CB-CE1 4.43Å; L175-F180 HydrophobicContact CB-CZ 3.97Å; L175-F180 HydrophobicContact CD1-CE1 4.1Å; L175-F180 HydrophobicContact CD1-CZ 4.36Å; F180-A215 HydrophobicContact CD2-CB 3.76Å; F180-A215 HydrophobicContact CE2-CB 3.91Å; F180-R216 PolarHBondContact N-O 3Å; F180-F217 HydrophobicContact CB-CD1 3.89Å; F180-F217 HydrophobicContact CB-CE1 3.87Å; F180-F217 CarbonylContact O-C 3.2Å; F180-F217 WeakPolarHBondContact O-CA 3.35Å; F180-G218 PolarHBondContact O-N 3Å
181	I	98.4	Very high	96.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	140.9	165.4	-70.6	-58	0	0	0	108.2	R138 K139 I140 L141 I183 I262	R138-I181 HydrophobicContact CB-CG1 4.15Å; K139-I181 PolarHBondContact O-N 2.84Å; I140-I181 HydrophobicContact CG1-CB 4.32Å; I140-I181 HydrophobicContact CG2-CG2 4.37Å; L141-I181 PolarHBondContact N-O 3.04Å; I181-I183 HydrophobicContact CG2-CD1 4.49Å; I181-I183 HydrophobicContact CG2-CG1 3.9Å; I181-I262 HydrophobicContact CG2-CD1 3.71Å
182	L	98.6	Very high	96.3	Very high	20 Å²	20	30.6 Å²	30.6	11%	0.105	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	124.2	170.3	-179.8	60.5	0	0	0	109.2	L141 L143 I184 G219 V220 H221	L141-L182 HydrophobicContact CB-CD1 3.87Å; L143-L182 HydrophobicContact CD1-CD1 3.88Å; L143-L182 HydrophobicContact CD1-CD2 4.32Å; L143-L182 HydrophobicContact CG-CD1 3.89Å; L182-I184 HydrophobicContact CD2-CD1 4.09Å; L182-I184 HydrophobicContact CD2-CG1 4.27Å; L182-I184 HydrophobicContact CG-CD1 4.36Å; L182-I184 HydrophobicContact CG-CG1 3.99Å; L182-G219 PolarHBondContact N-O 3.41Å; L182-V220 HydrophobicContact CB-CG1 4.16Å; L182-V220 HydrophobicContact CB-CG2 4.39Å; L182-V220 HydrophobicContact CD2-CG1 3.98Å; L182-V220 HydrophobicContact CG-CG1 4.18Å; L182-V220 CarbonylContact O-C 2.92Å; L182-V220 VanDerWaalsContact O-CA 3.3Å; L182-V220 WeakPolarHBondContact O-CA 3.44Å; L182-H221 PolarHBondContact O-N 2.76Å
183	I	98.6	Very high	96.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	127.1	172.1	-50.3	179.6	0	0	0	108	I140 L141 L142 L143 I181 H221 V223 I262 L267 F271	I140-I183 HydrophobicContact CG2-CD1 3.8Å; I140-I183 HydrophobicContact CG2-CG1 4.12Å; L141-I183 PolarHBondContact O-N 3.39Å; L142-I183 CarbonylContact C-O 3.6Å; L142-I183 WeakPolarHBondContact CA-O 3.29Å; L142-I183 HydrophobicContact CD2-CB 3.88Å; L142-I183 HydrophobicContact CD2-CD1 4.06Å; L142-I183 HydrophobicContact CD2-CG1 4.26Å; L143-I183 PolarHBondContact N-O 2.78Å; I181-I183 HydrophobicContact CG2-CD1 4.49Å; I181-I183 HydrophobicContact CG2-CG1 3.9Å; I183-H221 CarbonylContact C-O 3.56Å; I183-H221 WeakPolarHBondContact CA-O 3.28Å; I183-H221 HydrophobicContact CG1-CB 4.31Å; I183-H221 HydrophobicContact CG2-CB 4.42Å; I183-V223 HydrophobicContact CG2-CG1 4.36Å; I183-V223 HydrophobicContact CG2-CG2 4.41Å; I183-I262 HydrophobicContact CD1-CD1 3.8Å; I183-I262 HydrophobicContact CG1-CD1 4.25Å; I183-L267 HydrophobicContact CD1-CD2 3.57Å; I183-F271 HydrophobicContact CG2-CD1 3.85Å; I183-F271 HydrophobicContact CG2-CE1 3.48Å; I183-F271 VanDerWaalsContact CG2-CE1 3.48Å; I183-F271 HydrophobicContact CG2-CZ 4Å
184	I	98	Very high	95.8	Very high	21 Å²	21	28.1 Å²	28.1	11%	0.108	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	109.9	179.3	-46.6	-178.2	0	0	0	107.7	L143 L182 W186 V220 H221 F222 V223	L143-I184 HydrophobicContact CB-CB 4.49Å; L143-I184 HydrophobicContact CB-CG1 4.35Å; L143-I184 HydrophobicContact CB-CG2 4.14Å; L143-I184 HydrophobicContact CD1-CD1 4.32Å; L143-I184 HydrophobicContact CD1-CG1 4.18Å; L143-I184 CarbonylContact O-C 3.47Å; L143-I184 WeakPolarHBondContact O-CA 3.31Å; L182-I184 HydrophobicContact CD2-CD1 4.09Å; L182-I184 HydrophobicContact CD2-CG1 4.27Å; L182-I184 HydrophobicContact CG-CD1 4.36Å; L182-I184 HydrophobicContact CG-CG1 3.99Å; I184-W186 HydrophobicContact CG2-CD2 4.26Å; I184-W186 HydrophobicContact CG2-CG 4.48Å; I184-W186 HydrophobicContact CG2-CZ2 3.9Å; I184-W186 VanDerWaalsContact CG2-NE1 3.34Å; I184-W186 VanDerWaalsContact O-CD1 3.25Å; I184-V220 HydrophobicContact CD1-CG1 4.19Å; I184-H221 PolarHBondContact N-O 3.14Å; I184-F222 HydrophobicContact CD1-CE1 4.01Å; I184-F222 HydrophobicContact CD1-CZ 4.06Å; I184-V223 PolarHBondContact O-N 3.03Å
185	D	97.9	Very high	95.5	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.011	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	117.1	171.2	-172.9	12.3	0	0	0	109.8	L143 F144 A145 S187 V223 N224 F271 Y303	L143-D185 PolarHBondContact O-N 2.94Å; F144-D185 HydrophobicContact CD1-CB 3.93Å; F144-D185 HydrophobicContact CE1-CB 4.4Å; A145-D185 VanDerWaalsContact CB-O 3.24Å; A145-D185 WeakPolarHBondContact CB-O 3.38Å; A145-D185 PolarHBondContact N-O 3.13Å; D185-S187 VanDerWaalsContact OD1-CB 3.24Å; D185-S187 WeakPolarHBondContact OD1-CB 3.22Å; D185-S187 PolarHBondContact OD1-N 3.19Å; D185-S187 PolarHBondContact OD1-OG 2.88Å; D185-S187 PolarHBondContact OD2-OG 3.13Å; D185-V223 HydrophobicContact CB-CG2 3.96Å; D185-N224 PolarHBondContact OD1-ND2 3.1Å; D185-F271 HydrophobicContact CB-CE1 3.94Å; D185-F271 HydrophobicContact CB-CZ 4.23Å; D185-Y303 PolarHBondContact OD2-OH 3.27Å
186	W	96.4	Very high	95.1	Very high	18 Å²	18	36.1 Å²	36.1	7%	0.068	18%	0.184	C	C	.	.			trans	-98.9	6.3	178.9	-65.9	89.3	0	0	0	112.8	A145 I184 N188 F189 L197 F222 V223 N224 Q225 I229 L232	A145-W186 HydrophobicContact CB-CD2 4.44Å; A145-W186 HydrophobicContact CB-CE3 4.11Å; A145-W186 HydrophobicContact CB-CZ3 4.49Å; I184-W186 HydrophobicContact CG2-CD2 4.26Å; I184-W186 HydrophobicContact CG2-CG 4.48Å; I184-W186 HydrophobicContact CG2-CZ2 3.9Å; I184-W186 VanDerWaalsContact CG2-NE1 3.34Å; I184-W186 VanDerWaalsContact O-CD1 3.25Å; W186-N188 PolarHBondContact O-N 3.01Å; W186-F189 HydrophobicContact CE3-CB 4.03Å; W186-F189 AromaticContact CE3-CD1 3.46Å; W186-F189 HydrophobicContact CE3-CD1 3.46Å; W186-F189 VanDerWaalsContact CE3-CD1 3.46Å; W186-F189 HydrophobicContact CE3-CD2 4.29Å; W186-F189 AromaticContact CE3-CE1 3.88Å; W186-F189 HydrophobicContact CE3-CE1 3.88Å; W186-F189 AromaticContact CE3-CG 3.67Å; W186-F189 HydrophobicContact CE3-CG 3.67Å; W186-F189 HydrophobicContact CE3-CZ 4.43Å; W186-F189 AromaticContact CZ3-CD1 3.53Å; W186-F189 HydrophobicContact CZ3-CD1 3.53Å; W186-F189 HydrophobicContact CZ3-CD2 4.38Å; W186-F189 AromaticContact CZ3-CE1 3.41Å; W186-F189 HydrophobicContact CZ3-CE1 3.41Å; W186-F189 VanDerWaalsContact CZ3-CE1 3.41Å; W186-F189 HydrophobicContact CZ3-CE2 4.26Å; W186-F189 HydrophobicContact CZ3-CG 4.02Å; W186-F189 AromaticContact CZ3-CZ 3.8Å; W186-F189 HydrophobicContact CZ3-CZ 3.8Å; W186-F189 VanDerWaalsContact O-CB 3.24Å; W186-F189 WeakPolarHBondContact O-CB 3.42Å; W186-F189 PolarHBondContact O-N 3.06Å; W186-L197 HydrophobicContact CH2-CD1 4.34Å; W186-L197 HydrophobicContact CZ3-CD1 4.48Å; W186-F222 AromaticContact CD1-CD2 3.94Å; W186-F222 AromaticContact CE2-CD2 3.61Å; W186-F222 AromaticContact CE2-CE2 3.79Å; W186-F222 AromaticContact CZ2-CD2 3.85Å; W186-F222 HydrophobicContact CZ2-CD2 3.85Å; W186-F222 AromaticContact CZ2-CE2 3.5Å; W186-F222 HydrophobicContact CZ2-CE2 3.5Å; W186-F222 HydrophobicContact CZ2-CZ 4.37Å; W186-F222 AromaticContact NE1-CD2 3.01Å; W186-F222 AromaticContact NE1-CE2 3.62Å; W186-F222 AromaticContact NE1-CG 3.55Å; W186-V223 WeakPolarHBondContact CB-O 3.35Å; W186-V223 PolarHBondContact N-O 3.45Å; W186-N224 CarbonylContact C-O 3.48Å; W186-Q225 HydrophobicContact CB-CB 3.94Å; W186-Q225 HydrophobicContact CG-CB 3.82Å; W186-I229 HydrophobicContact CD2-CD1 3.98Å; W186-I229 HydrophobicContact CD2-CG1 4.01Å; W186-I229 HydrophobicContact CE3-CD1 3.36Å; W186-I229 HydrophobicContact CE3-CG1 3.86Å; W186-I229 HydrophobicContact CG-CG1 4.47Å; W186-I229 HydrophobicContact CH2-CD1 3.89Å; W186-I229 HydrophobicContact CZ2-CD1 4.44Å; W186-I229 HydrophobicContact CZ2-CG2 4.37Å; W186-I229 HydrophobicContact CZ3-CD1 3.32Å; W186-I229 HydrophobicContact CZ3-CG1 4.26Å; W186-L232 HydrophobicContact CH2-CD2 3.82Å; W186-L232 HydrophobicContact CZ3-CD2 4.37Å
187	S	94.7	Very high	94.8	Very high	20 Å²	20	36.3 Å²	36.3	14%	0.14	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	130.3	172.4	-61.7	0	0	0	0	110.1	A146 D185 F189 N224	A146-S187 VanDerWaalsContact CB-O 3.23Å; A146-S187 WeakPolarHBondContact CB-O 3.32Å; D185-S187 VanDerWaalsContact OD1-CB 3.24Å; D185-S187 WeakPolarHBondContact OD1-CB 3.22Å; D185-S187 PolarHBondContact OD1-N 3.19Å; D185-S187 PolarHBondContact OD1-OG 2.88Å; D185-S187 PolarHBondContact OD2-OG 3.13Å; S187-F189 PolarHBondContact O-N 3.5Å; S187-N224 WeakPolarHBondContact OG-CB 3.36Å; S187-N224 VanDerWaalsContact OG-CG 3.26Å; S187-N224 PolarHBondContact OG-ND2 3.47Å
188	N	93.7	Very high	94.6	Very high	89 Å²	89	39.1 Å²	39.1	48%	0.476	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	13.4	-180	-54.4	-48.3	0	0	0	115.4	A146 W186 S190	A146-N188 HydrophobicContact CB-CB 4.01Å; W186-N188 PolarHBondContact O-N 3.01Å; N188-S190 PolarHBondContact O-N 3.24Å
189	F	94.3	Very high	94.3	Very high	12 Å²	12	41.6 Å²	41.6	5%	0.053	22%	0.219	C	C	.	.			trans	-63.1	131.9	168.5	-167.3	-113	0	0	0	108.8	A145 W148 W186 S187 Q193 A194 L197 Y228 I229	A145-F189 HydrophobicContact CB-CB 4.35Å; A145-F189 HydrophobicContact CB-CD2 3.53Å; A145-F189 HydrophobicContact CB-CE2 4Å; A145-F189 HydrophobicContact CB-CG 4.14Å; A145-F189 WeakPolarHBondContact O-CD2 3.46Å; W148-F189 HydrophobicContact CE3-CE2 4.07Å; W148-F189 HydrophobicContact CE3-CZ 4.36Å; W148-F189 HydrophobicContact CZ3-CZ 4.43Å; W186-F189 HydrophobicContact CE3-CB 4.03Å; W186-F189 AromaticContact CE3-CD1 3.46Å; W186-F189 HydrophobicContact CE3-CD1 3.46Å; W186-F189 VanDerWaalsContact CE3-CD1 3.46Å; W186-F189 HydrophobicContact CE3-CD2 4.29Å; W186-F189 AromaticContact CE3-CE1 3.88Å; W186-F189 HydrophobicContact CE3-CE1 3.88Å; W186-F189 AromaticContact CE3-CG 3.67Å; W186-F189 HydrophobicContact CE3-CG 3.67Å; W186-F189 HydrophobicContact CE3-CZ 4.43Å; W186-F189 AromaticContact CZ3-CD1 3.53Å; W186-F189 HydrophobicContact CZ3-CD1 3.53Å; W186-F189 HydrophobicContact CZ3-CD2 4.38Å; W186-F189 AromaticContact CZ3-CE1 3.41Å; W186-F189 HydrophobicContact CZ3-CE1 3.41Å; W186-F189 VanDerWaalsContact CZ3-CE1 3.41Å; W186-F189 HydrophobicContact CZ3-CE2 4.26Å; W186-F189 HydrophobicContact CZ3-CG 4.02Å; W186-F189 AromaticContact CZ3-CZ 3.8Å; W186-F189 HydrophobicContact CZ3-CZ 3.8Å; W186-F189 VanDerWaalsContact O-CB 3.24Å; W186-F189 WeakPolarHBondContact O-CB 3.42Å; W186-F189 PolarHBondContact O-N 3.06Å; S187-F189 PolarHBondContact O-N 3.5Å; F189-Q193 HydrophobicContact CD2-CB 3.85Å; F189-Q193 HydrophobicContact CD2-CG 4.44Å; F189-Q193 HydrophobicContact CE1-CB 4.04Å; F189-Q193 HydrophobicContact CE2-CB 3.25Å; F189-Q193 HydrophobicContact CE2-CG 4.08Å; F189-Q193 HydrophobicContact CG-CB 4.5Å; F189-Q193 HydrophobicContact CZ-CB 3.36Å; F189-A194 HydrophobicContact CD1-CB 4.36Å; F189-A194 HydrophobicContact CE1-CB 3.66Å; F189-A194 VanDerWaalsContact CE1-N 3.35Å; F189-L197 HydrophobicContact CE1-CD1 4.33Å; F189-L197 HydrophobicContact CZ-CD1 3.99Å; F189-Y228 HydrophobicContact CD1-CE2 4.28Å; F189-Y228 PolarHBondContact O-OH 3.26Å; F189-I229 HydrophobicContact CD1-CD1 4.22Å; F189-I229 HydrophobicContact CE1-CD1 4.39Å
190	S	92.6	Very high	94.1	Very high	46 Å²	46	45.8 Å²	45.8	32%	0.322	25%	0.248	S	C	.	.			trans	-96.4	154	-174.8	67.3	0	0	0	0	111.6	N188 K192 Q193 A194	N188-S190 PolarHBondContact O-N 3.24Å; S190-K192 PolarHBondContact O-N 3.36Å; S190-Q193 PolarHBondContact O-N 3.44Å; S190-Q193 WeakPolarHBondContact OG-CG 3.43Å; S190-Q193 PolarHBondContact OG-N 3.25Å; S190-Q193 VanDerWaalsContact OG-N 3.13Å; S190-Q193 PolarHBondContact OG-OE1 2.69Å; S190-A194 PolarHBondContact O-N 2.83Å
191	F	90	Very high	93.8	Very high	139 Å²	139	47 Å²	47	61%	0.61	26%	0.255	S	S	*	.	H	α-helix	trans	-59.9	-32.3	171.2	-171.3	-96.7	0	0	0	112.2	Q193 A194 S195 Y228	F191-Q193 VanDerWaalsContact C-N 3.34Å; F191-Q193 PolarHBondContact O-N 2.94Å; F191-A194 PolarHBondContact O-N 2.94Å; F191-S195 WeakPolarHBondContact O-CB 3.46Å; F191-S195 PolarHBondContact O-N 2.78Å; F191-Y228 HydrophobicContact CD2-CD1 4.46Å; F191-Y228 HydrophobicContact CD2-CG 4.42Å
192	K	90.3	Very high	93.7	Very high	151 Å²	151	48 Å²	48	66%	0.657	26%	0.259	S	S	*	.	H	α-helix	trans	-59.8	-44.1	173.4	-177.3	-178	175.5	-173.8	0	111.1	S190 S195	S190-K192 PolarHBondContact O-N 3.36Å; K192-S195 PolarHBondContact O-N 3.36Å; K192-S195 PolarHBondContact O-OG 2.85Å
193	Q	92.3	Very high	93.5	Very high	19 Å²	19	51 Å²	51	9%	0.089	27%	0.272	C	S	.	.	H	α-helix	trans	-65.2	-45.5	172.9	-68.6	156.9	-48.1	0	0	112.2	A146 W148 F189 S190 F191 S195 K196	A146-Q193 PolarHBondContact O-NE2 2.93Å; W148-Q193 HydrophobicContact CE3-CB 4.1Å; W148-Q193 HydrophobicContact CE3-CG 4.35Å; W148-Q193 HydrophobicContact CZ3-CB 4.32Å; W148-Q193 PolarHBondContact O-NE2 3.33Å; F189-Q193 HydrophobicContact CD2-CB 3.85Å; F189-Q193 HydrophobicContact CD2-CG 4.44Å; F189-Q193 HydrophobicContact CE1-CB 4.04Å; F189-Q193 HydrophobicContact CE2-CB 3.25Å; F189-Q193 HydrophobicContact CE2-CG 4.08Å; F189-Q193 HydrophobicContact CG-CB 4.5Å; F189-Q193 HydrophobicContact CZ-CB 3.36Å; S190-Q193 PolarHBondContact O-N 3.44Å; S190-Q193 WeakPolarHBondContact OG-CG 3.43Å; S190-Q193 PolarHBondContact OG-N 3.25Å; S190-Q193 VanDerWaalsContact OG-N 3.13Å; S190-Q193 PolarHBondContact OG-OE1 2.69Å; F191-Q193 VanDerWaalsContact C-N 3.34Å; F191-Q193 PolarHBondContact O-N 2.94Å; Q193-S195 PolarHBondContact O-N 2.59Å; Q193-K196 PolarHBondContact O-N 2.76Å; Q193-K196 VanDerWaalsContact O-N 3.13Å
194	A	90.9	Very high	93.4	Very high	17 Å²	17	52.3 Å²	52.3	14%	0.14	28%	0.279	C	S	.	.	H	α-helix	trans	-56.2	-39.7	176.7	0	0	0	0	0	112.6	F189 S190 F191 K196 L197 Y228	F189-A194 HydrophobicContact CD1-CB 4.36Å; F189-A194 HydrophobicContact CE1-CB 3.66Å; F189-A194 VanDerWaalsContact CE1-N 3.35Å; S190-A194 PolarHBondContact O-N 2.83Å; F191-A194 PolarHBondContact O-N 2.94Å; A194-K196 PolarHBondContact O-N 3.06Å; A194-K196 VanDerWaalsContact O-N 3.08Å; A194-L197 WeakPolarHBondContact O-CB 3.34Å; A194-L197 PolarHBondContact O-N 2.83Å; A194-Y228 HydrophobicContact CB-CD2 4.15Å; A194-Y228 HydrophobicContact CB-CE2 3.96Å
195	S	89.3	Confident	93.3	Very high	70 Å²	70	51.9 Å²	51.9	49%	0.49	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-17.2	-178.5	77.1	0	0	0	0	114.7	F191 K192 Q193	F191-S195 WeakPolarHBondContact O-CB 3.46Å; F191-S195 PolarHBondContact O-N 2.78Å; K192-S195 PolarHBondContact O-N 3.36Å; K192-S195 PolarHBondContact O-OG 2.85Å; Q193-S195 PolarHBondContact O-N 2.59Å
196	K	90.9	Very high	93.3	Very high	116 Å²	116	52.8 Å²	52.8	50%	0.504	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-9.3	177	-61.3	-49.8	-174.6	173.5	0	113.8	W148 Q150 Q193 A194 T198	W148-K196 HydrophobicContact CH2-CB 3.79Å; W148-K196 HydrophobicContact CZ3-CB 4.46Å; Q150-K196 HydrophobicContact CG-CG 4.45Å; Q193-K196 PolarHBondContact O-N 2.76Å; Q193-K196 VanDerWaalsContact O-N 3.13Å; A194-K196 PolarHBondContact O-N 3.06Å; A194-K196 VanDerWaalsContact O-N 3.08Å; K196-T198 VanDerWaalsContact C-N 3.31Å; K196-T198 PolarHBondContact O-N 2.83Å
197	L	91.8	Very high	93.3	Very high	14 Å²	14	55 Å²	55	7%	0.073	29%	0.294	C	S	.	.			trans	-81.5	80.6	176.4	-61.4	-179.7	0	0	0	109.6	W148 F155 W186 F189 A194 L202 L232	W148-L197 HydrophobicContact CH2-CD2 3.9Å; W148-L197 HydrophobicContact CZ3-CD2 3.7Å; W148-L197 HydrophobicContact CZ3-CG 4.12Å; F155-L197 HydrophobicContact CD2-CD2 3.53Å; F155-L197 HydrophobicContact CE2-CD2 3.54Å; W186-L197 HydrophobicContact CH2-CD1 4.34Å; W186-L197 HydrophobicContact CZ3-CD1 4.48Å; F189-L197 HydrophobicContact CE1-CD1 4.33Å; F189-L197 HydrophobicContact CZ-CD1 3.99Å; A194-L197 WeakPolarHBondContact O-CB 3.34Å; A194-L197 PolarHBondContact O-N 2.83Å; L197-L202 HydrophobicContact CB-CD1 4.16Å; L197-L202 HydrophobicContact CB-CD2 4.19Å; L197-L202 HydrophobicContact CB-CG 4.31Å; L197-L202 HydrophobicContact CD2-CD2 4.36Å; L197-L232 HydrophobicContact CB-CD1 3.89Å; L197-L232 HydrophobicContact CD1-CD1 4.31Å; L197-L232 HydrophobicContact CD1-CD2 3.59Å
198	T	92.8	Very high	93.4	Very high	59 Å²	59	54.1 Å²	54.1	36%	0.362	29%	0.288	S	S	.	.			trans	-72	157.2	178.4	66.9	0	0	0	0	111.7	K196 S200 I201 L202	K196-T198 VanDerWaalsContact C-N 3.31Å; K196-T198 PolarHBondContact O-N 2.83Å; T198-S200 PolarHBondContact O-N 3.47Å; T198-S200 PolarHBondContact OG1-OG 3.42Å; T198-I201 WeakPolarHBondContact O-CG2 3.33Å; T198-I201 PolarHBondContact O-N 3.11Å; T198-I201 WeakPolarHBondContact OG1-CG2 3.17Å; T198-I201 PolarHBondContact OG1-N 2.87Å; T198-L202 VanDerWaalsContact O-CG 3.28Å; T198-L202 WeakPolarHBondContact O-CG 3.49Å; T198-L202 PolarHBondContact O-N 3.03Å; T198-L202 VanDerWaalsContact O-N 3.11Å
199	P	92.7	Very high	93.6	Very high	61 Å²	61	51.5 Å²	51.5	40%	0.396	27%	0.274	S	S	.	.	H	α-helix	trans	-57.2	-36.9	175.6	-16.5	23.3	0	0	0	112.5	K203 L235 F239	P199-K203 WeakPolarHBondContact O-CB 3.32Å; P199-K203 PolarHBondContact O-N 2.7Å; P199-L235 HydrophobicContact CB-CD1 4.04Å; P199-L235 HydrophobicContact CB-CD2 4.21Å; P199-L235 HydrophobicContact CB-CG 4.21Å; P199-L235 HydrophobicContact CG-CD1 3.67Å; P199-L235 HydrophobicContact CG-CD2 3.81Å; P199-L235 HydrophobicContact CG-CG 4.09Å; P199-F239 HydrophobicContact CB-CE2 4.41Å
200	S	93.6	Very high	93.6	Very high	87 Å²	87	52.2 Å²	52.2	61%	0.608	28%	0.277	S	S	*	.	H	α-helix	trans	-66.1	-44.7	-179.6	53.4	0	0	0	0	112.6	T198 K203 L204	T198-S200 PolarHBondContact O-N 3.47Å; T198-S200 PolarHBondContact OG1-OG 3.42Å; S200-K203 PolarHBondContact O-N 3.38Å; S200-L204 WeakPolarHBondContact O-CB 3.4Å; S200-L204 PolarHBondContact O-N 3.02Å
201	I	93.2	Very high	93.7	Very high	27 Å²	27	51.2 Å²	51.2	14%	0.138	27%	0.269	C	S	.	.	H	α-helix	trans	-71.9	-34.4	-179.2	-159.8	73.4	0	0	0	111.8	F155 T198 L204 A205	F155-I201 HydrophobicContact CB-CG1 4.1Å; F155-I201 HydrophobicContact CD1-CB 4.39Å; F155-I201 HydrophobicContact CD1-CD1 3.95Å; F155-I201 HydrophobicContact CD1-CG1 3.17Å; F155-I201 HydrophobicContact CD1-CG2 4.42Å; F155-I201 HydrophobicContact CE1-CG1 3.73Å; F155-I201 HydrophobicContact CG-CG1 3.83Å; T198-I201 WeakPolarHBondContact O-CG2 3.33Å; T198-I201 PolarHBondContact O-N 3.11Å; T198-I201 WeakPolarHBondContact OG1-CG2 3.17Å; T198-I201 PolarHBondContact OG1-N 2.87Å; I201-L204 HydrophobicContact CD1-CD2 3.87Å; I201-L204 WeakPolarHBondContact O-CB 3.41Å; I201-L204 PolarHBondContact O-N 3.43Å; I201-A205 PolarHBondContact O-N 2.82Å; I201-A205 VanDerWaalsContact O-N 3.11Å
202	L	94.8	Very high	94	Very high	19 Å²	19	45 Å²	45	10%	0.099	24%	0.242	C	C	.	.	H	α-helix	trans	-69.3	-40.5	174.7	-65.1	167.6	0	0	0	111.5	L197 T198 L204 A205 I206 L232 L235 I236	L197-L202 HydrophobicContact CB-CD1 4.16Å; L197-L202 HydrophobicContact CB-CD2 4.19Å; L197-L202 HydrophobicContact CB-CG 4.31Å; L197-L202 HydrophobicContact CD2-CD2 4.36Å; T198-L202 VanDerWaalsContact O-CG 3.28Å; T198-L202 WeakPolarHBondContact O-CG 3.49Å; T198-L202 PolarHBondContact O-N 3.03Å; T198-L202 VanDerWaalsContact O-N 3.11Å; L202-L204 VanDerWaalsContact C-N 3.32Å; L202-L204 PolarHBondContact O-N 2.89Å; L202-A205 PolarHBondContact O-N 2.64Å; L202-I206 WeakPolarHBondContact O-CD1 3.38Å; L202-I206 VanDerWaalsContact O-CG1 3.25Å; L202-I206 WeakPolarHBondContact O-CG1 3.43Å; L202-I206 PolarHBondContact O-N 2.77Å; L202-L232 HydrophobicContact CD1-CD1 3.4Å; L202-L232 VanDerWaalsContact CD1-CD1 3.4Å; L202-L232 HydrophobicContact CD1-CG 4.31Å; L202-L235 HydrophobicContact CD1-CD2 4.04Å; L202-I236 HydrophobicContact CB-CG2 3.59Å; L202-I236 HydrophobicContact CD1-CG2 3.42Å; L202-I236 VanDerWaalsContact CD1-CG2 3.42Å; L202-I236 HydrophobicContact CD2-CG2 4.35Å; L202-I236 HydrophobicContact CG-CG2 3.97Å
203	K	95.7	Very high	94.4	Very high	83 Å²	83	37.9 Å²	37.9	36%	0.361	21%	0.211	S	C	.	.	H	α-helix	trans	-59	-45.5	173.1	-178.8	-178.2	168.6	-174.1	0	110.8	P199 S200 A205 I206 E207 F239	P199-K203 WeakPolarHBondContact O-CB 3.32Å; P199-K203 PolarHBondContact O-N 2.7Å; S200-K203 PolarHBondContact O-N 3.38Å; K203-A205 PolarHBondContact O-N 2.64Å; K203-I206 PolarHBondContact O-N 2.85Å; K203-I206 VanDerWaalsContact O-N 3.17Å; K203-E207 VanDerWaalsContact CE-CD 3.44Å; K203-E207 WeakPolarHBondContact CE-OE1 3.4Å; K203-E207 HydrophobicContact CG-CG 4.28Å; K203-E207 IonicContact NZ-OE1 2.79Å; K203-E207 PolarHBondContact NZ-OE1 3.19Å; K203-E207 WeakPolarHBondContact O-CB 3.39Å; K203-E207 WeakPolarHBondContact O-CG 3.15Å; K203-E207 PolarHBondContact O-N 3.32Å; K203-F239 HydrophobicContact CB-CD1 4.38Å; K203-F239 HydrophobicContact CB-CD2 3.93Å; K203-F239 HydrophobicContact CB-CE1 4.4Å; K203-F239 HydrophobicContact CB-CE2 3.95Å; K203-F239 HydrophobicContact CB-CG 4.17Å; K203-F239 HydrophobicContact CB-CZ 4.19Å; K203-F239 HydrophobicContact CD-CD1 4.03Å; K203-F239 HydrophobicContact CD-CE1 3.84Å; K203-F239 HydrophobicContact CD-CZ 4.26Å; K203-F239 HydrophobicContact CG-CD1 4Å; K203-F239 HydrophobicContact CG-CD2 4.39Å; K203-F239 HydrophobicContact CG-CE1 4.2Å; K203-F239 HydrophobicContact CG-CG 4.11Å; K203-F239 HydrophobicContact CG-CZ 4.48Å
204	L	96.1	Very high	94.6	Very high	28 Å²	28	37 Å²	37	15%	0.147	21%	0.208	C	C	.	.	H	α-helix	trans	-55.6	-48.3	176	-177.1	68.1	0	0	0	111.7	Y100 N104 M107 L159 S200 I201 L202 I206 E207 G208	Y100-L204 HydrophobicContact CE2-CD1 3.94Å; Y100-L204 VanDerWaalsContact OH-CD1 3.27Å; Y100-L204 WeakPolarHBondContact OH-CD1 3.3Å; Y100-L204 PolarHBondContact OH-O 3.23Å; Y100-L204 VanDerWaalsContact OH-O 3.06Å; N104-L204 VanDerWaalsContact OD1-CD1 3.32Å; N104-L204 WeakPolarHBondContact OD1-CD1 3.47Å; M107-L204 HydrophobicContact CE-CD2 4.49Å; M107-L204 HydrophobicContact SD-CD1 3.91Å; M107-L204 HydrophobicContact SD-CD2 3.62Å; M107-L204 HydrophobicContact SD-CG 3.93Å; L159-L204 HydrophobicContact CD2-CD2 4.29Å; L159-L204 HydrophobicContact CD2-CG 4.09Å; S200-L204 WeakPolarHBondContact O-CB 3.4Å; S200-L204 PolarHBondContact O-N 3.02Å; I201-L204 HydrophobicContact CD1-CD2 3.87Å; I201-L204 WeakPolarHBondContact O-CB 3.41Å; I201-L204 PolarHBondContact O-N 3.43Å; L202-L204 VanDerWaalsContact C-N 3.32Å; L202-L204 PolarHBondContact O-N 2.89Å; L204-I206 PolarHBondContact O-N 3.5Å; L204-E207 PolarHBondContact O-N 2.77Å; L204-G208 PolarHBondContact O-N 2.95Å
205	A	96.6	Very high	94.8	Very high	12 Å²	12	36.8 Å²	36.8	10%	0.099	21%	0.206	C	C	.	.	H	α-helix	trans	-61.2	-42.7	176.2	0	0	0	0	0	112.9	F155 L159 I201 L202 K203 G208 L209	F155-A205 HydrophobicContact CE1-CB 4.03Å; F155-A205 HydrophobicContact CZ-CB 4.18Å; L159-A205 HydrophobicContact CD1-CB 4Å; L159-A205 HydrophobicContact CD2-CB 4Å; I201-A205 PolarHBondContact O-N 2.82Å; I201-A205 VanDerWaalsContact O-N 3.11Å; L202-A205 PolarHBondContact O-N 2.64Å; K203-A205 PolarHBondContact O-N 2.64Å; A205-G208 PolarHBondContact O-N 2.92Å; A205-L209 WeakPolarHBondContact O-CB 3.29Å; A205-L209 VanDerWaalsContact O-CG 3.32Å; A205-L209 WeakPolarHBondContact O-CG 3.26Å; A205-L209 PolarHBondContact O-N 3.18Å
206	I	96.8	Very high	95.1	Very high	21 Å²	21	35.3 Å²	35.3	11%	0.108	19%	0.189	C	C	.	.	H	α-helix	trans	-66	-46.9	179.6	-68.6	163.4	0	0	0	110.6	L202 K203 L204 G208 L209 Q210 I236 F239 L240	L202-I206 WeakPolarHBondContact O-CD1 3.38Å; L202-I206 VanDerWaalsContact O-CG1 3.25Å; L202-I206 WeakPolarHBondContact O-CG1 3.43Å; L202-I206 PolarHBondContact O-N 2.77Å; K203-I206 PolarHBondContact O-N 2.85Å; K203-I206 VanDerWaalsContact O-N 3.17Å; L204-I206 PolarHBondContact O-N 3.5Å; I206-G208 VanDerWaalsContact C-N 3.31Å; I206-G208 PolarHBondContact O-N 3.32Å; I206-L209 PolarHBondContact O-N 3.22Å; I206-Q210 HydrophobicContact CG2-CB 4.23Å; I206-Q210 WeakPolarHBondContact O-CA 3.29Å; I206-Q210 WeakPolarHBondContact O-CB 3.42Å; I206-Q210 PolarHBondContact O-N 2.66Å; I206-I236 HydrophobicContact CD1-CB 3.74Å; I206-I236 HydrophobicContact CD1-CD1 4.43Å; I206-I236 HydrophobicContact CD1-CG2 4.14Å; I206-F239 HydrophobicContact CD1-CB 3.94Å; I206-F239 HydrophobicContact CD1-CD2 4.4Å; I206-F239 HydrophobicContact CG2-CB 4.19Å; I206-F239 WeakPolarHBondContact CG2-O 3.39Å; I206-L240 HydrophobicContact CD1-CD2 3.92Å; I206-L240 HydrophobicContact CD1-CG 4.37Å; I206-L240 HydrophobicContact CG1-CD2 4.12Å; I206-L240 HydrophobicContact CG2-CD2 4.07Å
207	E	96.8	Very high	95.4	Very high	65 Å²	65	31.3 Å²	31.3	30%	0.304	17%	0.172	S	C	.	.	I	π-helix	trans	-61.1	-41.3	177.3	-73.6	178.6	157.3	0	0	111.3	Y100 K203 L204 D211 S212	Y100-E207 HydrophobicContact CD2-CB 4.31Å; Y100-E207 HydrophobicContact CE2-CB 4Å; K203-E207 VanDerWaalsContact CE-CD 3.44Å; K203-E207 WeakPolarHBondContact CE-OE1 3.4Å; K203-E207 HydrophobicContact CG-CG 4.28Å; K203-E207 IonicContact NZ-OE1 2.79Å; K203-E207 PolarHBondContact NZ-OE1 3.19Å; K203-E207 WeakPolarHBondContact O-CB 3.39Å; K203-E207 WeakPolarHBondContact O-CG 3.15Å; K203-E207 PolarHBondContact O-N 3.32Å; L204-E207 PolarHBondContact O-N 2.77Å; E207-D211 CarbonylContact O-C 3.51Å; E207-D211 WeakPolarHBondContact O-CB 3.43Å; E207-D211 PolarHBondContact O-N 3.11Å; E207-S212 VanDerWaalsContact O-CB 3.28Å; E207-S212 WeakPolarHBondContact O-CB 3.33Å; E207-S212 PolarHBondContact O-N 3.29Å; E207-S212 PolarHBondContact O-OG 2.78Å
208	G	97.1	Very high	95.6	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.01	18%	0.18	C	C	.	.	I	π-helix	trans	-60.3	-51.4	174.9	0	0	0	0	0	112.9	L204 A205 I206 F213	L204-G208 PolarHBondContact O-N 2.95Å; A205-G208 PolarHBondContact O-N 2.92Å; I206-G208 VanDerWaalsContact C-N 3.31Å; I206-G208 PolarHBondContact O-N 3.32Å; G208-F213 VanDerWaalsContact O-CB 3.25Å; G208-F213 WeakPolarHBondContact O-CB 3.48Å; G208-F213 PolarHBondContact O-N 3.15Å
209	L	96.5	Very high	95.8	Very high	35 Å²	35	28.9 Å²	28.9	18%	0.183	16%	0.162	C	C	.	.	I	π-helix	trans	-83.3	-39	-172.1	-65.8	170.9	0	0	0	114.2	I162 L163 L166 A205 I206 F217	I162-L209 HydrophobicContact CG2-CD2 4.06Å; L163-L209 HydrophobicContact CD2-CD2 4Å; L166-L209 HydrophobicContact CD1-CD2 3.47Å; L166-L209 VanDerWaalsContact CD1-CD2 3.47Å; A205-L209 WeakPolarHBondContact O-CB 3.29Å; A205-L209 VanDerWaalsContact O-CG 3.32Å; A205-L209 WeakPolarHBondContact O-CG 3.26Å; A205-L209 PolarHBondContact O-N 3.18Å; I206-L209 PolarHBondContact O-N 3.22Å; L209-F217 HydrophobicContact CD2-CZ 4.4Å
210	Q	95.1	Very high	96	Very high	26 Å²	26	27 Å²	27	12%	0.121	15%	0.15	C	C	.	.	I	π-helix	trans	-89.9	-43.2	-173.8	-175.1	-171.3	-101.2	0	0	112.2	I206 F239 K241 T244	I206-Q210 HydrophobicContact CG2-CB 4.23Å; I206-Q210 WeakPolarHBondContact O-CA 3.29Å; I206-Q210 WeakPolarHBondContact O-CB 3.42Å; I206-Q210 PolarHBondContact O-N 2.66Å; Q210-F239 PolarHBondContact NE2-O 2.85Å; Q210-K241 HydrophobicContact CG-CD 4.21Å; Q210-T244 WeakPolarHBondContact CG-OG1 3.38Å; Q210-T244 PolarHBondContact OE1-OG1 2.87Å
211	D	93.7	Very high	96.2	Very high	26 Å²	26	23 Å²	23	14%	0.139	12%	0.121	C	C	.	.	I	π-helix	trans	-103.7	-26.9	-165.2	-60.1	-24.2	0	0	0	112.2	L93 Q96 E207 K241	L93-D211 WeakPolarHBondContact CD1-O 3.25Å; Q96-D211 PolarHBondContact OE1-O 2.96Å; E207-D211 CarbonylContact O-C 3.51Å; E207-D211 WeakPolarHBondContact O-CB 3.43Å; E207-D211 PolarHBondContact O-N 3.11Å; D211-K241 WeakPolarHBondContact OD1-CE 3.46Å; D211-K241 IonicContact OD1-NZ 3.46Å; D211-K241 PolarHBondContact OD1-NZ 2.82Å
212	S	97.4	Very high	96.4	Very high	8 Å²	8	22.5 Å²	22.5	6%	0.056	12%	0.118	C	C	.	.	S	Bend	trans	-117.9	-7.3	-168.7	-48.4	0	0	0	0	114.2	Y97 Y100 E207	Y97-S212 VanDerWaalsContact CA-O 3.25Å; Y97-S212 WeakPolarHBondContact CA-O 2.95Å; Y97-S212 WeakPolarHBondContact CB-O 3.23Å; Y97-S212 WeakPolarHBondContact CD2-O 3.41Å; Y100-S212 WeakPolarHBondContact CB-OG 3.5Å; E207-S212 VanDerWaalsContact O-CB 3.28Å; E207-S212 WeakPolarHBondContact O-CB 3.33Å; E207-S212 PolarHBondContact O-N 3.29Å; E207-S212 PolarHBondContact O-OG 2.78Å
213	F	98	Very high	96.6	Very high	1 Å²	1	21.6 Å²	21.6	0%	0.004	11%	0.113	C	C	.	.	S	Bend	trans	-114.6	135.1	-179	-163.6	-89	0	0	0	111.6	Y97 L163 L166 E167 I170 G208 A215	Y97-F213 HydrophobicContact CE2-CD2 4.45Å; L163-F213 HydrophobicContact CD2-CD2 4.38Å; L166-F213 VanDerWaalsContact C-CZ 3.43Å; L166-F213 HydrophobicContact CB-CD1 4.37Å; L166-F213 HydrophobicContact CB-CE1 3.65Å; L166-F213 HydrophobicContact CB-CE2 3.96Å; L166-F213 HydrophobicContact CB-CZ 3.43Å; L166-F213 VanDerWaalsContact CB-CZ 3.43Å; L166-F213 HydrophobicContact CD1-CD1 4.42Å; L166-F213 HydrophobicContact CD1-CE1 4.44Å; L166-F213 HydrophobicContact CG-CE1 4.5Å; L166-F213 WeakPolarHBondContact O-CZ 3.41Å; E167-F213 HydrophobicContact CG-CE2 3.96Å; E167-F213 VanDerWaalsContact OE1-CE2 3.32Å; E167-F213 WeakPolarHBondContact OE1-CE2 3.3Å; I170-F213 HydrophobicContact CB-CE1 4.4Å; I170-F213 HydrophobicContact CB-CZ 4.34Å; I170-F213 HydrophobicContact CD1-CE1 3.71Å; I170-F213 HydrophobicContact CD1-CZ 4.28Å; I170-F213 HydrophobicContact CG2-CE1 4.4Å; I170-F213 HydrophobicContact CG2-CZ 3.91Å; G208-F213 VanDerWaalsContact O-CB 3.25Å; G208-F213 WeakPolarHBondContact O-CB 3.48Å; G208-F213 PolarHBondContact O-N 3.15Å; F213-A215 HydrophobicContact CD1-CB 3.45Å; F213-A215 VanDerWaalsContact CD1-CB 3.45Å; F213-A215 HydrophobicContact CE1-CB 3.79Å; F213-A215 PolarHBondContact O-N 2.68Å
214	P	97.8	Very high	96.6	Very high	2 Å²	2	19.2 Å²	19.2	1%	0.013	11%	0.105	C	C	.	.			trans	-77.3	33.6	-177.3	31.2	-33.3	0	0	0	114.2	R78 F79 A82 L93 I170	R78-P214 HydrophobicContact CB-CB 4.11Å; R78-P214 HydrophobicContact CB-CG 4.07Å; F79-P214 HydrophobicContact CD1-CB 4.01Å; F79-P214 HydrophobicContact CD1-CG 4.43Å; F79-P214 HydrophobicContact CE1-CB 4.02Å; F79-P214 HydrophobicContact CE1-CG 3.97Å; F79-P214 HydrophobicContact CE2-CG 4.26Å; F79-P214 HydrophobicContact CG-CB 4.29Å; F79-P214 HydrophobicContact CZ-CB 4.35Å; F79-P214 HydrophobicContact CZ-CG 3.89Å; A82-P214 HydrophobicContact CB-CB 4.02Å; A82-P214 WeakPolarHBondContact CB-O 3.44Å; L93-P214 HydrophobicContact CD2-CB 4.1Å; I170-P214 HydrophobicContact CD1-CB 4.3Å; I170-P214 HydrophobicContact CD1-CG 3.92Å; I170-P214 VanDerWaalsContact CD1-O 3.23Å; I170-P214 WeakPolarHBondContact CD1-O 3.37Å
215	A	94.7	Very high	96.5	Very high	12 Å²	12	18.8 Å²	18.8	10%	0.099	10%	0.102	C	C	.	.			trans	-88.1	147.6	176.5	0	0	0	0	0	112.5	F180 F213 F217	F180-A215 HydrophobicContact CD2-CB 3.76Å; F180-A215 HydrophobicContact CE2-CB 3.91Å; F213-A215 HydrophobicContact CD1-CB 3.45Å; F213-A215 VanDerWaalsContact CD1-CB 3.45Å; F213-A215 HydrophobicContact CE1-CB 3.79Å; F213-A215 PolarHBondContact O-N 2.68Å; A215-F217 HydrophobicContact CB-CD2 4.2Å; A215-F217 HydrophobicContact CB-CE2 3.7Å; A215-F217 HydrophobicContact CB-CZ 4.17Å
216	R	95.8	Very high	96.3	Very high	38 Å²	38	19.8 Å²	19.8	14%	0.143	11%	0.107	C	C	.	.			trans	-102.7	102.4	167.6	-61.2	172.9	83.6	-113.7	13.8	108.7	E41 Q176 I177 G179 F180 G218	E41-R216 IonicContact OE2-NH2 3.96Å; E41-R216 PolarHBondContact OE2-NH2 3.33Å; E41-R216 VanDerWaalsContact OE2-NH2 3.12Å; Q176-R216 WeakPolarHBondContact O-CD 3.33Å; I177-R216 PolarHBondContact O-NH1 3.21Å; G179-R216 CarbonylContact C-O 3.51Å; G179-R216 WeakPolarHBondContact CA-O 3.47Å; F180-R216 PolarHBondContact N-O 3Å; R216-G218 PolarHBondContact O-N 3.42Å
217	F	96.3	Very high	95.9	Very high	32 Å²	32	28.4 Å²	28.4	14%	0.14	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	118.2	172.4	-71.2	-82.6	0	0	0	110.5	L166 F180 L209 A215 G219 R247	L166-F217 HydrophobicContact CD1-CZ 4.09Å; L166-F217 HydrophobicContact CD2-CZ 4.39Å; F180-F217 HydrophobicContact CB-CD1 3.89Å; F180-F217 HydrophobicContact CB-CE1 3.87Å; F180-F217 CarbonylContact O-C 3.2Å; F180-F217 WeakPolarHBondContact O-CA 3.35Å; L209-F217 HydrophobicContact CD2-CZ 4.4Å; A215-F217 HydrophobicContact CB-CD2 4.2Å; A215-F217 HydrophobicContact CB-CE2 3.7Å; A215-F217 HydrophobicContact CB-CZ 4.17Å; F217-G219 VanDerWaalsContact C-N 3.32Å; F217-R247 VanDerWaalsContact O-CD 3.24Å; F217-R247 WeakPolarHBondContact O-CD 3.22Å; F217-R247 PolarHBondContact O-NH1 2.93Å
218	G	95.4	Very high	95.5	Very high	23 Å²	23	26.9 Å²	26.9	24%	0.237	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	-25.3	173.1	0	0	0	0	0	113.1	F180 R216	F180-G218 PolarHBondContact O-N 3Å; R216-G218 PolarHBondContact O-N 3.42Å
219	G	97.2	Very high	95.1	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177	151.1	-178.6	0	0	0	0	0	112.3	L182 F217 R247	L182-G219 PolarHBondContact N-O 3.41Å; F217-G219 VanDerWaalsContact C-N 3.32Å; G219-R247 CarbonylContact C-O 3.29Å; G219-R247 WeakPolarHBondContact CA-O 3.5Å
220	V	97.9	Very high	94.7	Very high	22 Å²	22	29.7 Å²	29.7	13%	0.133	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	112.3	169.3	-172.4	0	0	0	0	107.3	L182 I184 F222 R247 I248 F249	L182-V220 HydrophobicContact CB-CG1 4.16Å; L182-V220 HydrophobicContact CB-CG2 4.39Å; L182-V220 HydrophobicContact CD2-CG1 3.98Å; L182-V220 HydrophobicContact CG-CG1 4.18Å; L182-V220 CarbonylContact O-C 2.92Å; L182-V220 VanDerWaalsContact O-CA 3.3Å; L182-V220 WeakPolarHBondContact O-CA 3.44Å; I184-V220 HydrophobicContact CD1-CG1 4.19Å; V220-F222 HydrophobicContact CG1-CD1 4.15Å; V220-F222 HydrophobicContact CG1-CE1 3.61Å; V220-R247 PolarHBondContact N-O 2.78Å; V220-I248 HydrophobicContact CB-CG1 4.19Å; V220-I248 CarbonylContact O-C 3.59Å; V220-I248 WeakPolarHBondContact O-CA 3.49Å; V220-F249 PolarHBondContact O-N 2.92Å
221	H	98.1	Very high	94.4	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.009	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	117.8	-167.8	-60.8	-94.7	0	0	0	109.6	L182 I183 I184 F249 H251 L258	L182-H221 PolarHBondContact O-N 2.76Å; I183-H221 CarbonylContact C-O 3.56Å; I183-H221 WeakPolarHBondContact CA-O 3.28Å; I183-H221 HydrophobicContact CG1-CB 4.31Å; I183-H221 HydrophobicContact CG2-CB 4.42Å; I184-H221 PolarHBondContact N-O 3.14Å; H221-F249 AromaticContact CE1-CD2 3.47Å; H221-F249 VanDerWaalsContact CE1-CD2 3.47Å; H221-F249 WeakPolarHBondContact CE1-CD2 3.38Å; H221-F249 AromaticContact CE1-CE2 3.99Å; H221-F249 AromaticContact ND1-CD2 3.74Å; H221-F249 AromaticContact NE2-CD2 3.94Å; H221-H251 AromaticContact CG-NE2 3.64Å; H221-H251 AromaticContact ND1-CE1 3.78Å; H221-H251 AromaticContact ND1-NE2 2.92Å; H221-H251 PolarHBondContact ND1-NE2 3.19Å; H221-L258 HydrophobicContact CB-CD1 3.73Å
222	F	97.4	Very high	94.2	Very high	16 Å²	16	31.4 Å²	31.4	7%	0.07	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	120.9	176.1	-70.3	49.6	0	0	0	106.7	I184 W186 V220 Q225 I229 I248 F249 L250 H251	I184-F222 HydrophobicContact CD1-CE1 4.01Å; I184-F222 HydrophobicContact CD1-CZ 4.06Å; W186-F222 AromaticContact CD1-CD2 3.94Å; W186-F222 AromaticContact CE2-CD2 3.61Å; W186-F222 AromaticContact CE2-CE2 3.79Å; W186-F222 AromaticContact CZ2-CD2 3.85Å; W186-F222 HydrophobicContact CZ2-CD2 3.85Å; W186-F222 AromaticContact CZ2-CE2 3.5Å; W186-F222 HydrophobicContact CZ2-CE2 3.5Å; W186-F222 HydrophobicContact CZ2-CZ 4.37Å; W186-F222 AromaticContact NE1-CD2 3.01Å; W186-F222 AromaticContact NE1-CE2 3.62Å; W186-F222 AromaticContact NE1-CG 3.55Å; V220-F222 HydrophobicContact CG1-CD1 4.15Å; V220-F222 HydrophobicContact CG1-CE1 3.61Å; F222-Q225 PolarHBondContact O-OE1 3.42Å; F222-Q225 VanDerWaalsContact O-OE1 3.11Å; F222-I229 HydrophobicContact CD2-CG2 3.86Å; F222-I229 HydrophobicContact CE2-CG2 4.07Å; F222-I248 HydrophobicContact CD1-CG2 4.2Å; F222-I248 HydrophobicContact CE1-CG2 4Å; F222-F249 PolarHBondContact N-O 2.89Å; F222-L250 HydrophobicContact CB-CD2 3.58Å; F222-L250 HydrophobicContact CD1-CD2 4.17Å; F222-L250 HydrophobicContact CD2-CD2 3.79Å; F222-L250 HydrophobicContact CG-CD2 3.6Å; F222-H251 WeakPolarHBondContact O-CB 3.43Å; F222-H251 PolarHBondContact O-CD2 2.69Å; F222-H251 PolarHBondContact O-N 2.91Å
223	V	97.8	Very high	93.9	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	150.7	176.2	-56.6	0	0	0	0	109.8	I183 I184 D185 W186 Q225 H251 L255 L258 F271	I183-V223 HydrophobicContact CG2-CG1 4.36Å; I183-V223 HydrophobicContact CG2-CG2 4.41Å; I184-V223 PolarHBondContact O-N 3.03Å; D185-V223 HydrophobicContact CB-CG2 3.96Å; W186-V223 WeakPolarHBondContact CB-O 3.35Å; W186-V223 PolarHBondContact N-O 3.45Å; V223-Q225 PolarHBondContact O-N 2.93Å; V223-Q225 VanDerWaalsContact O-N 3.08Å; V223-H251 HydrophobicContact CG1-CB 4.19Å; V223-L255 HydrophobicContact CB-CD2 4.33Å; V223-L255 HydrophobicContact CG1-CD2 4.21Å; V223-L258 HydrophobicContact CG1-CD2 4.09Å; V223-F271 HydrophobicContact CG2-CD1 3.92Å; V223-F271 HydrophobicContact CG2-CE1 3.71Å
224	N	96.1	Very high	93.5	Very high	34 Å²	34	37.7 Å²	37.7	18%	0.182	19%	0.194	C	C	.	.	S	Bend	trans	54.2	28.6	179.1	-52.4	-50.4	0	0	0	113.4	D185 W186 S187 P226 G252	D185-N224 PolarHBondContact OD1-ND2 3.1Å; W186-N224 CarbonylContact C-O 3.48Å; S187-N224 WeakPolarHBondContact OG-CB 3.36Å; S187-N224 VanDerWaalsContact OG-CG 3.26Å; S187-N224 PolarHBondContact OG-ND2 3.47Å; N224-P226 WeakPolarHBondContact O-CD 3.27Å; N224-G252 WeakPolarHBondContact CA-O 3.27Å; N224-G252 PolarHBondContact N-O 2.71Å
225	Q	94	Very high	93.2	Very high	19 Å²	19	40.8 Å²	40.8	9%	0.089	21%	0.21	C	C	.	.			trans	-73.6	126.2	-175.5	78.9	-72.7	-12.2	0	0	112.2	W186 F222 V223 I229 G252	W186-Q225 HydrophobicContact CB-CB 3.94Å; W186-Q225 HydrophobicContact CG-CB 3.82Å; F222-Q225 PolarHBondContact O-OE1 3.42Å; F222-Q225 VanDerWaalsContact O-OE1 3.11Å; V223-Q225 PolarHBondContact O-N 2.93Å; V223-Q225 VanDerWaalsContact O-N 3.08Å; Q225-I229 HydrophobicContact CB-CB 3.92Å; Q225-I229 HydrophobicContact CB-CG1 4.01Å; Q225-I229 HydrophobicContact CB-CG2 3.95Å; Q225-I229 HydrophobicContact CG-CB 4.18Å; Q225-I229 HydrophobicContact CG-CG2 4.16Å; Q225-G252 VanDerWaalsContact NE2-CA 3.34Å; Q225-G252 VanDerWaalsContact OE1-CA 3.28Å
226	P	91.9	Very high	93.1	Very high	33 Å²	33	41.1 Å²	41.1	21%	0.214	21%	0.21	C	C	.	.			trans	-70.8	162.4	175.9	27.2	-32.9	0	0	0	111.3	N224 Y228 I229	N224-P226 WeakPolarHBondContact O-CD 3.27Å; P226-Y228 HydrophobicContact CB-CD1 4.06Å; P226-Y228 HydrophobicContact CB-CE1 3.56Å; P226-Y228 HydrophobicContact CB-CE2 4.27Å; P226-Y228 HydrophobicContact CG-CD1 4.29Å; P226-Y228 HydrophobicContact CG-CD2 4.12Å; P226-Y228 HydrophobicContact CG-CE1 3.64Å; P226-Y228 HydrophobicContact CG-CE2 3.46Å; P226-Y228 VanDerWaalsContact CG-CE2 3.46Å; P226-Y228 WeakPolarHBondContact CG-OH 3.39Å; P226-Y228 PolarHBondContact O-N 3.34Å; P226-I229 HydrophobicContact CG-CG1 3.9Å; P226-I229 WeakPolarHBondContact O-CB 3.25Å; P226-I229 PolarHBondContact O-N 3.27Å
227	W	88.8	Confident	93	Very high	202 Å²	202	44.1 Å²	44.1	77%	0.765	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-33.9	-172.2	68.4	-95.3	0	0	0	114	I229 H230	W227-I229 VanDerWaalsContact C-N 3.26Å; W227-I229 PolarHBondContact O-N 3.41Å; W227-H230 WeakPolarHBondContact O-CB 3.39Å; W227-H230 PolarHBondContact O-CD2 3.29Å; W227-H230 PolarHBondContact O-N 2.86Å
228	Y	87.7	Confident	92.9	Very high	33 Å²	33	47.4 Å²	47.4	13%	0.129	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-11.9	-178.6	53.5	-102.7	0	0	0	113.9	F189 F191 A194 P226 H230 A231 L232	F189-Y228 HydrophobicContact CD1-CE2 4.28Å; F189-Y228 PolarHBondContact O-OH 3.26Å; F191-Y228 HydrophobicContact CD2-CD1 4.46Å; F191-Y228 HydrophobicContact CD2-CG 4.42Å; A194-Y228 HydrophobicContact CB-CD2 4.15Å; A194-Y228 HydrophobicContact CB-CE2 3.96Å; P226-Y228 HydrophobicContact CB-CD1 4.06Å; P226-Y228 HydrophobicContact CB-CE1 3.56Å; P226-Y228 HydrophobicContact CB-CE2 4.27Å; P226-Y228 HydrophobicContact CG-CD1 4.29Å; P226-Y228 HydrophobicContact CG-CD2 4.12Å; P226-Y228 HydrophobicContact CG-CE1 3.64Å; P226-Y228 HydrophobicContact CG-CE2 3.46Å; P226-Y228 VanDerWaalsContact CG-CE2 3.46Å; P226-Y228 WeakPolarHBondContact CG-OH 3.39Å; P226-Y228 PolarHBondContact O-N 3.34Å; Y228-H230 PolarHBondContact O-N 3.46Å; Y228-A231 WeakPolarHBondContact O-CB 3.45Å; Y228-A231 PolarHBondContact O-N 3.02Å; Y228-A231 VanDerWaalsContact O-N 3.13Å; Y228-L232 PolarHBondContact O-N 2.84Å
229	I	90	Very high	92.9	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-67.9	-23.5	171.5	-61.3	-53.7	0	0	0	111.6	W186 F189 F222 Q225 P226 W227 A231 L232 Y233	W186-I229 HydrophobicContact CD2-CD1 3.98Å; W186-I229 HydrophobicContact CD2-CG1 4.01Å; W186-I229 HydrophobicContact CE3-CD1 3.36Å; W186-I229 HydrophobicContact CE3-CG1 3.86Å; W186-I229 HydrophobicContact CG-CG1 4.47Å; W186-I229 HydrophobicContact CH2-CD1 3.89Å; W186-I229 HydrophobicContact CZ2-CD1 4.44Å; W186-I229 HydrophobicContact CZ2-CG2 4.37Å; W186-I229 HydrophobicContact CZ3-CD1 3.32Å; W186-I229 HydrophobicContact CZ3-CG1 4.26Å; F189-I229 HydrophobicContact CD1-CD1 4.22Å; F189-I229 HydrophobicContact CE1-CD1 4.39Å; F222-I229 HydrophobicContact CD2-CG2 3.86Å; F222-I229 HydrophobicContact CE2-CG2 4.07Å; Q225-I229 HydrophobicContact CB-CB 3.92Å; Q225-I229 HydrophobicContact CB-CG1 4.01Å; Q225-I229 HydrophobicContact CB-CG2 3.95Å; Q225-I229 HydrophobicContact CG-CB 4.18Å; Q225-I229 HydrophobicContact CG-CG2 4.16Å; P226-I229 HydrophobicContact CG-CG1 3.9Å; P226-I229 WeakPolarHBondContact O-CB 3.25Å; P226-I229 PolarHBondContact O-N 3.27Å; W227-I229 VanDerWaalsContact C-N 3.26Å; W227-I229 PolarHBondContact O-N 3.41Å; I229-A231 VanDerWaalsContact C-N 3.31Å; I229-A231 PolarHBondContact O-N 3.24Å; I229-L232 HydrophobicContact CD1-CD2 4.1Å; I229-L232 WeakPolarHBondContact O-CB 3.49Å; I229-L232 PolarHBondContact O-N 3.22Å; I229-Y233 WeakPolarHBondContact O-CB 3.39Å; I229-Y233 PolarHBondContact O-N 2.84Å
230	H	88.2	Confident	92.8	Very high	93 Å²	93	50 Å²	50	43%	0.431	25%	0.254	S	S	.	.	H	α-helix	trans	-64.3	-35.8	170	-69.5	-74.8	0	0	0	112.5	W227 Y228 Y233 T234	W227-H230 WeakPolarHBondContact O-CB 3.39Å; W227-H230 PolarHBondContact O-CD2 3.29Å; W227-H230 PolarHBondContact O-N 2.86Å; Y228-H230 PolarHBondContact O-N 3.46Å; H230-Y233 PolarHBondContact O-N 2.81Å; H230-T234 PolarHBondContact O-N 3.23Å; H230-T234 PolarHBondContact O-OG1 3.13Å
231	A	88.4	Confident	92.7	Very high	64 Å²	64	53.1 Å²	53.1	53%	0.529	27%	0.266	S	S	.	.	H	α-helix	trans	-67.5	-43.2	174.4	0	0	0	0	0	110.8	Y228 I229 Y233 T234 L235	Y228-A231 WeakPolarHBondContact O-CB 3.45Å; Y228-A231 PolarHBondContact O-N 3.02Å; Y228-A231 VanDerWaalsContact O-N 3.13Å; I229-A231 VanDerWaalsContact C-N 3.31Å; I229-A231 PolarHBondContact O-N 3.24Å; A231-Y233 VanDerWaalsContact C-N 3.35Å; A231-Y233 PolarHBondContact O-N 3.23Å; A231-T234 WeakPolarHBondContact O-CB 3.37Å; A231-T234 PolarHBondContact O-N 3.46Å; A231-L235 PolarHBondContact O-N 3.19Å
232	L	89.3	Confident	92.6	Very high	24 Å²	24	57.8 Å²	57.8	13%	0.126	29%	0.291	C	S	.	.	H	α-helix	trans	-59.8	-43.6	173.7	-173.1	68.5	0	0	0	112	W186 L197 L202 Y228 I229 T234 L235 I236	W186-L232 HydrophobicContact CH2-CD2 3.82Å; W186-L232 HydrophobicContact CZ3-CD2 4.37Å; L197-L232 HydrophobicContact CB-CD1 3.89Å; L197-L232 HydrophobicContact CD1-CD1 4.31Å; L197-L232 HydrophobicContact CD1-CD2 3.59Å; L202-L232 HydrophobicContact CD1-CD1 3.4Å; L202-L232 VanDerWaalsContact CD1-CD1 3.4Å; L202-L232 HydrophobicContact CD1-CG 4.31Å; Y228-L232 PolarHBondContact O-N 2.84Å; I229-L232 HydrophobicContact CD1-CD2 4.1Å; I229-L232 WeakPolarHBondContact O-CB 3.49Å; I229-L232 PolarHBondContact O-N 3.22Å; L232-T234 VanDerWaalsContact C-N 3.31Å; L232-T234 PolarHBondContact O-N 3.1Å; L232-L235 HydrophobicContact CD1-CD2 4.45Å; L232-L235 WeakPolarHBondContact O-CB 3.48Å; L232-L235 PolarHBondContact O-N 3.3Å; L232-L235 VanDerWaalsContact O-N 3.16Å; L232-I236 PolarHBondContact O-N 2.98Å; L232-I236 VanDerWaalsContact O-N 3.13Å
233	Y	90.6	Very high	92.4	Very high	48 Å²	48	62.3 Å²	62.3	19%	0.188	31%	0.311	C	S	.	.	H	α-helix	trans	-59.7	-42.9	174.9	176.9	-105.8	0	0	0	111.6	I229 H230 A231 L235 I236 K237 L240 I248	I229-Y233 WeakPolarHBondContact O-CB 3.39Å; I229-Y233 PolarHBondContact O-N 2.84Å; H230-Y233 PolarHBondContact O-N 2.81Å; A231-Y233 VanDerWaalsContact C-N 3.35Å; A231-Y233 PolarHBondContact O-N 3.23Å; Y233-L235 VanDerWaalsContact C-N 3.26Å; Y233-L235 PolarHBondContact O-N 2.99Å; Y233-I236 HydrophobicContact CD2-CD1 4.41Å; Y233-I236 HydrophobicContact CD2-CG1 4.4Å; Y233-I236 VanDerWaalsContact O-CG1 3.26Å; Y233-I236 WeakPolarHBondContact O-CG1 3.41Å; Y233-I236 PolarHBondContact O-N 3.36Å; Y233-K237 WeakPolarHBondContact O-CB 3.24Å; Y233-K237 PolarHBondContact O-N 3Å; Y233-L240 HydrophobicContact CE2-CD1 3.99Å; Y233-I248 HydrophobicContact CD2-CG2 4.39Å; Y233-I248 HydrophobicContact CE2-CB 4.46Å; Y233-I248 HydrophobicContact CE2-CD1 3.96Å; Y233-I248 HydrophobicContact CE2-CG2 4.03Å
234	T	91	Very high	92.2	Very high	93 Å²	93	63.9 Å²	63.9	57%	0.571	32%	0.321	S	S	*	.	H	α-helix	trans	-61.2	-38.1	176.8	-57.9	0	0	0	0	111.5	H230 A231 L232	H230-T234 PolarHBondContact O-N 3.23Å; H230-T234 PolarHBondContact O-OG1 3.13Å; A231-T234 WeakPolarHBondContact O-CB 3.37Å; A231-T234 PolarHBondContact O-N 3.46Å; L232-T234 VanDerWaalsContact C-N 3.31Å; L232-T234 PolarHBondContact O-N 3.1Å
235	L	89.9	Confident	92.2	Very high	67 Å²	67	66.3 Å²	66.3	35%	0.351	33%	0.327	S	S	.	.	H	α-helix	trans	-64.8	-38.6	177	-177.9	69.5	0	0	0	112.9	P199 L202 A231 L232 Y233 P238	P199-L235 HydrophobicContact CB-CD1 4.04Å; P199-L235 HydrophobicContact CB-CD2 4.21Å; P199-L235 HydrophobicContact CB-CG 4.21Å; P199-L235 HydrophobicContact CG-CD1 3.67Å; P199-L235 HydrophobicContact CG-CD2 3.81Å; P199-L235 HydrophobicContact CG-CG 4.09Å; L202-L235 HydrophobicContact CD1-CD2 4.04Å; A231-L235 PolarHBondContact O-N 3.19Å; L232-L235 HydrophobicContact CD1-CD2 4.45Å; L232-L235 WeakPolarHBondContact O-CB 3.48Å; L232-L235 PolarHBondContact O-N 3.3Å; L232-L235 VanDerWaalsContact O-N 3.16Å; Y233-L235 VanDerWaalsContact C-N 3.26Å; Y233-L235 PolarHBondContact O-N 2.99Å; L235-P238 WeakPolarHBondContact O-CD 3.33Å
236	I	92.6	Very high	92.3	Very high	20 Å²	20	73.4 Å²	73.4	10%	0.103	36%	0.358	C	S	.	.	H	α-helix	trans	-87.3	-19.2	-178.8	65.6	170.6	0	0	0	113.8	L202 I206 L232 Y233 P238 F239 L240	L202-I236 HydrophobicContact CB-CG2 3.59Å; L202-I236 HydrophobicContact CD1-CG2 3.42Å; L202-I236 VanDerWaalsContact CD1-CG2 3.42Å; L202-I236 HydrophobicContact CD2-CG2 4.35Å; L202-I236 HydrophobicContact CG-CG2 3.97Å; I206-I236 HydrophobicContact CD1-CB 3.74Å; I206-I236 HydrophobicContact CD1-CD1 4.43Å; I206-I236 HydrophobicContact CD1-CG2 4.14Å; L232-I236 PolarHBondContact O-N 2.98Å; L232-I236 VanDerWaalsContact O-N 3.13Å; Y233-I236 HydrophobicContact CD2-CD1 4.41Å; Y233-I236 HydrophobicContact CD2-CG1 4.4Å; Y233-I236 VanDerWaalsContact O-CG1 3.26Å; Y233-I236 WeakPolarHBondContact O-CG1 3.41Å; Y233-I236 PolarHBondContact O-N 3.36Å; I236-P238 VanDerWaalsContact C-N 3.27Å; I236-P238 VanDerWaalsContact O-N 3.12Å; I236-F239 WeakPolarHBondContact O-CB 3.24Å; I236-F239 PolarHBondContact O-N 3.01Å; I236-L240 HydrophobicContact CD1-CD1 4.09Å; I236-L240 HydrophobicContact CG1-CD1 4.04Å; I236-L240 PolarHBondContact O-N 2.67Å
237	K	93.9	Very high	92.6	Very high	100 Å²	100	75.6 Å²	75.6	44%	0.435	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-48.9	-37	-178.5	-172.2	179.7	178.7	-176.1	0	114.6	Y233 F239 L240	Y233-K237 WeakPolarHBondContact O-CB 3.24Å; Y233-K237 PolarHBondContact O-N 3Å; K237-F239 VanDerWaalsContact C-N 3.28Å; K237-F239 PolarHBondContact O-N 3.14Å; K237-L240 PolarHBondContact O-N 3.39Å
238	P	94.9	Very high	93	Very high	102 Å²	102	67.1 Å²	67.1	66%	0.662	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-65.3	-25.7	175.4	-23.2	35.8	0	0	0	114.6	L235 I236	L235-P238 WeakPolarHBondContact O-CD 3.33Å; I236-P238 VanDerWaalsContact C-N 3.27Å; I236-P238 VanDerWaalsContact O-N 3.12Å
239	F	94.9	Very high	93.4	Very high	63 Å²	63	68.6 Å²	68.6	28%	0.276	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-88.6	-12.4	179.6	-48.7	-49.9	0	0	0	112.7	P199 K203 I206 Q210 I236 K237	P199-F239 HydrophobicContact CB-CE2 4.41Å; K203-F239 HydrophobicContact CB-CD1 4.38Å; K203-F239 HydrophobicContact CB-CD2 3.93Å; K203-F239 HydrophobicContact CB-CE1 4.4Å; K203-F239 HydrophobicContact CB-CE2 3.95Å; K203-F239 HydrophobicContact CB-CG 4.17Å; K203-F239 HydrophobicContact CB-CZ 4.19Å; K203-F239 HydrophobicContact CD-CD1 4.03Å; K203-F239 HydrophobicContact CD-CE1 3.84Å; K203-F239 HydrophobicContact CD-CZ 4.26Å; K203-F239 HydrophobicContact CG-CD1 4Å; K203-F239 HydrophobicContact CG-CD2 4.39Å; K203-F239 HydrophobicContact CG-CE1 4.2Å; K203-F239 HydrophobicContact CG-CG 4.11Å; K203-F239 HydrophobicContact CG-CZ 4.48Å; I206-F239 HydrophobicContact CD1-CB 3.94Å; I206-F239 HydrophobicContact CD1-CD2 4.4Å; I206-F239 HydrophobicContact CG2-CB 4.19Å; I206-F239 WeakPolarHBondContact CG2-O 3.39Å; Q210-F239 PolarHBondContact NE2-O 2.85Å; I236-F239 WeakPolarHBondContact O-CB 3.24Å; I236-F239 PolarHBondContact O-N 3.01Å; K237-F239 VanDerWaalsContact C-N 3.28Å; K237-F239 PolarHBondContact O-N 3.14Å
240	L	95.4	Very high	93.6	Very high	13 Å²	13	71.5 Å²	71.5	7%	0.068	35%	0.353	C	S	.	.	S	Bend	trans	-89.4	127	-176.6	-63.7	173.8	0	0	0	111.8	I206 Y233 I236 K237 T244 R245 I248	I206-L240 HydrophobicContact CD1-CD2 3.92Å; I206-L240 HydrophobicContact CD1-CG 4.37Å; I206-L240 HydrophobicContact CG1-CD2 4.12Å; I206-L240 HydrophobicContact CG2-CD2 4.07Å; Y233-L240 HydrophobicContact CE2-CD1 3.99Å; I236-L240 HydrophobicContact CD1-CD1 4.09Å; I236-L240 HydrophobicContact CG1-CD1 4.04Å; I236-L240 PolarHBondContact O-N 2.67Å; K237-L240 PolarHBondContact O-N 3.39Å; L240-T244 HydrophobicContact CD2-CG2 3.89Å; L240-R245 HydrophobicContact CB-CG 3.55Å; L240-R245 HydrophobicContact CD1-CG 4.27Å; L240-I248 HydrophobicContact CD1-CD1 3.43Å; L240-I248 VanDerWaalsContact CD1-CD1 3.43Å; L240-I248 HydrophobicContact CD2-CD1 4.2Å; L240-I248 HydrophobicContact CG-CD1 4.45Å
241	K	95.2	Very high	94	Very high	89 Å²	89	67.9 Å²	67.9	39%	0.387	34%	0.337	S	S	.	.			trans	-67.4	152.2	169.1	-72.7	169.6	-179.9	167.4	0	110.5	Q210 D211 K243 T244 R245	Q210-K241 HydrophobicContact CG-CD 4.21Å; D211-K241 WeakPolarHBondContact OD1-CE 3.46Å; D211-K241 IonicContact OD1-NZ 3.46Å; D211-K241 PolarHBondContact OD1-NZ 2.82Å; K241-K243 PolarHBondContact O-N 2.82Å; K241-K243 VanDerWaalsContact O-N 3.14Å; K241-T244 WeakPolarHBondContact O-CA 3.42Å; K241-T244 WeakPolarHBondContact O-CB 3.32Å; K241-T244 PolarHBondContact O-N 2.84Å; K241-R245 PolarHBondContact O-N 2.88Å
242	D	96.1	Very high	94.3	Very high	100 Å²	100	65.6 Å²	65.6	54%	0.535	32%	0.32	S	S	.	.	H	α-helix	trans	-49.5	-44.4	179.7	-78.2	-44.9	0	0	0	113.9	T244 R245 K246	D242-T244 VanDerWaalsContact C-N 3.3Å; D242-T244 PolarHBondContact O-N 3.03Å; D242-R245 PolarHBondContact O-N 3.29Å; D242-R245 IonicContact OD1-CZ 2.72Å; D242-R245 IonicContact OD1-NE 3.53Å; D242-R245 PolarHBondContact OD1-NE 2.97Å; D242-R245 IonicContact OD1-NH2 2.67Å; D242-R245 PolarHBondContact OD1-NH2 3.08Å; D242-K246 WeakPolarHBondContact O-CG 3.01Å; D242-K246 PolarHBondContact O-N 3.02Å
243	K	93.3	Very high	94.5	Very high	110 Å²	110	70.8 Å²	70.8	48%	0.478	35%	0.348	S	S	.	.	H	α-helix	trans	-60.5	-39.7	178.8	-173.5	178.3	178.6	-176.8	0	112.2	K241 R247	K241-K243 PolarHBondContact O-N 2.82Å; K241-K243 VanDerWaalsContact O-N 3.14Å; K243-R247 VanDerWaalsContact CE-CZ 3.48Å; K243-R247 WeakPolarHBondContact O-CD 3.4Å; K243-R247 VanDerWaalsContact O-CG 3.29Å; K243-R247 WeakPolarHBondContact O-CG 3.48Å
244	T	94.4	Very high	94.5	Very high	34 Å²	34	72.4 Å²	72.4	21%	0.209	36%	0.359	C	S	.	.	H	α-helix	trans	-73	-41.4	177.9	-48	0	0	0	0	110.9	Q210 L240 K241 D242 K246 R247 I248	Q210-T244 WeakPolarHBondContact CG-OG1 3.38Å; Q210-T244 PolarHBondContact OE1-OG1 2.87Å; L240-T244 HydrophobicContact CD2-CG2 3.89Å; K241-T244 WeakPolarHBondContact O-CA 3.42Å; K241-T244 WeakPolarHBondContact O-CB 3.32Å; K241-T244 PolarHBondContact O-N 2.84Å; D242-T244 VanDerWaalsContact C-N 3.3Å; D242-T244 PolarHBondContact O-N 3.03Å; T244-K246 VanDerWaalsContact C-N 3.29Å; T244-K246 PolarHBondContact O-N 2.85Å; T244-R247 CarbonylContact O-C 3.39Å; T244-R247 WeakPolarHBondContact O-CA 3.47Å; T244-R247 PolarHBondContact O-N 2.74Å; T244-I248 HydrophobicContact CG2-CD1 4.41Å; T244-I248 PolarHBondContact O-N 2.69Å
245	R	95.8	Very high	94.7	Very high	84 Å²	84	69.8 Å²	69.8	32%	0.317	34%	0.342	S	S	.	.	H	α-helix	trans	-56.2	-43.7	175.8	-65.1	-165.7	-68.6	-151	9.3	112	L240 K241 D242 R247 I248	L240-R245 HydrophobicContact CB-CG 3.55Å; L240-R245 HydrophobicContact CD1-CG 4.27Å; K241-R245 PolarHBondContact O-N 2.88Å; D242-R245 PolarHBondContact O-N 3.29Å; D242-R245 IonicContact OD1-CZ 2.72Å; D242-R245 IonicContact OD1-NE 3.53Å; D242-R245 PolarHBondContact OD1-NE 2.97Å; D242-R245 IonicContact OD1-NH2 2.67Å; D242-R245 PolarHBondContact OD1-NH2 3.08Å; R245-R247 PolarHBondContact O-N 2.96Å; R245-I248 PolarHBondContact O-N 2.95Å
246	K	96.8	Very high	95	Very high	169 Å²	169	71.9 Å²	71.9	74%	0.735	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-11.6	176.4	-69.3	178	-178.1	-175.9	0	114.2	D242 T244	D242-K246 WeakPolarHBondContact O-CG 3.01Å; D242-K246 PolarHBondContact O-N 3.02Å; T244-K246 VanDerWaalsContact C-N 3.29Å; T244-K246 PolarHBondContact O-N 2.85Å
247	R	96.8	Very high	95.2	Very high	78 Å²	78	72.2 Å²	72.2	29%	0.294	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	3.5	-178.5	-69.9	175.4	173.7	-166.3	-6	112.6	F217 G219 V220 K243 T244 R245 F249	F217-R247 VanDerWaalsContact O-CD 3.24Å; F217-R247 WeakPolarHBondContact O-CD 3.22Å; F217-R247 PolarHBondContact O-NH1 2.93Å; G219-R247 CarbonylContact C-O 3.29Å; G219-R247 WeakPolarHBondContact CA-O 3.5Å; V220-R247 PolarHBondContact N-O 2.78Å; K243-R247 VanDerWaalsContact CE-CZ 3.48Å; K243-R247 WeakPolarHBondContact O-CD 3.4Å; K243-R247 VanDerWaalsContact O-CG 3.29Å; K243-R247 WeakPolarHBondContact O-CG 3.48Å; T244-R247 CarbonylContact O-C 3.39Å; T244-R247 WeakPolarHBondContact O-CA 3.47Å; T244-R247 PolarHBondContact O-N 2.74Å; R245-R247 PolarHBondContact O-N 2.96Å; R247-F249 VanDerWaalsContact O-CD2 3.3Å; R247-F249 WeakPolarHBondContact O-CD2 3.21Å; R247-F249 VanDerWaalsContact O-CE2 3.28Å; R247-F249 WeakPolarHBondContact O-CE2 3.38Å
248	I	96.9	Very high	95.4	Very high	24 Å²	24	67.4 Å²	67.4	12%	0.123	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	123.7	171.4	-68.3	165.1	0	0	0	107.9	V220 F222 Y233 L240 T244 R245 L250	V220-I248 HydrophobicContact CB-CG1 4.19Å; V220-I248 CarbonylContact O-C 3.59Å; V220-I248 WeakPolarHBondContact O-CA 3.49Å; F222-I248 HydrophobicContact CD1-CG2 4.2Å; F222-I248 HydrophobicContact CE1-CG2 4Å; Y233-I248 HydrophobicContact CD2-CG2 4.39Å; Y233-I248 HydrophobicContact CE2-CB 4.46Å; Y233-I248 HydrophobicContact CE2-CD1 3.96Å; Y233-I248 HydrophobicContact CE2-CG2 4.03Å; L240-I248 HydrophobicContact CD1-CD1 3.43Å; L240-I248 VanDerWaalsContact CD1-CD1 3.43Å; L240-I248 HydrophobicContact CD2-CD1 4.2Å; L240-I248 HydrophobicContact CG-CD1 4.45Å; T244-I248 HydrophobicContact CG2-CD1 4.41Å; T244-I248 PolarHBondContact O-N 2.69Å; R245-I248 PolarHBondContact O-N 2.95Å; I248-L250 HydrophobicContact CG2-CD2 4.33Å
249	F	96.6	Very high	95.5	Very high	65 Å²	65	64.4 Å²	64.4	29%	0.285	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	124.8	-178.7	-56.1	-82.1	0	0	0	109.2	V220 H221 F222 R247 H251 L261	V220-F249 PolarHBondContact O-N 2.92Å; H221-F249 AromaticContact CE1-CD2 3.47Å; H221-F249 VanDerWaalsContact CE1-CD2 3.47Å; H221-F249 WeakPolarHBondContact CE1-CD2 3.38Å; H221-F249 AromaticContact CE1-CE2 3.99Å; H221-F249 AromaticContact ND1-CD2 3.74Å; H221-F249 AromaticContact NE2-CD2 3.94Å; F222-F249 PolarHBondContact N-O 2.89Å; R247-F249 VanDerWaalsContact O-CD2 3.3Å; R247-F249 WeakPolarHBondContact O-CD2 3.21Å; R247-F249 VanDerWaalsContact O-CE2 3.28Å; R247-F249 WeakPolarHBondContact O-CE2 3.38Å; F249-H251 WeakPolarHBondContact CB-NE2 3.46Å; F249-L261 HydrophobicContact CB-CD1 4.49Å; F249-L261 HydrophobicContact CD1-CD1 3.72Å; F249-L261 HydrophobicContact CD2-CD1 4.11Å; F249-L261 HydrophobicContact CE1-CD1 3.88Å; F249-L261 HydrophobicContact CE2-CD1 4.26Å; F249-L261 HydrophobicContact CG-CD1 3.84Å; F249-L261 HydrophobicContact CZ-CD1 4.15Å
250	L	95.7	Very high	95.6	Very high	61 Å²	61	68.9 Å²	68.9	32%	0.319	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	102.5	177.1	-60.8	-175.6	0	0	0	108.4	F222 I248	F222-L250 HydrophobicContact CB-CD2 3.58Å; F222-L250 HydrophobicContact CD1-CD2 4.17Å; F222-L250 HydrophobicContact CD2-CD2 3.79Å; F222-L250 HydrophobicContact CG-CD2 3.6Å; I248-L250 HydrophobicContact CG2-CD2 4.33Å
251	H	96.3	Very high	95.7	Very high	17 Å²	17	71 Å²	71	8%	0.079	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-21.5	-173.2	-63.2	-69.6	0	0	0	113.1	H221 F222 V223 F249 N254 S257 L258	H221-H251 AromaticContact CG-NE2 3.64Å; H221-H251 AromaticContact ND1-CE1 3.78Å; H221-H251 AromaticContact ND1-NE2 2.92Å; H221-H251 PolarHBondContact ND1-NE2 3.19Å; F222-H251 WeakPolarHBondContact O-CB 3.43Å; F222-H251 PolarHBondContact O-CD2 2.69Å; F222-H251 PolarHBondContact O-N 2.91Å; V223-H251 HydrophobicContact CG1-CB 4.19Å; F249-H251 WeakPolarHBondContact CB-NE2 3.46Å; H251-N254 PolarHBondContact O-N 3.01Å; H251-S257 WeakPolarHBondContact CB-OG 3.09Å; H251-S257 PolarHBondContact CE1-O 3.25Å; H251-S257 PolarHBondContact ND1-OG 3.24Å; H251-L258 PolarHBondContact ND1-N 2.89Å
252	G	94.1	Very high	95.8	Very high	17 Å²	17	66.8 Å²	66.8	18%	0.175	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	61.6	-138.8	-171.4	0	0	0	0	0	109.1	N224 Q225 N254	N224-G252 WeakPolarHBondContact CA-O 3.27Å; N224-G252 PolarHBondContact N-O 2.71Å; Q225-G252 VanDerWaalsContact NE2-CA 3.34Å; Q225-G252 VanDerWaalsContact OE1-CA 3.28Å; G252-N254 VanDerWaalsContact C-N 3.3Å
253	N	92.4	Very high	95.9	Very high	133 Å²	133	65.8 Å²	65.8	71%	0.711	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	5.1	177.8	-57.4	-16.6	0	0	0	112.8	L255	N253-L255 PolarHBondContact O-N 3.48Å
254	N	92.3	Very high	96.1	Very high	81 Å²	81	62.7 Å²	62.7	43%	0.433	31%	0.311	S	S	.	.			trans	-96.2	89.2	-176.1	-178.8	12.8	0	0	0	111.6	H251 G252 N256 S257	H251-N254 PolarHBondContact O-N 3.01Å; G252-N254 VanDerWaalsContact C-N 3.3Å; N254-N256 PolarHBondContact O-N 3.23Å; N254-N256 VanDerWaalsContact OD1-CB 3.3Å; N254-N256 WeakPolarHBondContact OD1-CB 3.42Å; N254-N256 PolarHBondContact OD1-N 2.91Å; N254-S257 PolarHBondContact O-N 3.35Å; N254-S257 PolarHBondContact O-OG 2.94Å
255	L	94.6	Very high	96.2	Very high	39 Å²	39	66 Å²	66	20%	0.204	33%	0.325	C	S	.	.	H	α-helix	trans	-64.7	-21.5	178.1	-63.5	176.9	0	0	0	113.6	V223 N253 S257 L258 H259	V223-L255 HydrophobicContact CB-CD2 4.33Å; V223-L255 HydrophobicContact CG1-CD2 4.21Å; N253-L255 PolarHBondContact O-N 3.48Å; L255-S257 PolarHBondContact O-N 2.8Å; L255-L258 HydrophobicContact CD2-CD2 4.35Å; L255-L258 WeakPolarHBondContact O-CA 3.48Å; L255-L258 VanDerWaalsContact O-CB 3.27Å; L255-L258 WeakPolarHBondContact O-CB 3.39Å; L255-L258 PolarHBondContact O-N 3.26Å; L255-H259 PolarHBondContact O-CD2 2.94Å; L255-H259 VanDerWaalsContact O-CG 3.24Å; L255-H259 PolarHBondContact O-N 3.32Å
256	N	96.3	Very high	96.3	Very high	110 Å²	110	63.8 Å²	63.8	59%	0.588	32%	0.317	S	S	*	.	H	α-helix	trans	-59.9	-33.7	175	-62.8	-37.7	0	0	0	111.8	N254 L258 H259 Q260	N254-N256 PolarHBondContact O-N 3.23Å; N254-N256 VanDerWaalsContact OD1-CB 3.3Å; N254-N256 WeakPolarHBondContact OD1-CB 3.42Å; N254-N256 PolarHBondContact OD1-N 2.91Å; N256-L258 VanDerWaalsContact C-N 3.3Å; N256-L258 PolarHBondContact O-N 3.34Å; N256-H259 PolarHBondContact O-N 3.29Å; N256-Q260 WeakPolarHBondContact O-CG 3.11Å; N256-Q260 PolarHBondContact O-N 3.19Å; N256-Q260 VanDerWaalsContact O-N 3.07Å
257	S	97.1	Very high	96.4	Very high	27 Å²	27	55.8 Å²	55.8	19%	0.189	28%	0.282	C	S	.	.	H	α-helix	trans	-70	-26.7	176	69.9	0	0	0	0	112.9	H251 N254 L255	H251-S257 WeakPolarHBondContact CB-OG 3.09Å; H251-S257 PolarHBondContact CE1-O 3.25Å; H251-S257 PolarHBondContact ND1-OG 3.24Å; N254-S257 PolarHBondContact O-N 3.35Å; N254-S257 PolarHBondContact O-OG 2.94Å; L255-S257 PolarHBondContact O-N 2.8Å
258	L	97.7	Very high	96.4	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-71.8	-44.5	168.7	-179.9	70.6	0	0	0	110	H221 V223 H251 L255 N256 Q260 L261 I262 L267 F271	H221-L258 HydrophobicContact CB-CD1 3.73Å; V223-L258 HydrophobicContact CG1-CD2 4.09Å; H251-L258 PolarHBondContact ND1-N 2.89Å; L255-L258 HydrophobicContact CD2-CD2 4.35Å; L255-L258 WeakPolarHBondContact O-CA 3.48Å; L255-L258 VanDerWaalsContact O-CB 3.27Å; L255-L258 WeakPolarHBondContact O-CB 3.39Å; L255-L258 PolarHBondContact O-N 3.26Å; N256-L258 VanDerWaalsContact C-N 3.3Å; N256-L258 PolarHBondContact O-N 3.34Å; L258-Q260 PolarHBondContact O-N 3.35Å; L258-L261 WeakPolarHBondContact O-CA 3.34Å; L258-L261 PolarHBondContact O-N 3.07Å; L258-I262 HydrophobicContact CD1-CD1 3.84Å; L258-I262 HydrophobicContact CD1-CG1 4.49Å; L258-I262 PolarHBondContact O-N 3.48Å; L258-L267 HydrophobicContact CD2-CD1 3.93Å; L258-L267 HydrophobicContact CG-CD1 4.33Å; L258-F271 HydrophobicContact CD2-CB 4.07Å; L258-F271 HydrophobicContact CD2-CD1 4.47Å
259	H	97.8	Very high	96.4	Very high	38 Å²	38	53.7 Å²	53.7	18%	0.176	28%	0.282	C	S	.	.	H	α-helix	trans	-64.3	-25.6	-177.1	-60.3	164.2	0	0	0	114.1	L255 N256 L261 I262 P264 F271 G272	L255-H259 PolarHBondContact O-CD2 2.94Å; L255-H259 VanDerWaalsContact O-CG 3.24Å; L255-H259 PolarHBondContact O-N 3.32Å; N256-H259 PolarHBondContact O-N 3.29Å; H259-L261 PolarHBondContact O-N 3.06Å; H259-I262 CarbonylContact C-O 3.51Å; H259-I262 VanDerWaalsContact CA-O 3.25Å; H259-I262 WeakPolarHBondContact CA-O 3.36Å; H259-P264 HydrophobicContact CB-CG 4.05Å; H259-F271 PolarHBondContact NE2-O 3.29Å; H259-G272 PolarHBondContact CE1-O 3.21Å
260	Q	96.4	Very high	96.4	Very high	158 Å²	158	51.6 Å²	51.6	74%	0.738	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-21.8	170.1	-74	172.8	6.6	0	0	113.4	N256 L258	N256-Q260 WeakPolarHBondContact O-CG 3.11Å; N256-Q260 PolarHBondContact O-N 3.19Å; N256-Q260 VanDerWaalsContact O-N 3.07Å; L258-Q260 PolarHBondContact O-N 3.35Å
261	L	96.7	Very high	96.5	Very high	58 Å²	58	48.7 Å²	48.7	30%	0.304	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-25.3	-176.7	-59.4	178.5	0	0	0	113.1	H135 F249 L258 H259	H135-L261 PolarHBondContact CE1-O 3.37Å; F249-L261 HydrophobicContact CB-CD1 4.49Å; F249-L261 HydrophobicContact CD1-CD1 3.72Å; F249-L261 HydrophobicContact CD2-CD1 4.11Å; F249-L261 HydrophobicContact CE1-CD1 3.88Å; F249-L261 HydrophobicContact CE2-CD1 4.26Å; F249-L261 HydrophobicContact CG-CD1 3.84Å; F249-L261 HydrophobicContact CZ-CD1 4.15Å; L258-L261 WeakPolarHBondContact O-CA 3.34Å; L258-L261 PolarHBondContact O-N 3.07Å; H259-L261 PolarHBondContact O-N 3.06Å
262	I	97.4	Very high	96.5	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.273	C	S	.	.	S	Bend	trans	-139.5	118.6	-179.7	-49.4	173.8	0	0	0	108.1	D134 I140 I181 I183 L258 H259 L267	D134-I262 HydrophobicContact CB-CG2 4.41Å; I140-I262 HydrophobicContact CD1-CG2 4.23Å; I181-I262 HydrophobicContact CG2-CD1 3.71Å; I183-I262 HydrophobicContact CD1-CD1 3.8Å; I183-I262 HydrophobicContact CG1-CD1 4.25Å; L258-I262 HydrophobicContact CD1-CD1 3.84Å; L258-I262 HydrophobicContact CD1-CG1 4.49Å; L258-I262 PolarHBondContact O-N 3.48Å; H259-I262 CarbonylContact C-O 3.51Å; H259-I262 VanDerWaalsContact CA-O 3.25Å; H259-I262 WeakPolarHBondContact CA-O 3.36Å; I262-L267 HydrophobicContact CB-CD1 4.25Å; I262-L267 HydrophobicContact CG2-CD1 4.09Å; I262-L267 HydrophobicContact CG2-CD2 3.9Å; I262-L267 HydrophobicContact CG2-CG 3.93Å
263	H	97.6	Very high	96.6	Very high	78 Å²	78	49.7 Å²	49.7	36%	0.361	27%	0.273	S	S	.	.			trans	-64.7	141.7	-176.1	-60.1	177.7	0	0	0	111.8	H135 E265 F266	H135-H263 AromaticContact CD2-CE1 3.91Å; H135-H263 AromaticContact CD2-NE2 3.71Å; H135-H263 AromaticContact CE1-CD2 3.73Å; H135-H263 AromaticContact CE1-NE2 3.98Å; H135-H263 AromaticContact CG-CE1 3.96Å; H135-H263 AromaticContact ND1-CD2 3.92Å; H135-H263 AromaticContact ND1-CG 3.98Å; H135-H263 AromaticContact NE2-CD2 3.87Å; H135-H263 AromaticContact NE2-NE2 3.66Å; H263-E265 HydrophobicContact CB-CG 4.05Å; H263-E265 IonicContact CG-OE1 3.55Å; H263-E265 IonicContact ND1-OE1 3.53Å; H263-E265 PolarHBondContact ND1-OE1 3.18Å; H263-E265 PolarHBondContact O-N 2.8Å; H263-E265 VanDerWaalsContact O-N 3.07Å; H263-F266 HydrophobicContact CB-CD2 3.79Å; H263-F266 HydrophobicContact CB-CE2 3.85Å; H263-F266 PolarHBondContact O-N 3.21Å; H263-F266 VanDerWaalsContact O-N 3.09Å
264	P	97.4	Very high	96.8	Very high	46 Å²	46	48.5 Å²	48.5	30%	0.299	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-54.4	-27.6	179.2	-28.4	35.1	0	0	0	114.9	H259 F266 L267 G273 T274	H259-P264 HydrophobicContact CB-CG 4.05Å; P264-F266 PolarHBondContact O-N 2.95Å; P264-L267 PolarHBondContact O-N 3.45Å; P264-L267 VanDerWaalsContact O-N 3.14Å; P264-G273 CarbonylContact O-C 3.49Å; P264-G273 WeakPolarHBondContact O-CA 3.41Å; P264-T274 PolarHBondContact O-N 3.2Å
265	E	97.9	Very high	97.1	Very high	104 Å²	104	46.7 Å²	46.7	49%	0.486	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-63.1	-22.7	179.4	71	-171	136	0	0	114.1	H263 T274 L275	H263-E265 HydrophobicContact CB-CG 4.05Å; H263-E265 IonicContact CG-OE1 3.55Å; H263-E265 IonicContact ND1-OE1 3.53Å; H263-E265 PolarHBondContact ND1-OE1 3.18Å; H263-E265 PolarHBondContact O-N 2.8Å; H263-E265 VanDerWaalsContact O-N 3.07Å; E265-T274 WeakPolarHBondContact CA-OG1 3.12Å; E265-L275 WeakPolarHBondContact O-CD2 3.29Å; E265-L275 WeakPolarHBondContact O-CG 3.39Å
266	F	97.4	Very high	97.2	Very high	37 Å²	37	49.5 Å²	49.5	16%	0.162	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-97.8	4.2	179.2	-53.8	-69.9	0	0	0	113.2	L130 R133 H135 I140 H263 P264	L130-F266 VanDerWaalsContact CD1-O 3.29Å; L130-F266 WeakPolarHBondContact CD1-O 3.23Å; R133-F266 WeakPolarHBondContact O-CD1 3.41Å; H135-F266 HydrophobicContact CB-CD2 4.46Å; H135-F266 HydrophobicContact CB-CE2 3.63Å; H135-F266 HydrophobicContact CB-CZ 4.07Å; I140-F266 HydrophobicContact CD1-CB 4.2Å; H263-F266 HydrophobicContact CB-CD2 3.79Å; H263-F266 HydrophobicContact CB-CE2 3.85Å; H263-F266 PolarHBondContact O-N 3.21Å; H263-F266 VanDerWaalsContact O-N 3.09Å; P264-F266 PolarHBondContact O-N 2.95Å
267	L	98.2	Very high	97.2	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	28%	0.275	C	S	.	.	S	Bend	trans	-116.3	142.2	-171.6	-68.7	176.3	0	0	0	111.7	I140 I183 L258 I262 P264 F271 G273 T274 L275	I140-L267 HydrophobicContact CD1-CD2 4.44Å; I183-L267 HydrophobicContact CD1-CD2 3.57Å; L258-L267 HydrophobicContact CD2-CD1 3.93Å; L258-L267 HydrophobicContact CG-CD1 4.33Å; I262-L267 HydrophobicContact CB-CD1 4.25Å; I262-L267 HydrophobicContact CG2-CD1 4.09Å; I262-L267 HydrophobicContact CG2-CD2 3.9Å; I262-L267 HydrophobicContact CG2-CG 3.93Å; P264-L267 PolarHBondContact O-N 3.45Å; P264-L267 VanDerWaalsContact O-N 3.14Å; L267-F271 HydrophobicContact CB-CB 4.25Å; L267-F271 HydrophobicContact CD1-CB 4.28Å; L267-F271 HydrophobicContact CD2-CB 4.5Å; L267-G273 CarbonylContact O-C 3.35Å; L267-G273 WeakPolarHBondContact O-CA 3.23Å; L267-T274 PolarHBondContact O-N 3.45Å; L267-L275 VanDerWaalsContact O-CB 3.26Å; L267-L275 WeakPolarHBondContact O-CB 3.24Å; L267-L275 WeakPolarHBondContact O-CG 3.11Å; L267-L275 PolarHBondContact O-N 3.33Å
268	P	97.8	Very high	97.2	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.006	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-60.1	160.4	165	-24.8	33.8	0	0	0	113.4	L130 L142 E270 F271 G273	L130-P268 HydrophobicContact CD1-CG 4.28Å; L130-P268 HydrophobicContact CD2-CG 3.68Å; L142-P268 HydrophobicContact CD1-CG 4.16Å; P268-E270 WeakPolarHBondContact CB-OE2 3.23Å; P268-E270 PolarHBondContact O-N 3.23Å; P268-F271 HydrophobicContact CB-CD2 4.26Å; P268-F271 HydrophobicContact CG-CD2 4.29Å; P268-F271 PolarHBondContact O-N 2.88Å; P268-G273 PolarHBondContact O-N 3.31Å; P268-G273 VanDerWaalsContact O-N 3.1Å
269	S	97.1	Very high	97	Very high	58 Å²	58	50 Å²	50	41%	0.406	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-56	-30.5	178.7	65.5	0	0	0	0	114.3	F271 G272 L275 P277	S269-F271 PolarHBondContact O-N 3.5Å; S269-G272 PolarHBondContact O-N 3.01Å; S269-L275 PolarHBondContact N-O 2.65Å; S269-L275 VanDerWaalsContact N-O 3.12Å; S269-P277 WeakPolarHBondContact OG-CG 3.3Å
270	E	95.9	Very high	96.7	Very high	20 Å²	20	48.8 Å²	48.8	9%	0.093	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-57.6	-31	176.1	-67.3	88.6	157.5	0	0	112.3	F144 P268 P277 Y278 Y303	F144-E270 HydrophobicContact CE1-CB 4.13Å; F144-E270 HydrophobicContact CE1-CG 4.07Å; F144-E270 HydrophobicContact CZ-CG 4.4Å; P268-E270 WeakPolarHBondContact CB-OE2 3.23Å; P268-E270 PolarHBondContact O-N 3.23Å; E270-P277 VanDerWaalsContact OE1-CA 3.32Å; E270-P277 WeakPolarHBondContact OE1-CA 3.46Å; E270-P277 WeakPolarHBondContact OE1-CB 3.5Å; E270-P277 WeakPolarHBondContact OE2-CA 3.25Å; E270-Y278 PolarHBondContact OE1-N 3.15Å; E270-Y278 PolarHBondContact OE2-N 3Å; E270-Y303 HydrophobicContact CB-CE1 4.45Å; E270-Y303 WeakPolarHBondContact CB-OH 3.04Å; E270-Y303 HydrophobicContact CG-CD1 4.42Å; E270-Y303 HydrophobicContact CG-CE1 3.3Å; E270-Y303 WeakPolarHBondContact CG-OH 3.37Å
271	F	97.3	Very high	96.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-104.8	19.4	179	-53.8	-73	0	0	0	111.8	L142 F144 I183 D185 V223 L258 H259 L267 P268 S269 G273	L142-F271 HydrophobicContact CD1-CE2 3.94Å; L142-F271 HydrophobicContact CD2-CD2 4.43Å; L142-F271 HydrophobicContact CD2-CE2 3.68Å; L142-F271 HydrophobicContact CD2-CZ 4Å; L142-F271 HydrophobicContact CG-CE2 4.36Å; F144-F271 HydrophobicContact CE1-CE2 4.06Å; F144-F271 AromaticContact CE1-CZ 3.76Å; F144-F271 HydrophobicContact CE1-CZ 3.76Å; F144-F271 AromaticContact CZ-CE2 3.74Å; F144-F271 HydrophobicContact CZ-CE2 3.74Å; F144-F271 AromaticContact CZ-CZ 3.8Å; F144-F271 HydrophobicContact CZ-CZ 3.8Å; I183-F271 HydrophobicContact CG2-CD1 3.85Å; I183-F271 HydrophobicContact CG2-CE1 3.48Å; I183-F271 VanDerWaalsContact CG2-CE1 3.48Å; I183-F271 HydrophobicContact CG2-CZ 4Å; D185-F271 HydrophobicContact CB-CE1 3.94Å; D185-F271 HydrophobicContact CB-CZ 4.23Å; V223-F271 HydrophobicContact CG2-CD1 3.92Å; V223-F271 HydrophobicContact CG2-CE1 3.71Å; L258-F271 HydrophobicContact CD2-CB 4.07Å; L258-F271 HydrophobicContact CD2-CD1 4.47Å; H259-F271 PolarHBondContact NE2-O 3.29Å; L267-F271 HydrophobicContact CB-CB 4.25Å; L267-F271 HydrophobicContact CD1-CB 4.28Å; L267-F271 HydrophobicContact CD2-CB 4.5Å; P268-F271 HydrophobicContact CB-CD2 4.26Å; P268-F271 HydrophobicContact CG-CD2 4.29Å; P268-F271 PolarHBondContact O-N 2.88Å; S269-F271 PolarHBondContact O-N 3.5Å; F271-G273 VanDerWaalsContact C-N 3.26Å; F271-G273 PolarHBondContact O-N 2.78Å
272	G	96.1	Very high	96.4	Very high	39 Å²	39	40.7 Å²	40.7	40%	0.402	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.1	24.6	-179.7	0	0	0	0	0	113.5	H259 S269	H259-G272 PolarHBondContact CE1-O 3.21Å; S269-G272 PolarHBondContact O-N 3.01Å
273	G	97.2	Very high	96.3	Very high	16 Å²	16	41.5 Å²	41.5	17%	0.165	25%	0.246	C	C	.	.			trans	-92.2	-176.4	177.2	0	0	0	0	0	114	P264 L267 P268 F271	P264-G273 CarbonylContact O-C 3.49Å; P264-G273 WeakPolarHBondContact O-CA 3.41Å; L267-G273 CarbonylContact O-C 3.35Å; L267-G273 WeakPolarHBondContact O-CA 3.23Å; P268-G273 PolarHBondContact O-N 3.31Å; P268-G273 VanDerWaalsContact O-N 3.1Å; F271-G273 VanDerWaalsContact C-N 3.26Å; F271-G273 PolarHBondContact O-N 2.78Å
274	T	97.3	Very high	96.2	Very high	108 Å²	108	37.8 Å²	37.8	66%	0.663	23%	0.228	S	C	*	.	S	Bend	trans	-101.6	-6	-177.2	68.1	0	0	0	0	113.9	P264 E265 L267	P264-T274 PolarHBondContact O-N 3.2Å; E265-T274 WeakPolarHBondContact CA-OG1 3.12Å; L267-T274 PolarHBondContact O-N 3.45Å
275	L	97.2	Very high	96.1	Very high	43 Å²	43	39.7 Å²	39.7	23%	0.225	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-74.4	155.2	172.8	-57.5	179.9	0	0	0	109.9	E265 L267 S269	E265-L275 WeakPolarHBondContact O-CD2 3.29Å; E265-L275 WeakPolarHBondContact O-CG 3.39Å; L267-L275 VanDerWaalsContact O-CB 3.26Å; L267-L275 WeakPolarHBondContact O-CB 3.24Å; L267-L275 WeakPolarHBondContact O-CG 3.11Å; L267-L275 PolarHBondContact O-N 3.33Å; S269-L275 PolarHBondContact N-O 2.65Å; S269-L275 VanDerWaalsContact N-O 3.12Å
276	P	96.7	Very high	95.9	Very high	99 Å²	99	39.1 Å²	39.1	64%	0.643	23%	0.233	S	C	*	.	P	Polyproline II helix	trans	-58.9	165.8	173.5	26.4	-36.1	0	0	0	111.8	Y278	P276-Y278 PolarHBondContact O-N 3.4Å
277	P	96.6	Very high	95.8	Very high	71 Å²	71	39 Å²	39	46%	0.461	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-48.6	140.7	170.4	-25.8	33.2	0	0	0	111.9	S269 E270 D279	S269-P277 WeakPolarHBondContact OG-CG 3.3Å; E270-P277 VanDerWaalsContact OE1-CA 3.32Å; E270-P277 WeakPolarHBondContact OE1-CA 3.46Å; E270-P277 WeakPolarHBondContact OE1-CB 3.5Å; E270-P277 WeakPolarHBondContact OE2-CA 3.25Å; P277-D279 PolarHBondContact O-N 2.97Å
278	Y	96.4	Very high	95.5	Very high	21 Å²	21	39.5 Å²	39.5	8%	0.082	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-71.3	119.6	-178.4	-174.4	-106.3	0	0	0	110.4	G128 V129 L130 L142 F144 E270 P276 M280	G128-Y278 VanDerWaalsContact CA-OH 3.32Å; G128-Y278 WeakPolarHBondContact CA-OH 3.46Å; V129-Y278 PolarHBondContact N-OH 3.29Å; V129-Y278 WeakPolarHBondContact O-CE2 3.23Å; V129-Y278 PolarHBondContact O-OH 3.2Å; L130-Y278 HydrophobicContact CD2-CD2 3.48Å; L130-Y278 VanDerWaalsContact CD2-CD2 3.48Å; L130-Y278 HydrophobicContact CD2-CE2 3.72Å; L130-Y278 HydrophobicContact CD2-CG 4.49Å; L142-Y278 HydrophobicContact CD1-CD1 4.13Å; L142-Y278 HydrophobicContact CD1-CD2 3.94Å; L142-Y278 HydrophobicContact CD1-CE2 4.41Å; L142-Y278 HydrophobicContact CD1-CG 3.8Å; F144-Y278 AromaticContact CE2-CD1 3.87Å; F144-Y278 HydrophobicContact CE2-CD1 3.87Å; F144-Y278 HydrophobicContact CE2-CG 4.41Å; E270-Y278 PolarHBondContact OE1-N 3.15Å; E270-Y278 PolarHBondContact OE2-N 3Å; P276-Y278 PolarHBondContact O-N 3.4Å; Y278-M280 HydrophobicContact CD1-CE 4.28Å; Y278-M280 HydrophobicContact CD1-SD 3.82Å; Y278-M280 HydrophobicContact CE1-SD 4.27Å; Y278-M280 PolarHBondContact O-N 2.78Å
279	D	94.7	Very high	95.1	Very high	55 Å²	55	41.2 Å²	41.2	29%	0.294	26%	0.255	S	S	.	.			trans	-78.4	108.4	169.7	175.5	-8.9	0	0	0	109.7	P277 G281 T282 R285	P277-D279 PolarHBondContact O-N 2.97Å; D279-G281 PolarHBondContact O-N 3.02Å; D279-G281 VanDerWaalsContact O-N 3.15Å; D279-G281 PolarHBondContact OD1-N 3.14Å; D279-T282 WeakPolarHBondContact CB-OG1 3.45Å; D279-T282 VanDerWaalsContact O-CB 3.23Å; D279-T282 WeakPolarHBondContact O-CB 3.19Å; D279-T282 PolarHBondContact O-N 3.24Å; D279-T282 PolarHBondContact O-OG1 3.41Å; D279-R285 VanDerWaalsContact CG-NH2 3.29Å; D279-R285 IonicContact OD1-NH1 2.78Å; D279-R285 IonicContact OD1-NH2 2.66Å; D279-R285 IonicContact OD2-CZ 3.43Å; D279-R285 IonicContact OD2-NH1 2.69Å; D279-R285 PolarHBondContact OD2-NH1 2.84Å; D279-R285 IonicContact OD2-NH2 3.6Å; D279-R285 PolarHBondContact OD2-NH2 3.39Å
280	M	91.9	Very high	94.3	Very high	12 Å²	12	44.9 Å²	44.9	6%	0.059	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-29.1	-177.9	-57.9	-64.6	161.1	0	0	113.5	F144 Y278 T282	F144-M280 HydrophobicContact CB-CE 4.48Å; F144-M280 HydrophobicContact CD1-CE 4.15Å; F144-M280 HydrophobicContact CD2-CE 3.36Å; F144-M280 HydrophobicContact CD2-SD 3.5Å; F144-M280 WeakPolarHBondContact CD2-SD 3.38Å; F144-M280 HydrophobicContact CE1-CE 4.18Å; F144-M280 HydrophobicContact CE2-CE 3.4Å; F144-M280 HydrophobicContact CE2-SD 3.76Å; F144-M280 HydrophobicContact CG-CE 3.75Å; F144-M280 HydrophobicContact CG-SD 4.27Å; F144-M280 HydrophobicContact CZ-CE 3.8Å; Y278-M280 HydrophobicContact CD1-CE 4.28Å; Y278-M280 HydrophobicContact CD1-SD 3.82Å; Y278-M280 HydrophobicContact CE1-SD 4.27Å; Y278-M280 PolarHBondContact O-N 2.78Å; M280-T282 VanDerWaalsContact C-N 3.31Å; M280-T282 PolarHBondContact O-N 3.21Å
281	G	91.3	Very high	93.3	Very high	1 Å²	1	49 Å²	49	1%	0.01	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-11.5	-180	0	0	0	0	0	113.7	D279 W283 A284 R285	D279-G281 PolarHBondContact O-N 3.02Å; D279-G281 VanDerWaalsContact O-N 3.15Å; D279-G281 PolarHBondContact OD1-N 3.14Å; G281-W283 PolarHBondContact O-N 3.22Å; G281-A284 PolarHBondContact O-N 3.33Å; G281-R285 WeakPolarHBondContact O-CG 3.34Å; G281-R285 PolarHBondContact O-N 2.82Å
282	T	94.1	Very high	92.4	Very high	45 Å²	45	50.8 Å²	50.8	28%	0.276	31%	0.307	S	S	.	.	H	α-helix	trans	-55.1	-50	-174	-59.4	0	0	0	0	112.2	D279 M280 R285 T286	D279-T282 WeakPolarHBondContact CB-OG1 3.45Å; D279-T282 VanDerWaalsContact O-CB 3.23Å; D279-T282 WeakPolarHBondContact O-CB 3.19Å; D279-T282 PolarHBondContact O-N 3.24Å; D279-T282 PolarHBondContact O-OG1 3.41Å; M280-T282 VanDerWaalsContact C-N 3.31Å; M280-T282 PolarHBondContact O-N 3.21Å; T282-R285 VanDerWaalsContact CA-NH2 3.32Å; T282-R285 PolarHBondContact O-N 2.83Å; T282-R285 PolarHBondContact OG1-NH2 3.44Å; T282-T286 PolarHBondContact O-N 3.39Å; T282-T286 PolarHBondContact O-OG1 3.09Å
283	W	96.6	Very high	91.1	Very high	17 Å²	17	51.8 Å²	51.8	6%	0.064	31%	0.308	C	S	.	.	H	α-helix	trans	-71.7	-36.6	-177.5	-175.5	-123.5	0	0	0	112.7	V129 S165 V168 L169 G281 R285 T286 L287	V129-W283 HydrophobicContact CB-CB 4.18Å; V129-W283 HydrophobicContact CB-CD2 3.65Å; V129-W283 HydrophobicContact CB-CE3 3.73Å; V129-W283 HydrophobicContact CB-CG 3.84Å; V129-W283 HydrophobicContact CB-CZ3 4.38Å; V129-W283 HydrophobicContact CG1-CD2 4.37Å; V129-W283 HydrophobicContact CG1-CE3 4.06Å; V129-W283 HydrophobicContact CG1-CZ3 4.24Å; V129-W283 HydrophobicContact CG2-CB 4.3Å; V129-W283 HydrophobicContact CG2-CD2 3.46Å; V129-W283 VanDerWaalsContact CG2-CD2 3.46Å; V129-W283 HydrophobicContact CG2-CE3 4Å; V129-W283 HydrophobicContact CG2-CG 3.57Å; V129-W283 HydrophobicContact CG2-CZ2 4.19Å; S165-W283 PolarHBondContact OG-NE1 3.46Å; V168-W283 HydrophobicContact CG1-CH2 4.36Å; L169-W283 HydrophobicContact CD1-CZ2 4.47Å; L169-W283 HydrophobicContact CD2-CH2 3.73Å; L169-W283 HydrophobicContact CD2-CZ2 4.37Å; L169-W283 HydrophobicContact CD2-CZ3 4.27Å; L169-W283 HydrophobicContact CG-CH2 4Å; L169-W283 HydrophobicContact CG-CZ2 4.17Å; G281-W283 PolarHBondContact O-N 3.22Å; W283-R285 VanDerWaalsContact C-N 3.34Å; W283-R285 PolarHBondContact O-N 3.34Å; W283-T286 HydrophobicContact CE3-CG2 4.09Å; W283-T286 HydrophobicContact CZ3-CG2 3.72Å; W283-T286 WeakPolarHBondContact O-CB 3.32Å; W283-T286 PolarHBondContact O-N 3.17Å; W283-L287 HydrophobicContact CD2-CD1 4.45Å; W283-L287 HydrophobicContact CD2-CG 4.28Å; W283-L287 HydrophobicContact CH2-CD2 3.99Å; W283-L287 HydrophobicContact CH2-CG 4.31Å; W283-L287 HydrophobicContact CZ2-CD1 3.79Å; W283-L287 HydrophobicContact CZ2-CD2 3.69Å; W283-L287 HydrophobicContact CZ2-CG 3.76Å; W283-L287 PolarHBondContact O-N 3.19Å; W283-L287 VanDerWaalsContact O-N 3.1Å
284	A	95.6	Very high	89.5	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-59.6	-44.8	174.5	0	0	0	0	0	111.5	L122 I123 G281 T286 L287 L288 Y292	L122-A284 HydrophobicContact CB-CB 4.03Å; I123-A284 HydrophobicContact CG1-CB 4.15Å; G281-A284 PolarHBondContact O-N 3.33Å; A284-T286 VanDerWaalsContact C-N 3.31Å; A284-T286 PolarHBondContact O-N 3.07Å; A284-L287 PolarHBondContact O-N 3.36Å; A284-L288 HydrophobicContact CB-CD1 4.19Å; A284-L288 VanDerWaalsContact O-CB 3.25Å; A284-L288 WeakPolarHBondContact O-CB 3.01Å; A284-L288 WeakPolarHBondContact O-CG 3.49Å; A284-L288 PolarHBondContact O-N 3.09Å; A284-Y292 HydrophobicContact CB-CD2 4Å; A284-Y292 HydrophobicContact CB-CE2 3.89Å
285	R	94.6	Very high	87.5	Confident	86 Å²	86	60 Å²	60	33%	0.325	34%	0.338	S	S	.	.	H	α-helix	trans	-59.8	-40.5	175.8	-74.2	-175.3	-59.8	-98.3	4.6	112.3	D279 G281 T282 W283 G289 Y292	D279-R285 VanDerWaalsContact CG-NH2 3.29Å; D279-R285 IonicContact OD1-NH1 2.78Å; D279-R285 IonicContact OD1-NH2 2.66Å; D279-R285 IonicContact OD2-CZ 3.43Å; D279-R285 IonicContact OD2-NH1 2.69Å; D279-R285 PolarHBondContact OD2-NH1 2.84Å; D279-R285 IonicContact OD2-NH2 3.6Å; D279-R285 PolarHBondContact OD2-NH2 3.39Å; G281-R285 WeakPolarHBondContact O-CG 3.34Å; G281-R285 PolarHBondContact O-N 2.82Å; T282-R285 VanDerWaalsContact CA-NH2 3.32Å; T282-R285 PolarHBondContact O-N 2.83Å; T282-R285 PolarHBondContact OG1-NH2 3.44Å; W283-R285 VanDerWaalsContact C-N 3.34Å; W283-R285 PolarHBondContact O-N 3.34Å; R285-G289 WeakPolarHBondContact O-CA 3.49Å; R285-G289 PolarHBondContact O-N 2.66Å; R285-Y292 HydrophobicContact CB-CG 4.46Å; R285-Y292 HydrophobicContact CG-CD1 3.45Å; R285-Y292 VanDerWaalsContact CG-CD1 3.45Å; R285-Y292 HydrophobicContact CG-CD2 3.69Å; R285-Y292 HydrophobicContact CG-CE1 3.51Å; R285-Y292 HydrophobicContact CG-CE2 3.77Å; R285-Y292 HydrophobicContact CG-CG 3.53Å
286	T	94.8	Very high	85.3	Confident	92 Å²	92	61.4 Å²	61.4	56%	0.564	35%	0.346	S	S	*	.	H	α-helix	trans	-62.5	-42.4	176.5	-58.8	0	0	0	0	112.5	T282 W283 A284	T282-T286 PolarHBondContact O-N 3.39Å; T282-T286 PolarHBondContact O-OG1 3.09Å; W283-T286 HydrophobicContact CE3-CG2 4.09Å; W283-T286 HydrophobicContact CZ3-CG2 3.72Å; W283-T286 WeakPolarHBondContact O-CB 3.32Å; W283-T286 PolarHBondContact O-N 3.17Å; A284-T286 VanDerWaalsContact C-N 3.31Å; A284-T286 PolarHBondContact O-N 3.07Å
287	L	95.1	Very high	82.7	Confident	35 Å²	35	64 Å²	64	18%	0.183	35%	0.354	C	S	.	.	H	α-helix	trans	-82.8	-34.4	-176.7	-70.8	-174.1	0	0	0	114.3	A113 L122 V168 W283 A284	A113-L287 HydrophobicContact CB-CB 4.1Å; L122-L287 HydrophobicContact CD1-CB 4.4Å; L122-L287 HydrophobicContact CD1-CD1 3.78Å; L122-L287 HydrophobicContact CD2-CD1 3.9Å; V168-L287 HydrophobicContact CB-CD2 4.19Å; V168-L287 HydrophobicContact CG1-CD2 3.91Å; V168-L287 HydrophobicContact CG2-CD2 3.9Å; W283-L287 HydrophobicContact CD2-CD1 4.45Å; W283-L287 HydrophobicContact CD2-CG 4.28Å; W283-L287 HydrophobicContact CH2-CD2 3.99Å; W283-L287 HydrophobicContact CH2-CG 4.31Å; W283-L287 HydrophobicContact CZ2-CD1 3.79Å; W283-L287 HydrophobicContact CZ2-CD2 3.69Å; W283-L287 HydrophobicContact CZ2-CG 3.76Å; W283-L287 PolarHBondContact O-N 3.19Å; W283-L287 VanDerWaalsContact O-N 3.1Å; A284-L287 PolarHBondContact O-N 3.36Å
288	L	91.9	Very high	80.6	Confident	11 Å²	11	69.2 Å²	69.2	6%	0.058	37%	0.366	C	S	.	.	H	α-helix	trans	-92	-22.4	-176.1	-65.7	163.9	0	0	0	112.3	A113 K119 I123 A284 D291 Y292	A113-L288 HydrophobicContact CB-CD2 3.95Å; A113-L288 WeakPolarHBondContact O-CD2 3.39Å; K119-L288 HydrophobicContact CD-CD1 4.45Å; K119-L288 HydrophobicContact CD-CD2 4.13Å; K119-L288 HydrophobicContact CG-CD1 3.9Å; K119-L288 HydrophobicContact CG-CD2 4.03Å; I123-L288 HydrophobicContact CG1-CD1 4.34Å; A284-L288 HydrophobicContact CB-CD1 4.19Å; A284-L288 VanDerWaalsContact O-CB 3.25Å; A284-L288 WeakPolarHBondContact O-CB 3.01Å; A284-L288 WeakPolarHBondContact O-CG 3.49Å; A284-L288 PolarHBondContact O-N 3.09Å; L288-D291 PolarHBondContact O-N 3.18Å; L288-Y292 HydrophobicContact CD1-CD2 4.13Å
289	G	89	Confident	78.2	Confident	37 Å²	37	70.6 Å²	70.6	38%	0.381	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	52.6	-126.2	-179.3	0	0	0	0	0	111.7	R285 D291 Y292	R285-G289 WeakPolarHBondContact O-CA 3.49Å; R285-G289 PolarHBondContact O-N 2.66Å; G289-D291 PolarHBondContact O-N 3.46Å; G289-Y292 WeakPolarHBondContact O-CB 3.47Å; G289-Y292 PolarHBondContact O-N 3.5Å
290	P	79.6	Confident	75.9	Confident	135 Å²	135	74.5 Å²	74.5	88%	0.877	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-60	-23.5	179.5	-22.3	33.2	0	0	0	115.2	Y292	P290-Y292 PolarHBondContact O-N 3.49Å
291	D	74.9	Confident	73.4	Confident	107 Å²	107	78.7 Å²	78.7	57%	0.572	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-81.8	-0.3	-178.4	-63.7	-34	0	0	0	112.8	K119 L288 G289	K119-D291 PolarHBondContact NZ-O 3Å; L288-D291 PolarHBondContact O-N 3.18Å; G289-D291 PolarHBondContact O-N 3.46Å
292	Y	78.8	Confident	71.3	Confident	37 Å²	37	81.3 Å²	81.3	15%	0.145	44%	0.437	C	S	.	.			trans	-75.5	124.4	169.8	-178.3	-89.5	0	0	0	110	I123 A284 R285 L288 G289 P290 D294	I123-Y292 HydrophobicContact CG1-CD2 4.48Å; I123-Y292 HydrophobicContact CG1-CE2 4.19Å; A284-Y292 HydrophobicContact CB-CD2 4Å; A284-Y292 HydrophobicContact CB-CE2 3.89Å; R285-Y292 HydrophobicContact CB-CG 4.46Å; R285-Y292 HydrophobicContact CG-CD1 3.45Å; R285-Y292 VanDerWaalsContact CG-CD1 3.45Å; R285-Y292 HydrophobicContact CG-CD2 3.69Å; R285-Y292 HydrophobicContact CG-CE1 3.51Å; R285-Y292 HydrophobicContact CG-CE2 3.77Å; R285-Y292 HydrophobicContact CG-CG 3.53Å; L288-Y292 HydrophobicContact CD1-CD2 4.13Å; G289-Y292 WeakPolarHBondContact O-CB 3.47Å; G289-Y292 PolarHBondContact O-N 3.5Å; P290-Y292 PolarHBondContact O-N 3.49Å; Y292-D294 WeakPolarHBondContact CE1-OD1 3.26Å; Y292-D294 PolarHBondContact OH-OD1 3.4Å
293	S	69.7	Low	69.1	Low	59 Å²	59	80.3 Å²	80.3	41%	0.413	43%	0.429	S	S	.	.			trans	-123.2	126	175.4	60.4	0	0	0	0	109.7	E295	S293-E295 PolarHBondContact O-N 2.85Å; S293-E295 VanDerWaalsContact O-N 3.09Å
294	D	61.9	Low	66.8	Low	120 Å²	120	83 Å²	83	64%	0.642	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	1.1	176.9	-85.9	-36.1	0	0	0	114.1	Y292 N296	Y292-D294 WeakPolarHBondContact CE1-OD1 3.26Å; Y292-D294 PolarHBondContact OH-OD1 3.4Å; D294-N296 CarbonylContact O-C 3.53Å; D294-N296 PolarHBondContact O-N 3.48Å
295	E	55.8	Low	64.4	Low	176 Å²	176	85.2 Å²	85.2	82%	0.822	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-4	178.7	-69.5	-93.6	150.4	0	0	114.5	S293 D297	S293-E295 PolarHBondContact O-N 2.85Å; S293-E295 VanDerWaalsContact O-N 3.09Å; E295-D297 PolarHBondContact O-N 3.26Å
296	N	51.3	Low	62	Low	74 Å²	74	85.1 Å²	85.1	40%	0.396	47%	0.467	S	S	.	.			trans	-92	75.8	166.2	-94.3	-1.8	0	0	0	110.7	I123 D294 Y298	I123-N296 HydrophobicContact CG2-CB 4.19Å; D294-N296 CarbonylContact O-C 3.53Å; D294-N296 PolarHBondContact O-N 3.48Å; N296-Y298 VanDerWaalsContact C-N 3.27Å; N296-Y298 PolarHBondContact O-N 3.35Å
297	D	42.4	Very low	59.8	Low	152 Å²	152	84.4 Å²	84.4	81%	0.813	46%	0.457	S	S	*	.			trans	-66.2	69.2	178.4	-145.4	7.9	0	0	0	111.9	E295	E295-D297 PolarHBondContact O-N 3.26Å
298	Y	52.2	Low	57.4	Low	181 Å²	181	86.9 Å²	86.9	71%	0.71	47%	0.473	S	S	*	.			trans	-154.6	12.5	178.9	-106.1	-66.8	0	0	0	120.2	N296	N296-Y298 VanDerWaalsContact C-N 3.27Å; N296-Y298 PolarHBondContact O-N 3.35Å
299	T	47.1	Very low	54.9	Low	50 Å²	50	93.9 Å²	93.9	31%	0.307	50%	0.503	S	S	.	.	S	Bend	trans	-113.6	-4.4	-176.8	46.4	0	0	0	0	117.2
300	H	45.6	Very low	52.8	Low	137 Å²	137	98 Å²	98	63%	0.634	51%	0.512	S	S	*	.	S	Bend	trans	-87.3	-22.1	176.7	-100.7	-64.8	0	0	0	115.2
301	T	39.6	Very low	50.9	Low	101 Å²	101	95.8 Å²	95.8	62%	0.62	50%	0.497	S	S	*	.	S	Bend	trans	-99.1	-26.7	-168.6	-0.9	0	0	0	0	114.8	A305	T301-A305 WeakPolarHBondContact O-CB 2.93Å; T301-A305 PolarHBondContact O-N 3.18Å
302	S	47.7	Very low	49.2	Very low	55 Å²	55	93.4 Å²	93.4	39%	0.385	49%	0.488	S	S	.	.	H	α-helix	trans	-79.4	-44	-172.5	65.9	0	0	0	0	113.3	M306	S302-M306 WeakPolarHBondContact O-CE 3.42Å; S302-M306 WeakPolarHBondContact O-CG 3.22Å; S302-M306 PolarHBondContact O-N 3.12Å
303	Y	46.4	Very low	47.4	Very low	25 Å²	25	93.5 Å²	93.5	10%	0.098	49%	0.494	C	S	.	.	H	α-helix	trans	-72.7	-50.2	-179	-167	-90.7	0	0	0	111.8	F144 D185 E270 A305 M306 H307	F144-Y303 AromaticContact CD1-CE2 3.77Å; F144-Y303 HydrophobicContact CD1-CE2 3.77Å; F144-Y303 HydrophobicContact CE1-CE2 4.12Å; D185-Y303 PolarHBondContact OD2-OH 3.27Å; E270-Y303 HydrophobicContact CB-CE1 4.45Å; E270-Y303 WeakPolarHBondContact CB-OH 3.04Å; E270-Y303 HydrophobicContact CG-CD1 4.42Å; E270-Y303 HydrophobicContact CG-CE1 3.3Å; E270-Y303 WeakPolarHBondContact CG-OH 3.37Å; Y303-A305 PolarHBondContact O-N 2.95Å; Y303-M306 PolarHBondContact O-N 3.24Å; Y303-H307 AromaticContact CE1-CD2 3.56Å; Y303-H307 AromaticContact CE1-NE2 3.82Å; Y303-H307 AromaticContact CE2-NE2 3.9Å; Y303-H307 AromaticContact CZ-CD2 3.6Å; Y303-H307 AromaticContact CZ-NE2 3.39Å; Y303-H307 PolarHBondContact O-N 3.2Å; Y303-H307 PolarHBondContact OH-NE2 2.96Å
304	N	49.3	Very low	46	Very low	74 Å²	74	95.4 Å²	95.4	40%	0.396	50%	0.5	S	S	.	.	H	α-helix	trans	-64.8	-40.7	178.6	-78.8	-16.3	0	0	0	113	M306 H307 V308	N304-M306 VanDerWaalsContact C-N 3.31Å; N304-M306 PolarHBondContact O-N 3.1Å; N304-H307 PolarHBondContact O-N 3.39Å; N304-V308 VanDerWaalsContact O-CG2 3.28Å; N304-V308 WeakPolarHBondContact O-CG2 3.28Å; N304-V308 PolarHBondContact O-N 2.96Å; N304-V308 VanDerWaalsContact O-N 3.13Å
305	A	44.6	Very low	44.9	Very low	45 Å²	45	95.8 Å²	95.8	37%	0.372	50%	0.501	S	S	.	.	H	α-helix	trans	-70.7	-25.5	-178.9	0	0	0	0	0	113.5	T301 Y303 K309	T301-A305 WeakPolarHBondContact O-CB 2.93Å; T301-A305 PolarHBondContact O-N 3.18Å; Y303-A305 PolarHBondContact O-N 2.95Å; A305-K309 WeakPolarHBondContact O-CG 3.49Å
306	M	44.3	Very low	44	Very low	85 Å²	85	94.7 Å²	94.7	42%	0.419	50%	0.496	S	S	.	.	H	α-helix	trans	-80.4	-37.5	175.6	-74.1	-167.4	-78.3	0	0	112.4	S302 Y303 N304 H310	S302-M306 WeakPolarHBondContact O-CE 3.42Å; S302-M306 WeakPolarHBondContact O-CG 3.22Å; S302-M306 PolarHBondContact O-N 3.12Å; Y303-M306 PolarHBondContact O-N 3.24Å; N304-M306 VanDerWaalsContact C-N 3.31Å; N304-M306 PolarHBondContact O-N 3.1Å; M306-H310 PolarHBondContact O-N 3Å
307	H	49.7	Very low	43.3	Very low	76 Å²	76	100.8 Å²	100.8	35%	0.352	51%	0.514	S	S	.	.	H	α-helix	trans	-68.5	-37.9	176.3	-91.9	-89.4	0	0	0	113.1	Y303 N304 H310 T311	Y303-H307 AromaticContact CE1-CD2 3.56Å; Y303-H307 AromaticContact CE1-NE2 3.82Å; Y303-H307 AromaticContact CE2-NE2 3.9Å; Y303-H307 AromaticContact CZ-CD2 3.6Å; Y303-H307 AromaticContact CZ-NE2 3.39Å; Y303-H307 PolarHBondContact O-N 3.2Å; Y303-H307 PolarHBondContact OH-NE2 2.96Å; N304-H307 PolarHBondContact O-N 3.39Å; H307-H310 PolarHBondContact O-N 3.44Å; H307-T311 PolarHBondContact O-N 3.01Å; H307-T311 PolarHBondContact O-OG1 3.13Å; H307-T311 VanDerWaalsContact O-OG1 3.1Å
308	V	43.8	Very low	43	Very low	88 Å²	88	101.8 Å²	101.8	53%	0.533	51%	0.514	S	S	.	.	H	α-helix	trans	-65.6	-39.1	176.6	174.2	0	0	0	0	111.9	N304 H310 T311 S312	N304-V308 VanDerWaalsContact O-CG2 3.28Å; N304-V308 WeakPolarHBondContact O-CG2 3.28Å; N304-V308 PolarHBondContact O-N 2.96Å; N304-V308 VanDerWaalsContact O-N 3.13Å; V308-H310 VanDerWaalsContact C-N 3.31Å; V308-H310 PolarHBondContact O-N 3.1Å; V308-T311 PolarHBondContact O-N 3.08Å; V308-T311 PolarHBondContact O-OG1 3.39Å; V308-T311 VanDerWaalsContact O-OG1 3.1Å; V308-S312 PolarHBondContact O-N 3.46Å; V308-S312 VanDerWaalsContact O-N 3.08Å; V308-S312 PolarHBondContact O-OG 3.37Å
309	K	39.7	Very low	42.1	Very low	157 Å²	157	98.6 Å²	98.6	68%	0.683	52%	0.516	S	S	*	.	H	α-helix	trans	-63.3	-36	179.2	-79	179.8	180	179.8	0	112.9	A305 S313	A305-K309 WeakPolarHBondContact O-CG 3.49Å; K309-S313 WeakPolarHBondContact O-CB 3.34Å; K309-S313 PolarHBondContact O-N 3.36Å; K309-S313 VanDerWaalsContact O-N 3.1Å; K309-S313 PolarHBondContact O-OG 3.41Å
310	H	44.2	Very low	41.3	Very low	124 Å²	124	100.6 Å²	100.6	57%	0.574	53%	0.532	S	S	*	.	H	α-helix	trans	-73.4	-39.7	-179.5	-102.2	-72.6	0	0	0	112.9	M306 H307 V308 S313 N314	M306-H310 PolarHBondContact O-N 3Å; H307-H310 PolarHBondContact O-N 3.44Å; V308-H310 VanDerWaalsContact C-N 3.31Å; V308-H310 PolarHBondContact O-N 3.1Å; H310-S313 PolarHBondContact O-OG 3.22Å; H310-N314 PolarHBondContact O-N 3.29Å
311	T	41	Very low	40.5	Very low	89 Å²	89	100.5 Å²	100.5	55%	0.546	54%	0.544	S	S	.	.	H	α-helix	trans	-67.9	-40.8	175.5	37.3	0	0	0	0	112.2	H307 V308 N314 L315	H307-T311 PolarHBondContact O-N 3.01Å; H307-T311 PolarHBondContact O-OG1 3.13Å; H307-T311 VanDerWaalsContact O-OG1 3.1Å; V308-T311 PolarHBondContact O-N 3.08Å; V308-T311 PolarHBondContact O-OG1 3.39Å; V308-T311 VanDerWaalsContact O-OG1 3.1Å; T311-N314 PolarHBondContact O-N 3.31Å; T311-L315 PolarHBondContact O-N 3.47Å
312	S	38.6	Very low	40.2	Very low	56 Å²	56	105.1 Å²	105.1	39%	0.392	56%	0.555	S	S	.	*	H	α-helix	trans	-64.7	-39.5	175.2	-54.7	0	0	0	0	112.8	V308 N314 L315 E316	V308-S312 PolarHBondContact O-N 3.46Å; V308-S312 VanDerWaalsContact O-N 3.08Å; V308-S312 PolarHBondContact O-OG 3.37Å; S312-N314 VanDerWaalsContact C-N 3.28Å; S312-N314 PolarHBondContact O-N 3.1Å; S312-L315 PolarHBondContact O-N 3.1Å; S312-E316 PolarHBondContact O-N 3.45Å
313	S	41.1	Very low	39.4	Very low	40 Å²	40	110.4 Å²	110.4	28%	0.28	58%	0.578	S	S	.	*	H	α-helix	trans	-68.3	-23.1	-178.7	74.7	0	0	0	0	114.6	K309 H310	K309-S313 WeakPolarHBondContact O-CB 3.34Å; K309-S313 PolarHBondContact O-N 3.36Å; K309-S313 VanDerWaalsContact O-N 3.1Å; K309-S313 PolarHBondContact O-OG 3.41Å; H310-S313 PolarHBondContact O-OG 3.22Å
314	N	40.6	Very low	38.5	Very low	99 Å²	99	118.2 Å²	118.2	53%	0.529	62%	0.618	S	S	.	*	H	α-helix	trans	-82.9	-33.3	175.8	-82.2	-19.7	0	0	0	112.1	H310 T311 S312 R317	H310-N314 PolarHBondContact O-N 3.29Å; T311-N314 PolarHBondContact O-N 3.31Å; S312-N314 VanDerWaalsContact C-N 3.28Å; S312-N314 PolarHBondContact O-N 3.1Å; N314-R317 PolarHBondContact O-N 3.44Å
315	L	38.4	Very low	37.5	Very low	128 Å²	128	124 Å²	124	67%	0.67	64%	0.639	S	S	*	*	H	α-helix	trans	-69.5	-33.1	175.4	-81.1	152.5	0	0	0	112.6	T311 S312 R317	T311-L315 PolarHBondContact O-N 3.47Å; S312-L315 PolarHBondContact O-N 3.1Å; L315-R317 VanDerWaalsContact C-N 3.31Å; L315-R317 PolarHBondContact O-N 3.41Å
316	E	36.1	Very low	36.6	Very low	152 Å²	152	132.4 Å²	132.4	71%	0.71	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-17.9	178.6	-71.4	-176.6	169.3	0	0	113.8	S312	S312-E316 PolarHBondContact O-N 3.45Å
317	R	37.5	Very low	35.9	Very low	202 Å²	202	133.8 Å²	133.8	76%	0.762	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-15.3	178.7	-75.4	-177.8	-171.1	170.7	4.9	114.4	N314 L315	N314-R317 PolarHBondContact O-N 3.44Å; L315-R317 VanDerWaalsContact C-N 3.31Å; L315-R317 PolarHBondContact O-N 3.41Å
318	E	36.2	Very low	34.8	Very low	174 Å²	174	138.2 Å²	138.2	81%	0.813	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	-10.6	-179.1	-74.3	-170.7	155.7	0	0	114.3
319	C	33	Very low	34.2	Very low	113 Å²	113	139.6 Å²	139.6	76%	0.764	71%	0.714	S	S	*	*			trans	-111.7	75.1	177.5	-93.1	0	0	0	0	111.8
320	S	29.2	Very low	33.7	Very low	93 Å²	93	138.4 Å²	138.4	65%	0.65	72%	0.72	S	S	*	*			trans	-149.2	112.7	164	-79.1	0	0	0	0	110.4	K322	S320-K322 PolarHBondContact O-N 3.18Å
321	P	30.7	Very low	33	Very low	134 Å²	134	139.5 Å²	139.5	87%	0.87	74%	0.735	S	S	*	*			trans	-76	107.8	179.1	28.8	-29.6	0	0	0	109.6	L323	P321-L323 PolarHBondContact O-N 3.38Å
322	K	32.8	Very low	32.4	Very low	199 Å²	199	144 Å²	144	87%	0.865	75%	0.75	S	S	*	*			trans	-77.5	115.1	171.7	-76.7	-178.2	179.3	174.1	0	110	S320 M324	S320-K322 PolarHBondContact O-N 3.18Å; K322-M324 PolarHBondContact O-N 3.37Å
323	L	29.7	Very low	31.8	Very low	166 Å²	166	146.5 Å²	146.5	87%	0.869	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-60.4	119.8	171	-133	87.4	0	0	0	110.3	P321 K325	P321-L323 PolarHBondContact O-N 3.38Å; L323-K325 PolarHBondContact O-N 3.39Å
324	M	28.2	Very low	31.2	Very low	188 Å²	188	148 Å²	148	93%	0.926	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-68	120	173.2	-75.1	170.2	77.8	0	0	110.4	K322	K322-M324 PolarHBondContact O-N 3.37Å
325	K	29.2	Very low	30.7	Very low	195 Å²	195	149.7 Å²	149.7	85%	0.848	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-98.9	121.4	161.8	-80	-175	177.6	179.8	0	109.4	L323	L323-K325 PolarHBondContact O-N 3.39Å
326	R	25.4	Very low	30.2	Very low	223 Å²	223	151.6 Å²	151.6	84%	0.842	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-73.9	124.8	175.5	-171.7	-179.3	-172.3	-177.5	2.3	109.1
327	S	29.2	Very low	29.9	Very low	114 Å²	114	154 Å²	154	80%	0.797	83%	0.827	S	S	*	*			trans	-129.7	119.5	164.9	-66.9	0	0	0	0	108.9
328	Q	26.5	Very low	29.4	Very low	169 Å²	169	152.5 Å²	152.5	79%	0.79	83%	0.829	S	S	*	*			trans	-79.2	134.2	172.7	-71.2	171.7	-42	0	0	109
329	S	30.8	Very low	29	Very low	117 Å²	117	153.5 Å²	153.5	82%	0.818	83%	0.833	S	S	*	*			trans	-147	119.4	153.7	57.4	0	0	0	0	109.2
330	V	28.4	Very low	28.7	Very low	132 Å²	132	156 Å²	156	80%	0.8	83%	0.834	S	S	*	*			trans	-75.4	132	175.4	170.7	0	0	0	0	109.2
331	V	29.6	Very low	28.7	Very low	146 Å²	146	162 Å²	162	89%	0.885	85%	0.848	S	S	*	*			trans	-148.5	137.8	150	-167.4	0	0	0	0	109.4
332	E	29.1	Very low	28.6	Very low	184 Å²	184	159 Å²	159	86%	0.86	84%	0.841	S	S	*	*			trans	-71.8	169.9	-169.2	-72.2	172	137.3	0	0	116.8
333	A	27.1	Very low	28.4	Very low	108 Å²	108	158.1 Å²	158.1	89%	0.893	84%	0.84	S	S	*	*			trans	-70.6	140.9	-176.6	0	0	0	0	0	114.4
334	G	27.9	Very low	28.4	Very low	71 Å²	71	157.4 Å²	157.4	73%	0.732	84%	0.838	S	S	*	*			trans	-150	93.1	172.9	0	0	0	0	0	112.2
335	T	29.4	Very low	28.5	Very low	135 Å²	135	157.8 Å²	157.8	83%	0.828	84%	0.837	S	S	*	*			trans	29.9	115.8	145.8	-40.4	0	0	0	0	120.7
336	L	28.6	Very low	28.6	Very low	169 Å²	169	155.2 Å²	155.2	89%	0.885	83%	0.832	S	S	*	*			trans	-56.5	130.9	160	-75.1	148.5	0	0	0	112.5
337	K	29.8	Very low	28.7	Very low	202 Å²	202	151.1 Å²	151.1	88%	0.878	83%	0.833	S	S	*	*			trans	-135.9	124.4	149	-84.9	-169.1	176.2	-178.1	0	110.6
338	H	27.5	Very low	28.9	Very low	170 Å²	170	153.7 Å²	153.7	79%	0.787	83%	0.832	S	S	*	*			trans	-81.2	130.1	171.4	-138.3	-77.1	0	0	0	107.8
339	E	26.4	Very low	29.2	Very low	195 Å²	195	151.7 Å²	151.7	91%	0.911	83%	0.833	S	S	*	*			trans	-135.4	120.6	157.6	-84.9	-171.8	160.1	0	0	109.1
340	E	27.6	Very low	29.2	Very low	167 Å²	167	154.1 Å²	154.1	78%	0.78	84%	0.836	S	S	*	*			trans	-88.6	156	167	-75.4	-176.8	143.5	0	0	110.7
341	K	29.8	Very low	29.4	Very low	218 Å²	218	156 Å²	156	95%	0.948	84%	0.841	S	S	*	*			trans	118.7	129.4	162.7	-72.2	176.7	175.3	-178.1	0	111.8
342	G	27.3	Very low	29.4	Very low	70 Å²	70	153.8 Å²	153.8	72%	0.722	84%	0.838	S	S	*	*			cis	177.6	-178.8	2.4	0	0	0	0	0	109.8
343	E	29.7	Very low	29.5	Very low	181 Å²	181	152.8 Å²	152.8	85%	0.846	84%	0.838	S	S	*	*			trans	72.2	103	163.6	-60.7	-173.5	162.9	0	0	117.7
344	N	28.6	Very low	30.2	Very low	152 Å²	152	159 Å²	159	81%	0.813	86%	0.856	S	S	*	*				72.3	108.1	102	-82	-14.2	0	0	0	114.6
345	E	30.6	Very low	30.3	Very low	196 Å²	196	163.4 Å²	163.4	92%	0.916	86%	0.862	S	S	*	*				-165.8	134.4	106.1	-104.8	177.1	-179.3	0	0	111.5
346	N	30.6	Very low	30.4	Very low	140 Å²	140	164.8 Å²	164.8	75%	0.749	86%	0.864	S	S	*	*			trans	-98.4	119.4	-176	174.3	30.6	0	0	0	108
347	T	29.3	Very low	30.5	Very low	138 Å²	138	164.6 Å²	164.6	85%	0.847	86%	0.862	S	S	*	*			trans	-151.8	102.4	156.4	35.5	0	0	0	0	111
348	Q	32.9	Very low	30.5	Very low	168 Å²	168	162.4 Å²	162.4	79%	0.785	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-60.5	145.5	155.8	-68.9	177.9	-30.9	0	0	110.3
349	P	33.1	Very low	30.7	Very low	126 Å²	126	161.9 Å²	161.9	82%	0.818	87%	0.866	S	S	*	*	P	Polyproline II helix	trans	-83.1	124.3	162	15	-2.3	0	0	0	110.8
350	L	30.7	Very low	31	Very low	168 Å²	168	159.7 Å²	159.7	88%	0.88	86%	0.863	S	S	*	*	P	Polyproline II helix	trans	-55.4	128.8	174	-86.1	118.8	0	0	0	112.7
351	L	32.6	Very low	31.2	Very low	172 Å²	172	159.2 Å²	159.2	90%	0.901	87%	0.869	S	S	*	*	P	Polyproline II helix	trans	-71.3	130.8	152.7	-76	155.7	0	0	0	108.6
352	A	29.1	Very low	31.3	Very low	99 Å²	99	154.7 Å²	154.7	82%	0.818	86%	0.863	S	S	*	*			trans	-131.5	112.1	161.6	0	0	0	0	0	108.8
353	L	32	Very low	31.7	Very low	163 Å²	163	161.8 Å²	161.8	85%	0.853	88%	0.875	S	S	*	*			trans	-83.6	131.1	153	-76.5	158.8	0	0	0	106.9
354	D	40.9	Very low	31.9	Very low	238 Å²	238	160 Å²	160	100%	1.273	88%	0.877	S	S	*	*				-174.2	0	118.3	-86.8	-16.7	0	0	0	110.1

Retrieved 354 of 354 residues in 754.5 ms (Link to these results)

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