A0A087XQG5_POEFO Loading...

Ankyrin repeat domain 33

AlphaFold DB , UniProt , Accession A0A087XQG5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 450 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.7	Very low	49.3	Very low	250 Å²	250	129.6 Å²	129.6	100%	1.232	82%	0.819	S	S	*	*				0	103	0	-73.3	-175.6	179.7	0	0	106.8
2	A	37.3	Very low	49.3	Very low	105 Å²	105	130.1 Å²	130.1	87%	0.868	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-92.3	128.1	179.6	0	0	0	0	0	108.2
3	A	38.8	Very low	49.5	Very low	102 Å²	102	125 Å²	125	84%	0.843	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-72.5	127.9	176	0	0	0	0	0	109.6
4	A	44.8	Very low	49.7	Very low	92 Å²	92	126.1 Å²	126.1	76%	0.76	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-77.3	136.7	167.6	0	0	0	0	0	108.7
5	A	44.5	Very low	49.3	Very low	103 Å²	103	124.9 Å²	124.9	85%	0.851	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-83.8	126	172.8	0	0	0	0	0	108.9
6	D	50.4	Low	48.8	Very low	161 Å²	161	123.8 Å²	123.8	86%	0.861	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-74	131.3	174.4	-72.7	-41.8	0	0	0	110.7
7	D	61.5	Low	48.4	Very low	109 Å²	109	125.9 Å²	125.9	58%	0.583	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-85.6	125	179.1	-171.3	-16.1	0	0	0	110.1	H9	D7-H9 PolarHBondContact O-N 3.5Å; D7-H9 IonicContact OD1-CD2 3.91Å
8	P	57.4	Low	48	Very low	116 Å²	116	129 Å²	129	75%	0.753	82%	0.815	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	13	-169.7	30.6	-36.9	0	0	0	116
9	H	53.2	Low	47.9	Very low	167 Å²	167	132.2 Å²	132.2	77%	0.773	82%	0.819	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	9.5	-177.1	-71.6	-56.3	0	0	0	115.8	D7	D7-H9 PolarHBondContact O-N 3.5Å; D7-H9 IonicContact OD1-CD2 3.91Å
10	L	55.1	Low	47.6	Very low	156 Å²	156	132.9 Å²	132.9	82%	0.817	82%	0.815	S	S	*	*			trans	-90.2	111.1	174	-68.4	169.6	0	0	0	110.5
11	G	59.3	Low	47.1	Very low	65 Å²	65	134.4 Å²	134.4	67%	0.67	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-71.7	155.2	169.9	0	0	0	0	0	112	G13	G11-G13 PolarHBondContact O-N 2.95Å
12	P	50	Low	47.2	Very low	135 Å²	135	130.4 Å²	130.4	88%	0.877	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-69	128	-176.6	28.1	-32.5	0	0	0	110.9
13	G	51.7	Low	47.4	Very low	64 Å²	64	132.8 Å²	132.8	66%	0.66	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-69.8	148.5	170.4	0	0	0	0	0	111.2	G11 S15	G11-G13 PolarHBondContact O-N 2.95Å; G13-S15 PolarHBondContact O-N 3Å
14	P	52.4	Low	47.7	Very low	140 Å²	140	135.5 Å²	135.5	91%	0.909	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-73.8	123.6	-178.4	28.8	-32.3	0	0	0	111.2
15	S	43.3	Very low	47.8	Very low	108 Å²	108	136 Å²	136	76%	0.755	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-99.2	126	162.4	58.8	0	0	0	0	108.9	G13	G13-S15 PolarHBondContact O-N 3Å
16	S	42	Very low	48.1	Very low	108 Å²	108	139 Å²	139	76%	0.755	80%	0.798	S	S	*	*			trans	166.5	113.2	136.8	52.6	0	0	0	0	110.8
17	D	41.7	Very low	48	Very low	159 Å²	159	136.3 Å²	136.3	85%	0.85	79%	0.792	S	S	*	*			trans	-15.4	126.7	144.3	-50.6	-49.2	0	0	0	116
18	E	41	Very low	47.6	Very low	182 Å²	182	135 Å²	135	85%	0.85	80%	0.804	S	S	*	*			trans	-130.3	109.6	148.8	-78.4	-162.5	167	0	0	108.7	I20	E18-I20 PolarHBondContact O-N 2.73Å
19	E	45.3	Very low	47.3	Very low	190 Å²	190	134.5 Å²	134.5	89%	0.888	80%	0.804	S	S	*	*			trans	-69.1	114.7	167.8	-70.7	178.6	148.3	0	0	109.1
20	I	41.9	Very low	47	Very low	146 Å²	146	134.6 Å²	134.6	75%	0.749	81%	0.808	S	S	*	*			trans	-101.4	109.5	166.1	-59.3	177.1	0	0	0	107.3	E18 L22	E18-I20 PolarHBondContact O-N 2.73Å; I20-L22 PolarHBondContact O-N 3.24Å
21	L	38.9	Very low	46.2	Very low	164 Å²	164	135.2 Å²	135.2	86%	0.859	81%	0.811	S	S	*	*			trans	-59.2	117	173.4	-68	164	0	0	0	109.8
22	L	41.4	Very low	45.6	Very low	167 Å²	167	136.8 Å²	136.8	87%	0.874	81%	0.812	S	S	*	*			trans	-86.8	113.3	167.9	-75	165	0	0	0	108.2	I20	I20-L22 PolarHBondContact O-N 3.24Å
23	D	41.1	Very low	45.7	Very low	154 Å²	154	138.3 Å²	138.3	82%	0.824	81%	0.813	S	S	*	*			trans	-82.8	119.2	174.3	-164.7	20.3	0	0	0	108.8	S25	D23-S25 PolarHBondContact O-N 2.73Å
24	D	45.3	Very low	45.7	Very low	160 Å²	160	142 Å²	142	86%	0.856	82%	0.817	S	S	*	*			trans	-73.8	109	174.5	-81.9	-41.7	0	0	0	109.1
25	S	47.1	Very low	45.6	Very low	103 Å²	103	139.8 Å²	139.8	72%	0.72	81%	0.805	S	S	*	*			trans	-127.5	106.5	168.8	-159.7	0	0	0	0	111.1	D23 S27	D23-S25 PolarHBondContact O-N 2.73Å; S25-S27 PolarHBondContact O-N 3.35Å
26	D	50.1	Low	46.2	Very low	165 Å²	165	140.8 Å²	140.8	88%	0.882	81%	0.807	S	S	*	*			trans	-49.3	120.8	167.4	-85.7	-41.2	0	0	0	111.6
27	S	49.3	Very low	46.4	Very low	105 Å²	105	142.2 Å²	142.2	73%	0.734	81%	0.805	S	S	*	*			trans	-137.2	85.2	158.4	-73	0	0	0	0	108.1	S25 S29	S25-S27 PolarHBondContact O-N 3.35Å; S27-S29 PolarHBondContact O-N 2.73Å; S27-S29 VanDerWaalsContact O-N 3.11Å
28	G	51.7	Low	46.9	Very low	80 Å²	80	138.4 Å²	138.4	83%	0.825	79%	0.789	S	S	*	*			trans	-58.2	111.7	167.3	0	0	0	0	0	109.8
29	S	51.6	Low	47.2	Very low	107 Å²	107	136.3 Å²	136.3	75%	0.748	78%	0.784	S	S	*	*			trans	-117.1	120.6	166.6	-71.7	0	0	0	0	108.8	S27 L31	S27-S29 PolarHBondContact O-N 2.73Å; S27-S29 VanDerWaalsContact O-N 3.11Å; S29-L31 PolarHBondContact O-N 2.99Å
30	I	46.4	Very low	47.4	Very low	168 Å²	168	136.6 Å²	136.6	86%	0.862	78%	0.778	S	S	*	*			trans	-61.9	123.8	-176.5	-67.4	145.9	0	0	0	109.2	S32	I30-S32 PolarHBondContact O-N 3.2Å; I30-S32 VanDerWaalsContact O-N 3.14Å
31	L	39.1	Very low	47.6	Very low	169 Å²	169	135.4 Å²	135.4	89%	0.885	77%	0.773	S	S	*	*			trans	-64.8	107.6	173.4	-67.9	168	0	0	0	109.3	S29 D33	S29-L31 PolarHBondContact O-N 2.99Å; L31-D33 PolarHBondContact O-N 3.08Å
32	S	46.9	Very low	48.3	Very low	99 Å²	99	138.2 Å²	138.2	69%	0.692	77%	0.772	S	S	*	*			trans	-78.9	110	161.3	55.6	0	0	0	0	108.7	I30 D34	I30-S32 PolarHBondContact O-N 3.2Å; I30-S32 VanDerWaalsContact O-N 3.14Å; S32-D34 PolarHBondContact O-N 3.36Å
33	D	51.7	Low	48.5	Very low	167 Å²	167	137 Å²	137	89%	0.893	77%	0.766	S	S	*	*	S	Bend	trans	-75.6	55.9	177.9	-166.5	27.5	0	0	0	111.7	L31	L31-D33 PolarHBondContact O-N 3.08Å
34	D	51.4	Low	49	Very low	141 Å²	141	132.5 Å²	132.5	75%	0.754	75%	0.745	S	S	*	*			trans	-147.8	71.7	173.9	-137.4	-3.2	0	0	0	109.6	S32	S32-D34 PolarHBondContact O-N 3.36Å
35	S	49.5	Very low	49.5	Very low	93 Å²	93	130.4 Å²	130.4	65%	0.65	74%	0.737	S	S	*	*			trans	-133.2	73.7	168.7	-67.5	0	0	0	0	107.7	L37	S35-L37 PolarHBondContact O-N 3.48Å
36	V	56.1	Low	50	Low	130 Å²	130	131.8 Å²	131.8	79%	0.788	73%	0.728	S	S	*	*			trans	-62.1	86.3	150.3	-178.7	0	0	0	0	105.5	P38	V36-P38 WeakPolarHBondContact O-CD 3.29Å
37	L	46.9	Very low	50.7	Low	138 Å²	138	135.1 Å²	135.1	72%	0.723	73%	0.728	S	S	*	*			trans	-56.2	123.2	164.5	-105.9	85.6	0	0	0	105.9	S35 D39	S35-L37 PolarHBondContact O-N 3.48Å; L37-D39 PolarHBondContact O-N 2.92Å; L37-D39 VanDerWaalsContact O-N 3.14Å
38	P	51.9	Low	52	Low	78 Å²	78	135.6 Å²	135.6	51%	0.506	72%	0.719	S	S	.	*			trans	-58.2	123.1	162.2	-13.3	27.4	0	0	0	106	V36 Y40	V36-P38 WeakPolarHBondContact O-CD 3.29Å; P38-Y40 HydrophobicContact CB-CD2 4.5Å; P38-Y40 HydrophobicContact CB-CE2 4.17Å; P38-Y40 HydrophobicContact CG-CE2 4.17Å; P38-Y40 WeakPolarHBondContact O-CD2 3.45Å; P38-Y40 PolarHBondContact O-N 3.47Å
39	D	47.1	Very low	53.3	Low	139 Å²	139	136.2 Å²	136.2	74%	0.743	71%	0.708	S	S	*	*			trans	-57.9	104.7	169.7	-134.8	-15.5	0	0	0	106.7	L37 D41	L37-D39 PolarHBondContact O-N 2.92Å; L37-D39 VanDerWaalsContact O-N 3.14Å; D39-D41 PolarHBondContact O-N 2.86Å
40	Y	49.5	Very low	54.7	Low	195 Å²	195	131.6 Å²	131.6	77%	0.765	68%	0.676	S	S	*	*			trans	-82	10.1	177.9	-79	-81	0	0	0	111.8	P38 R42	P38-Y40 HydrophobicContact CB-CD2 4.5Å; P38-Y40 HydrophobicContact CB-CE2 4.17Å; P38-Y40 HydrophobicContact CG-CE2 4.17Å; P38-Y40 WeakPolarHBondContact O-CD2 3.45Å; P38-Y40 PolarHBondContact O-N 3.47Å; Y40-R42 PolarHBondContact O-N 3.39Å
41	D	45.8	Very low	56.5	Low	122 Å²	122	129.9 Å²	129.9	65%	0.652	66%	0.662	S	S	*	*			trans	-65.8	91.8	158.2	-77.3	-20	0	0	0	107.3	D39 D43	D39-D41 PolarHBondContact O-N 2.86Å; D41-D43 PolarHBondContact O-N 3.32Å
42	R	53.4	Low	58.9	Low	223 Å²	223	123.8 Å²	123.8	84%	0.842	63%	0.632	S	S	*	*			trans	-62.9	72	159.1	-96.5	-162.5	177.5	-154	3.4	107.9	Y40 T44	Y40-R42 PolarHBondContact O-N 3.39Å; R42-T44 HydrophobicContact CB-CG2 4.41Å; R42-T44 PolarHBondContact O-N 3.17Å
43	D	47.2	Very low	61	Low	140 Å²	140	119.2 Å²	119.2	75%	0.749	60%	0.599	S	S	*	*			trans	-65.4	78.4	147.7	-82.8	-18.8	0	0	0	105.8	D41 V45	D41-D43 PolarHBondContact O-N 3.32Å; D43-V45 PolarHBondContact O-N 2.86Å
44	T	51.9	Low	62.9	Low	61 Å²	61	113.2 Å²	113.2	37%	0.374	57%	0.565	S	S	.	*			trans	-62	92.1	163	48.2	0	0	0	0	105.6	R42 Y46	R42-T44 HydrophobicContact CB-CG2 4.41Å; R42-T44 PolarHBondContact O-N 3.17Å; T44-Y46 WeakPolarHBondContact O-CD2 3.38Å; T44-Y46 PolarHBondContact O-N 3.03Å; T44-Y46 PolarHBondContact OG1-OH 2.73Å
45	V	55.7	Low	64.7	Low	115 Å²	115	109.1 Å²	109.1	70%	0.697	54%	0.541	S	S	*	.			trans	-61.4	93.8	172.3	-179.6	0	0	0	0	106.2	D43 R47	D43-V45 PolarHBondContact O-N 2.86Å; V45-R47 HydrophobicContact CG1-CG 4.24Å; V45-R47 PolarHBondContact O-N 3.46Å
46	Y	57.2	Low	66.8	Low	133 Å²	133	104.7 Å²	104.7	52%	0.522	51%	0.51	S	S	.	.			trans	-65.3	96.4	177.7	-65.4	-72.9	0	0	0	108.4	T44 E48 R59	T44-Y46 WeakPolarHBondContact O-CD2 3.38Å; T44-Y46 PolarHBondContact O-N 3.03Å; T44-Y46 PolarHBondContact OG1-OH 2.73Å; Y46-E48 VanDerWaalsContact C-N 3.35Å; Y46-R59 HydrophobicContact CD1-CG 4.49Å; Y46-R59 HydrophobicContact CD2-CG 4.08Å; Y46-R59 HydrophobicContact CE1-CG 4.26Å; Y46-R59 HydrophobicContact CE2-CG 3.88Å; Y46-R59 HydrophobicContact CG-CG 4.38Å; Y46-R59 VanDerWaalsContact CG-CZ 3.46Å
47	R	64.3	Low	68.5	Low	234 Å²	234	98.5 Å²	98.5	88%	0.883	47%	0.473	S	S	*	.			trans	-78	-17.4	-177.6	-75	-164.9	177	-170.6	0.7	114	V45	V45-R47 HydrophobicContact CG1-CG 4.24Å; V45-R47 PolarHBondContact O-N 3.46Å
48	E	75.7	Confident	70.7	Confident	115 Å²	115	93 Å²	93	54%	0.537	45%	0.446	S	S	.	.	S	Bend	trans	-116.4	145.3	-179.6	-64.3	-175	-176.3	0	0	110.7	Y46 K51 R59	Y46-E48 VanDerWaalsContact C-N 3.35Å; E48-K51 WeakPolarHBondContact OE2-CE 3.45Å; E48-K51 IonicContact OE2-NZ 3.38Å; E48-K51 PolarHBondContact OE2-NZ 2.93Å; E48-R59 PolarHBondContact O-NH1 2.86Å; E48-R59 PolarHBondContact O-NH2 3.23Å
49	P	79.3	Confident	72.6	Confident	93 Å²	93	92 Å²	92	60%	0.604	43%	0.432	S	S	*	.			trans	-61.2	149.2	175.3	27.4	-34.7	0	0	0	111	K51	P49-K51 PolarHBondContact O-N 2.87Å
50	P	82.2	Confident	74.8	Confident	10 Å²	10	88.4 Å²	88.4	7%	0.065	41%	0.413	C	S	.	.			trans	-62.8	133.5	-178.2	27.3	-33.6	0	0	0	110.4	E55 A56 D61 S64	P50-E55 VanDerWaalsContact CA-OE2 3.3Å; P50-E55 WeakPolarHBondContact CA-OE2 3.27Å; P50-E55 HydrophobicContact CB-CB 3.97Å; P50-E55 HydrophobicContact CB-CG 3.77Å; P50-A56 HydrophobicContact CB-CB 3.99Å; P50-A56 HydrophobicContact CG-CB 3.83Å; P50-D61 HydrophobicContact CG-CB 4.46Å; P50-S64 VanDerWaalsContact CG-CB 3.44Å
51	K	83.8	Confident	76.9	Confident	133 Å²	133	81.1 Å²	81.1	58%	0.578	39%	0.388	S	S	*	.			trans	-94.7	-32.8	-175.7	-66.7	175.2	-171.8	162.4	0	112.1	E48 P49 E55	E48-K51 WeakPolarHBondContact OE2-CE 3.45Å; E48-K51 IonicContact OE2-NZ 3.38Å; E48-K51 PolarHBondContact OE2-NZ 2.93Å; P49-K51 PolarHBondContact O-N 2.87Å; K51-E55 PolarHBondContact N-OE2 3.26Å
52	T	89.4	Confident	79.1	Confident	40 Å²	40	77.2 Å²	77.2	25%	0.245	37%	0.369	C	S	.	.	S	Bend	trans	-102.5	156.9	178.9	76.2	0	0	0	0	111.6	Y54 E55 A56 E80	T52-Y54 VanDerWaalsContact C-N 3.29Å; T52-Y54 PolarHBondContact O-N 2.84Å; T52-E55 PolarHBondContact O-N 3.27Å; T52-E55 WeakPolarHBondContact OG1-CB 3.24Å; T52-E55 PolarHBondContact OG1-N 2.94Å; T52-E55 VanDerWaalsContact OG1-N 3.15Å; T52-A56 PolarHBondContact O-N 2.93Å; T52-A56 VanDerWaalsContact O-N 3.13Å; T52-E80 WeakPolarHBondContact CB-OE2 3.36Å; T52-E80 PolarHBondContact OG1-OE2 3.47Å; T52-E80 VanDerWaalsContact OG1-OE2 3.11Å
53	L	90.6	Very high	81	Confident	3 Å²	3	72.4 Å²	72.4	2%	0.016	36%	0.359	C	S	.	.	H	α-helix	trans	-58.9	-44	174.9	-179.6	151.7	0	0	0	110.9	E55 A56 C57 L65 I68 L69 V73 L104	L53-E55 VanDerWaalsContact C-N 3.35Å; L53-E55 PolarHBondContact O-N 3.06Å; L53-A56 PolarHBondContact O-N 2.84Å; L53-C57 PolarHBondContact O-N 2.87Å; L53-C57 VanDerWaalsContact O-N 3.09Å; L53-C57 PolarHBondContact O-SG 3.31Å; L53-L65 HydrophobicContact CD1-CD1 4.39Å; L53-L65 HydrophobicContact CG-CD1 3.95Å; L53-I68 HydrophobicContact CB-CG2 4.39Å; L53-L69 HydrophobicContact CD1-CD2 4.44Å; L53-V73 HydrophobicContact CD1-CG1 3.8Å; L53-V73 HydrophobicContact CD1-CG2 4.02Å; L53-L104 HydrophobicContact CD1-CD2 4.23Å; L53-L104 HydrophobicContact CD2-CD2 3.9Å; L53-L104 HydrophobicContact CG-CD2 4.24Å
54	Y	91.4	Very high	83.2	Confident	42 Å²	42	66.9 Å²	66.9	17%	0.165	33%	0.332	C	S	.	.	H	α-helix	trans	-61.1	-43.7	179.3	-179.1	-90.8	0	0	0	111.7	T52 A56 C57 A58 E80 D82 L91	T52-Y54 VanDerWaalsContact C-N 3.29Å; T52-Y54 PolarHBondContact O-N 2.84Å; Y54-A56 PolarHBondContact O-N 2.75Å; Y54-C57 WeakPolarHBondContact O-CB 3.28Å; Y54-C57 PolarHBondContact O-N 3.06Å; Y54-A58 HydrophobicContact CE1-CB 4.42Å; Y54-A58 WeakPolarHBondContact O-CB 3.36Å; Y54-A58 PolarHBondContact O-N 2.88Å; Y54-E80 VanDerWaalsContact CB-OE2 3.32Å; Y54-E80 WeakPolarHBondContact CB-OE2 3.45Å; Y54-E80 HydrophobicContact CG-CG 4.4Å; Y54-D82 HydrophobicContact CE2-CB 3.89Å; Y54-D82 WeakPolarHBondContact OH-CB 3.29Å; Y54-L91 HydrophobicContact CE1-CD2 4.3Å; Y54-L91 HydrophobicContact CE2-CB 4.46Å; Y54-L91 HydrophobicContact CE2-CD2 3.9Å; Y54-L91 WeakPolarHBondContact OH-CD2 3.27Å
55	E	90.8	Very high	85.1	Confident	55 Å²	55	64 Å²	64	26%	0.257	31%	0.314	S	S	.	.	H	α-helix	trans	-63.5	-40.7	178.8	-169.8	178.8	-156.3	0	0	112.3	P50 K51 T52 L53 C57 A58 R59	P50-E55 VanDerWaalsContact CA-OE2 3.3Å; P50-E55 WeakPolarHBondContact CA-OE2 3.27Å; P50-E55 HydrophobicContact CB-CB 3.97Å; P50-E55 HydrophobicContact CB-CG 3.77Å; K51-E55 PolarHBondContact N-OE2 3.26Å; T52-E55 PolarHBondContact O-N 3.27Å; T52-E55 WeakPolarHBondContact OG1-CB 3.24Å; T52-E55 PolarHBondContact OG1-N 2.94Å; T52-E55 VanDerWaalsContact OG1-N 3.15Å; L53-E55 VanDerWaalsContact C-N 3.35Å; L53-E55 PolarHBondContact O-N 3.06Å; E55-C57 VanDerWaalsContact C-N 3.31Å; E55-C57 PolarHBondContact O-N 3.26Å; E55-A58 PolarHBondContact O-N 2.84Å; E55-R59 WeakPolarHBondContact O-CG 3.29Å; E55-R59 PolarHBondContact O-N 2.79Å; E55-R59 IonicContact OE1-CZ 3.02Å; E55-R59 VanDerWaalsContact OE1-CZ 3.24Å; E55-R59 IonicContact OE1-NE 3.94Å; E55-R59 PolarHBondContact OE1-NE 2.88Å; E55-R59 IonicContact OE1-NH2 2.7Å; E55-R59 PolarHBondContact OE1-NH2 3.41Å
56	A	92.1	Very high	86.9	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-62	-39.6	174.7	0	0	0	0	0	111.8	P50 T52 L53 Y54 N60 D61 L65 I68	P50-A56 HydrophobicContact CB-CB 3.99Å; P50-A56 HydrophobicContact CG-CB 3.83Å; T52-A56 PolarHBondContact O-N 2.93Å; T52-A56 VanDerWaalsContact O-N 3.13Å; L53-A56 PolarHBondContact O-N 2.84Å; Y54-A56 PolarHBondContact O-N 2.75Å; A56-N60 PolarHBondContact O-N 3.37Å; A56-D61 PolarHBondContact O-N 3.05Å; A56-D61 VanDerWaalsContact O-N 3.12Å; A56-L65 HydrophobicContact CB-CB 4.12Å; A56-L65 HydrophobicContact CB-CD1 4.41Å; A56-I68 HydrophobicContact CB-CD1 4Å
57	C	93	Very high	88.5	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-65.4	-40.4	173.4	-61.4	0	0	0	0	111.9	L53 Y54 E55 R59 N60 F97 I100	L53-C57 PolarHBondContact O-N 2.87Å; L53-C57 VanDerWaalsContact O-N 3.09Å; L53-C57 PolarHBondContact O-SG 3.31Å; Y54-C57 WeakPolarHBondContact O-CB 3.28Å; Y54-C57 PolarHBondContact O-N 3.06Å; E55-C57 VanDerWaalsContact C-N 3.31Å; E55-C57 PolarHBondContact O-N 3.26Å; C57-R59 VanDerWaalsContact C-N 3.33Å; C57-R59 PolarHBondContact O-N 3.42Å; C57-N60 PolarHBondContact O-N 3.17Å; C57-F97 WeakPolarHBondContact O-CD2 3.33Å; C57-F97 WeakPolarHBondContact O-CE2 3.44Å; C57-I100 HydrophobicContact CB-CG2 4.06Å
58	A	91.8	Very high	89.8	Confident	21 Å²	21	46.7 Å²	46.7	17%	0.174	25%	0.253	C	S	.	.	H	α-helix	trans	-65.6	-36.1	-178.2	0	0	0	0	0	113.1	Y54 E55 L91 K95	Y54-A58 HydrophobicContact CE1-CB 4.42Å; Y54-A58 WeakPolarHBondContact O-CB 3.36Å; Y54-A58 PolarHBondContact O-N 2.88Å; E55-A58 PolarHBondContact O-N 2.84Å; A58-L91 VanDerWaalsContact CA-CD2 3.43Å; A58-L91 HydrophobicContact CB-CD2 3.57Å; A58-K95 PolarHBondContact O-NZ 3.39Å
59	R	91.7	Very high	90.5	Very high	57 Å²	57	42.7 Å²	42.7	22%	0.215	24%	0.235	C	C	.	.	H	α-helix	trans	-88	-5.6	-179.1	-63.7	-179.9	-174	-171.5	-0.1	114.6	Y46 E48 E55 C57	Y46-R59 HydrophobicContact CD1-CG 4.49Å; Y46-R59 HydrophobicContact CD2-CG 4.08Å; Y46-R59 HydrophobicContact CE1-CG 4.26Å; Y46-R59 HydrophobicContact CE2-CG 3.88Å; Y46-R59 HydrophobicContact CG-CG 4.38Å; Y46-R59 VanDerWaalsContact CG-CZ 3.46Å; E48-R59 PolarHBondContact O-NH1 2.86Å; E48-R59 PolarHBondContact O-NH2 3.23Å; E55-R59 WeakPolarHBondContact O-CG 3.29Å; E55-R59 PolarHBondContact O-N 2.79Å; E55-R59 IonicContact OE1-CZ 3.02Å; E55-R59 VanDerWaalsContact OE1-CZ 3.24Å; E55-R59 IonicContact OE1-NE 3.94Å; E55-R59 PolarHBondContact OE1-NE 2.88Å; E55-R59 IonicContact OE1-NH2 2.7Å; E55-R59 PolarHBondContact OE1-NH2 3.41Å; C57-R59 VanDerWaalsContact C-N 3.33Å; C57-R59 PolarHBondContact O-N 3.42Å
60	N	93.9	Very high	91	Very high	64 Å²	64	46 Å²	46	34%	0.342	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	43.5	-172.9	-163.3	31.9	0	0	0	113.4	A56 C57 P62 F97 I100	A56-N60 PolarHBondContact O-N 3.37Å; C57-N60 PolarHBondContact O-N 3.17Å; N60-P62 WeakPolarHBondContact O-CD 3.46Å; N60-F97 HydrophobicContact CB-CD1 4.05Å; N60-F97 HydrophobicContact CB-CD2 3.73Å; N60-F97 HydrophobicContact CB-CE1 3.85Å; N60-F97 HydrophobicContact CB-CE2 3.5Å; N60-F97 HydrophobicContact CB-CG 4Å; N60-F97 HydrophobicContact CB-CZ 3.57Å; N60-F97 WeakPolarHBondContact OD1-CB 3.43Å; N60-F97 VanDerWaalsContact OD1-CG 3.23Å; N60-F97 WeakPolarHBondContact OD1-CG 3.5Å; N60-I100 WeakPolarHBondContact OD1-CG1 3.34Å
61	D	93.8	Very high	91.3	Very high	43 Å²	43	53.4 Å²	53.4	23%	0.23	27%	0.269	C	S	.	.			trans	-103	94.2	178.5	-173.6	-5.8	0	0	0	111.3	P50 A56 L63 S64 L65	P50-D61 HydrophobicContact CG-CB 4.46Å; A56-D61 PolarHBondContact O-N 3.05Å; A56-D61 VanDerWaalsContact O-N 3.12Å; D61-L63 VanDerWaalsContact C-N 3.31Å; D61-L63 PolarHBondContact O-N 3.01Å; D61-L63 PolarHBondContact OD1-N 3.06Å; D61-L63 VanDerWaalsContact OD1-N 3.12Å; D61-S64 PolarHBondContact OD1-N 3.26Å; D61-S64 VanDerWaalsContact OD1-N 3.12Å; D61-S64 WeakPolarHBondContact OD2-CB 3.26Å; D61-S64 PolarHBondContact OD2-OG 3.08Å; D61-L65 WeakPolarHBondContact O-CB 3.14Å; D61-L65 PolarHBondContact O-N 3.3Å; D61-L65 VanDerWaalsContact O-N 3.09Å
62	P	93	Very high	91.3	Very high	40 Å²	40	49 Å²	49	26%	0.26	26%	0.262	S	S	.	.	H	α-helix	trans	-69	-27.7	-179.1	27.9	-35.1	0	0	0	113.1	N60 S66 D99 I100 L103	N60-P62 WeakPolarHBondContact O-CD 3.46Å; P62-S66 PolarHBondContact O-N 3.4Å; P62-D99 HydrophobicContact CB-CB 4.3Å; P62-I100 HydrophobicContact CB-CD1 4.35Å; P62-L103 HydrophobicContact CB-CD1 3.59Å; P62-L103 VanDerWaalsContact O-CD1 3.23Å; P62-L103 WeakPolarHBondContact O-CD1 3.32Å
63	L	92.6	Very high	91.1	Very high	121 Å²	121	47.9 Å²	47.9	63%	0.634	25%	0.254	S	S	*	.	H	α-helix	trans	-74.4	-43.5	-177.4	-64.9	177.5	0	0	0	110.8	D61 L65 S66 S67	D61-L63 VanDerWaalsContact C-N 3.31Å; D61-L63 PolarHBondContact O-N 3.01Å; D61-L63 PolarHBondContact OD1-N 3.06Å; D61-L63 VanDerWaalsContact OD1-N 3.12Å; L63-L65 VanDerWaalsContact C-N 3.34Å; L63-S66 PolarHBondContact O-N 3.45Å; L63-S66 PolarHBondContact O-OG 3.09Å; L63-S67 PolarHBondContact O-N 3Å; L63-S67 VanDerWaalsContact O-N 3.1Å
64	S	92.1	Very high	91	Very high	24 Å²	24	50.8 Å²	50.8	17%	0.168	27%	0.273	C	S	.	.	H	α-helix	trans	-69.5	-36.9	175.2	-63.2	0	0	0	0	110.9	P50 D61 S66 S67 I68	P50-S64 VanDerWaalsContact CG-CB 3.44Å; D61-S64 PolarHBondContact OD1-N 3.26Å; D61-S64 VanDerWaalsContact OD1-N 3.12Å; D61-S64 WeakPolarHBondContact OD2-CB 3.26Å; D61-S64 PolarHBondContact OD2-OG 3.08Å; S64-S66 PolarHBondContact O-N 3.42Å; S64-S67 PolarHBondContact O-N 3.08Å; S64-I68 WeakPolarHBondContact O-CB 3.22Å; S64-I68 WeakPolarHBondContact O-CD1 3.33Å; S64-I68 VanDerWaalsContact O-CG1 3.23Å; S64-I68 WeakPolarHBondContact O-CG1 3.47Å; S64-I68 PolarHBondContact O-N 3.08Å
65	L	93.4	Very high	90.8	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-61.2	-42	173.2	-177.6	60.8	0	0	0	112.2	L53 A56 D61 L63 I68 L69 I100 L103 L104	L53-L65 HydrophobicContact CD1-CD1 4.39Å; L53-L65 HydrophobicContact CG-CD1 3.95Å; A56-L65 HydrophobicContact CB-CB 4.12Å; A56-L65 HydrophobicContact CB-CD1 4.41Å; D61-L65 WeakPolarHBondContact O-CB 3.14Å; D61-L65 PolarHBondContact O-N 3.3Å; D61-L65 VanDerWaalsContact O-N 3.09Å; L63-L65 VanDerWaalsContact C-N 3.34Å; L65-I68 PolarHBondContact O-N 3.12Å; L65-L69 HydrophobicContact CD1-CD1 4.28Å; L65-L69 HydrophobicContact CD1-CG 4.31Å; L65-L69 HydrophobicContact CG-CD1 4Å; L65-L69 HydrophobicContact CG-CG 4.48Å; L65-L69 WeakPolarHBondContact O-CB 3.37Å; L65-L69 VanDerWaalsContact O-CG 3.25Å; L65-L69 WeakPolarHBondContact O-CG 3.28Å; L65-L69 PolarHBondContact O-N 2.84Å; L65-I100 HydrophobicContact CB-CD1 4.39Å; L65-I100 HydrophobicContact CD2-CB 4.37Å; L65-I100 HydrophobicContact CD2-CD1 3.71Å; L65-I100 HydrophobicContact CD2-CG2 3.82Å; L65-L103 HydrophobicContact CB-CD1 4.39Å; L65-L103 HydrophobicContact CD2-CB 3.78Å; L65-L103 HydrophobicContact CD2-CD1 4.16Å; L65-L103 HydrophobicContact CG-CB 4.3Å; L65-L103 HydrophobicContact CG-CD1 4.43Å; L65-L104 HydrophobicContact CD1-CD2 3.99Å; L65-L104 HydrophobicContact CD2-CD2 3.98Å; L65-L104 HydrophobicContact CD2-CG 4.11Å
66	S	92.9	Very high	90.5	Very high	35 Å²	35	58.6 Å²	58.6	25%	0.245	31%	0.309	C	S	.	.	H	α-helix	trans	-64	-42.5	176.9	71.7	0	0	0	0	111.9	P62 L63 S64 I68 L69 E70	P62-S66 PolarHBondContact O-N 3.4Å; L63-S66 PolarHBondContact O-N 3.45Å; L63-S66 PolarHBondContact O-OG 3.09Å; S64-S66 PolarHBondContact O-N 3.42Å; S66-I68 VanDerWaalsContact C-N 3.35Å; S66-I68 PolarHBondContact O-N 2.8Å; S66-L69 PolarHBondContact O-N 3.08Å; S66-E70 WeakPolarHBondContact O-CB 3.47Å; S66-E70 WeakPolarHBondContact O-CG 3.28Å; S66-E70 PolarHBondContact O-N 2.85Å
67	S	91.1	Very high	90.2	Very high	74 Å²	74	60.7 Å²	60.7	52%	0.517	32%	0.319	S	S	.	.	H	α-helix	trans	-61.5	-41.5	176	-178.2	0	0	0	0	112.2	L63 S64 E70 R71	L63-S67 PolarHBondContact O-N 3Å; L63-S67 VanDerWaalsContact O-N 3.1Å; S64-S67 PolarHBondContact O-N 3.08Å; S67-E70 PolarHBondContact O-N 3.05Å; S67-R71 WeakPolarHBondContact O-CB 3.42Å; S67-R71 PolarHBondContact O-N 3.38Å
68	I	90.9	Very high	89.9	Confident	10 Å²	10	61 Å²	61	5%	0.051	32%	0.321	C	S	.	.	H	α-helix	trans	-63.9	-42.7	175.3	-68.9	164.2	0	0	0	110.9	L53 A56 S64 L65 S66 R71 G72 V73	L53-I68 HydrophobicContact CB-CG2 4.39Å; A56-I68 HydrophobicContact CB-CD1 4Å; S64-I68 WeakPolarHBondContact O-CB 3.22Å; S64-I68 WeakPolarHBondContact O-CD1 3.33Å; S64-I68 VanDerWaalsContact O-CG1 3.23Å; S64-I68 WeakPolarHBondContact O-CG1 3.47Å; S64-I68 PolarHBondContact O-N 3.08Å; L65-I68 PolarHBondContact O-N 3.12Å; S66-I68 VanDerWaalsContact C-N 3.35Å; S66-I68 PolarHBondContact O-N 2.8Å; I68-R71 PolarHBondContact O-N 2.9Å; I68-G72 PolarHBondContact O-N 3.06Å; I68-V73 HydrophobicContact CG2-CG2 3.95Å
69	L	90.7	Very high	89.7	Confident	31 Å²	31	65.3 Å²	65.3	16%	0.162	34%	0.339	C	S	.	.	H	α-helix	trans	-65.6	-39.6	177.4	-70.8	168	0	0	0	112.5	L53 L65 S66 R71 G72 V73 L103 C107	L53-L69 HydrophobicContact CD1-CD2 4.44Å; L65-L69 HydrophobicContact CD1-CD1 4.28Å; L65-L69 HydrophobicContact CD1-CG 4.31Å; L65-L69 HydrophobicContact CG-CD1 4Å; L65-L69 HydrophobicContact CG-CG 4.48Å; L65-L69 WeakPolarHBondContact O-CB 3.37Å; L65-L69 VanDerWaalsContact O-CG 3.25Å; L65-L69 WeakPolarHBondContact O-CG 3.28Å; L65-L69 PolarHBondContact O-N 2.84Å; S66-L69 PolarHBondContact O-N 3.08Å; L69-R71 VanDerWaalsContact C-N 3.35Å; L69-G72 PolarHBondContact O-N 2.91Å; L69-V73 HydrophobicContact CD2-CG2 3.85Å; L69-L103 HydrophobicContact CD1-CB 4.12Å; L69-L103 WeakPolarHBondContact CD1-O 3.41Å; L69-C107 HydrophobicContact CD2-CB 3.75Å
70	E	89.8	Confident	89.5	Confident	164 Å²	164	66 Å²	66	77%	0.766	35%	0.345	S	S	*	.	H	α-helix	trans	-67.4	-33.6	176.9	-75.7	175	-174.2	0	0	112.8	S66 S67 G72	S66-E70 WeakPolarHBondContact O-CB 3.47Å; S66-E70 WeakPolarHBondContact O-CG 3.28Å; S66-E70 PolarHBondContact O-N 2.85Å; S67-E70 PolarHBondContact O-N 3.05Å; E70-G72 PolarHBondContact O-N 2.78Å
71	R	88.4	Confident	89.5	Confident	164 Å²	164	67 Å²	67	62%	0.619	35%	0.349	S	S	*	.	H	α-helix	trans	-67	-19.1	174.6	-173.7	168.7	64	96.3	1.5	112.9	S67 I68 L69 E77	S67-R71 WeakPolarHBondContact O-CB 3.42Å; S67-R71 PolarHBondContact O-N 3.38Å; I68-R71 PolarHBondContact O-N 2.9Å; L69-R71 VanDerWaalsContact C-N 3.35Å; R71-E77 IonicContact NH2-OE1 2.6Å
72	G	83.3	Confident	89.4	Confident	42 Å²	42	66.1 Å²	66.1	43%	0.433	35%	0.345	S	S	.	.			trans	89.2	120.9	-173	0	0	0	0	0	110.9	I68 L69 E70	I68-G72 PolarHBondContact O-N 3.06Å; L69-G72 PolarHBondContact O-N 2.91Å; E70-G72 PolarHBondContact O-N 2.78Å
73	V	86.3	Confident	89.3	Confident	15 Å²	15	71.6 Å²	71.6	9%	0.091	37%	0.37	C	S	.	.			trans	-93.4	133.3	-177.4	178.3	0	0	0	0	109.7	L53 I68 L69 E77 A78 F109	L53-V73 HydrophobicContact CD1-CG1 3.8Å; L53-V73 HydrophobicContact CD1-CG2 4.02Å; I68-V73 HydrophobicContact CG2-CG2 3.95Å; L69-V73 HydrophobicContact CD2-CG2 3.85Å; V73-E77 HydrophobicContact CG1-CB 4.07Å; V73-A78 HydrophobicContact CG1-CB 4.03Å; V73-F109 WeakPolarHBondContact O-CD2 3.42Å; V73-F109 VanDerWaalsContact O-CE2 3.22Å; V73-F109 WeakPolarHBondContact O-CE2 3.4Å
74	T	88.3	Confident	89.3	Confident	65 Å²	65	69.3 Å²	69.3	40%	0.399	36%	0.359	S	S	.	.			trans	-77.7	155.6	173.6	58.9	0	0	0	0	111.1	E76 E77 A78	T74-E76 WeakPolarHBondContact CB-OE2 3.41Å; T74-E76 PolarHBondContact O-N 3.36Å; T74-E77 PolarHBondContact N-OE2 3.1Å; T74-E77 VanDerWaalsContact N-OE2 3.09Å; T74-E77 PolarHBondContact O-N 3.08Å; T74-E77 WeakPolarHBondContact OG1-CB 3.38Å; T74-E77 WeakPolarHBondContact OG1-CG 3.49Å; T74-E77 PolarHBondContact OG1-N 2.83Å; T74-E77 PolarHBondContact OG1-OE2 3.34Å; T74-A78 PolarHBondContact O-N 3.2Å; T74-A78 VanDerWaalsContact O-N 3.16Å
75	K	86.3	Confident	89.4	Confident	120 Å²	120	68.5 Å²	68.5	52%	0.522	35%	0.354	S	S	.	.	H	α-helix	trans	-60.8	-36.7	179.4	-177.4	176.8	175.9	-179.5	0	111	A78 M79	K75-A78 PolarHBondContact O-N 2.87Å; K75-M79 HydrophobicContact CD-SD 4.15Å; K75-M79 WeakPolarHBondContact CE-SD 3.39Å; K75-M79 HydrophobicContact CG-CG 4.31Å; K75-M79 HydrophobicContact CG-SD 3.69Å; K75-M79 WeakPolarHBondContact O-CB 3.36Å; K75-M79 VanDerWaalsContact O-CG 3.23Å; K75-M79 WeakPolarHBondContact O-CG 3.32Å; K75-M79 PolarHBondContact O-N 3.05Å
76	E	85.8	Confident	89.4	Confident	141 Å²	141	71.1 Å²	71.1	66%	0.659	36%	0.364	S	S	*	.	H	α-helix	trans	-64.8	-43.4	-179.9	-61.9	71.5	-155.2	0	0	111.8	T74 M79 E80	T74-E76 WeakPolarHBondContact CB-OE2 3.41Å; T74-E76 PolarHBondContact O-N 3.36Å; E76-M79 PolarHBondContact O-N 3.05Å; E76-E80 PolarHBondContact O-N 2.98Å
77	E	86.1	Confident	89.5	Confident	44 Å²	44	69.8 Å²	69.8	21%	0.206	35%	0.354	C	S	.	.	H	α-helix	trans	-66.5	-36.9	176.2	-73.7	167.2	153.3	0	0	112.4	R71 V73 T74 M79 E80	R71-E77 IonicContact NH2-OE1 2.6Å; V73-E77 HydrophobicContact CG1-CB 4.07Å; T74-E77 PolarHBondContact N-OE2 3.1Å; T74-E77 VanDerWaalsContact N-OE2 3.09Å; T74-E77 PolarHBondContact O-N 3.08Å; T74-E77 WeakPolarHBondContact OG1-CB 3.38Å; T74-E77 WeakPolarHBondContact OG1-CG 3.49Å; T74-E77 PolarHBondContact OG1-N 2.83Å; T74-E77 PolarHBondContact OG1-OE2 3.34Å; E77-M79 VanDerWaalsContact C-N 3.33Å; E77-E80 WeakPolarHBondContact O-CB 3.35Å; E77-E80 PolarHBondContact O-N 3.42Å
78	A	84.9	Confident	89.6	Confident	6 Å²	6	66.4 Å²	66.4	5%	0.05	33%	0.331	C	S	.	.	H	α-helix	trans	-72.4	-27.6	177.8	0	0	0	0	0	112.9	V73 T74 K75 F109 I110	V73-A78 HydrophobicContact CG1-CB 4.03Å; T74-A78 PolarHBondContact O-N 3.2Å; T74-A78 VanDerWaalsContact O-N 3.16Å; K75-A78 PolarHBondContact O-N 2.87Å; A78-F109 HydrophobicContact CB-CB 3.69Å; A78-I110 HydrophobicContact CB-CG1 4.36Å
79	M	87.6	Confident	89.8	Confident	111 Å²	111	66 Å²	66	55%	0.547	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	8.5	178.5	-67.3	-177.6	72	0	0	113.3	K75 E76 E77 L81	K75-M79 HydrophobicContact CD-SD 4.15Å; K75-M79 WeakPolarHBondContact CE-SD 3.39Å; K75-M79 HydrophobicContact CG-CG 4.31Å; K75-M79 HydrophobicContact CG-SD 3.69Å; K75-M79 WeakPolarHBondContact O-CB 3.36Å; K75-M79 VanDerWaalsContact O-CG 3.23Å; K75-M79 WeakPolarHBondContact O-CG 3.32Å; K75-M79 PolarHBondContact O-N 3.05Å; E76-M79 PolarHBondContact O-N 3.05Å; E77-M79 VanDerWaalsContact C-N 3.33Å; M79-L81 WeakPolarHBondContact O-CG 3.35Å; M79-L81 PolarHBondContact O-N 3.26Å
80	E	89.1	Confident	90	Very high	73 Å²	73	64.6 Å²	64.6	34%	0.341	32%	0.321	S	S	.	.			trans	-62.2	124.6	174.2	-169	178.3	-178.8	0	0	110	T52 Y54 E76 E77	T52-E80 WeakPolarHBondContact CB-OE2 3.36Å; T52-E80 PolarHBondContact OG1-OE2 3.47Å; T52-E80 VanDerWaalsContact OG1-OE2 3.11Å; Y54-E80 VanDerWaalsContact CB-OE2 3.32Å; Y54-E80 WeakPolarHBondContact CB-OE2 3.45Å; Y54-E80 HydrophobicContact CG-CG 4.4Å; E76-E80 PolarHBondContact O-N 2.98Å; E77-E80 WeakPolarHBondContact O-CB 3.35Å; E77-E80 PolarHBondContact O-N 3.42Å
81	L	92.5	Very high	90.3	Very high	83 Å²	83	57 Å²	57	44%	0.435	29%	0.286	S	S	.	.			trans	-114.1	147.5	-178.6	-58.9	-178.5	0	0	0	110.9	M79 R86 N87	M79-L81 WeakPolarHBondContact O-CG 3.35Å; M79-L81 PolarHBondContact O-N 3.26Å; L81-R86 WeakPolarHBondContact CA-O 3.16Å; L81-N87 HydrophobicContact CD2-CB 3.81Å
82	D	91.4	Very high	90.6	Very high	25 Å²	25	49.2 Å²	49.2	13%	0.134	26%	0.257	C	S	.	.			trans	-81.1	177.8	173.7	87.7	-12.9	0	0	0	112.9	Y54 N84 G85 R86	Y54-D82 HydrophobicContact CE2-CB 3.89Å; Y54-D82 WeakPolarHBondContact OH-CB 3.29Å; D82-N84 PolarHBondContact O-N 3.32Å; D82-N84 VanDerWaalsContact O-N 3.11Å; D82-N84 VanDerWaalsContact OD1-CA 3.22Å; D82-N84 WeakPolarHBondContact OD1-CA 3.48Å; D82-N84 WeakPolarHBondContact OD1-CB 3.04Å; D82-N84 PolarHBondContact OD1-N 3.1Å; D82-G85 PolarHBondContact O-N 3.39Å; D82-G85 PolarHBondContact OD1-N 3.44Å; D82-R86 PolarHBondContact N-O 3.33Å; D82-R86 WeakPolarHBondContact OD1-CB 3.39Å; D82-R86 PolarHBondContact OD1-N 2.99Å; D82-R86 IonicContact OD1-NE 3.24Å; D82-R86 IonicContact OD2-CZ 3.76Å; D82-R86 IonicContact OD2-NE 2.79Å; D82-R86 PolarHBondContact OD2-NE 2.98Å; D82-R86 IonicContact OD2-NH2 3.43Å; D82-R86 PolarHBondContact OD2-NH2 3.31Å
83	I	92.3	Very high	91.2	Very high	156 Å²	156	47.2 Å²	47.2	80%	0.8	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	-22.4	177.6	59.4	169.2	0	0	0	113.8	N117	I83-N117 PolarHBondContact O-ND2 3.48Å
84	N	92.3	Very high	91.7	Very high	73 Å²	73	48.3 Å²	48.3	39%	0.39	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	6.5	177.9	-56.7	-39.8	0	0	0	111.5	D82 R86 D116 N117	D82-N84 PolarHBondContact O-N 3.32Å; D82-N84 VanDerWaalsContact O-N 3.11Å; D82-N84 VanDerWaalsContact OD1-CA 3.22Å; D82-N84 WeakPolarHBondContact OD1-CA 3.48Å; D82-N84 WeakPolarHBondContact OD1-CB 3.04Å; D82-N84 PolarHBondContact OD1-N 3.1Å; N84-R86 VanDerWaalsContact C-N 3.31Å; N84-R86 HydrophobicContact CB-CG 4.27Å; N84-R86 PolarHBondContact ND2-NH2 3.41Å; N84-R86 PolarHBondContact O-N 2.9Å; N84-D116 WeakPolarHBondContact O-CB 3.16Å; N84-N117 WeakPolarHBondContact CA-ND2 3.33Å; N84-N117 WeakPolarHBondContact O-CB 3.34Å; N84-N117 PolarHBondContact O-N 3.06Å; N84-N117 PolarHBondContact O-ND2 2.88Å; N84-N117 PolarHBondContact O-OD1 3.41Å
85	G	93.6	Very high	91.9	Very high	7 Å²	7	50.2 Å²	50.2	7%	0.072	25%	0.247	C	C	.	.	S	Bend	trans	73.5	17.7	-177	0	0	0	0	0	113.8	D82 H114	D82-G85 PolarHBondContact O-N 3.39Å; D82-G85 PolarHBondContact OD1-N 3.44Å; G85-H114 PolarHBondContact O-CD2 3.31Å; G85-H114 PolarHBondContact O-NE2 3.07Å
86	R	93.7	Very high	92.3	Very high	54 Å²	54	45.6 Å²	45.6	20%	0.204	23%	0.234	C	C	.	.			trans	-87.3	133.6	179.3	-61.2	-179.9	-61.9	-176.5	-0.5	110.8	L81 D82 N84 M90 D116	L81-R86 WeakPolarHBondContact CA-O 3.16Å; D82-R86 PolarHBondContact N-O 3.33Å; D82-R86 WeakPolarHBondContact OD1-CB 3.39Å; D82-R86 PolarHBondContact OD1-N 2.99Å; D82-R86 IonicContact OD1-NE 3.24Å; D82-R86 IonicContact OD2-CZ 3.76Å; D82-R86 IonicContact OD2-NE 2.79Å; D82-R86 PolarHBondContact OD2-NE 2.98Å; D82-R86 IonicContact OD2-NH2 3.43Å; D82-R86 PolarHBondContact OD2-NH2 3.31Å; N84-R86 VanDerWaalsContact C-N 3.31Å; N84-R86 HydrophobicContact CB-CG 4.27Å; N84-R86 PolarHBondContact ND2-NH2 3.41Å; N84-R86 PolarHBondContact O-N 2.9Å; R86-M90 HydrophobicContact CB-CB 3.96Å; R86-M90 HydrophobicContact CG-CB 4.33Å; R86-M90 HydrophobicContact CG-CE 4.29Å; R86-D116 HydrophobicContact CG-CB 3.78Å
87	N	93.9	Very high	92.9	Very high	8 Å²	8	40.8 Å²	40.8	4%	0.043	21%	0.211	C	C	.	.			trans	-76.4	170.7	168.5	68.5	17	0	0	0	111.3	L81 L89 M90 L91 D111	L81-N87 HydrophobicContact CD2-CB 3.81Å; N87-L89 PolarHBondContact O-N 3.27Å; N87-L89 WeakPolarHBondContact OD1-CB 3.35Å; N87-L89 PolarHBondContact OD1-N 3.44Å; N87-M90 PolarHBondContact O-N 3.35Å; N87-M90 WeakPolarHBondContact OD1-CB 3.47Å; N87-M90 WeakPolarHBondContact OD1-CG 3.27Å; N87-M90 PolarHBondContact OD1-N 2.99Å; N87-L91 PolarHBondContact O-N 3.42Å; N87-D111 PolarHBondContact ND2-O 3.45Å
88	G	93.4	Very high	93.3	Very high	3 Å²	3	41.4 Å²	41.4	3%	0.031	22%	0.218	C	C	.	.	H	α-helix	trans	-56.6	-33.1	179.6	0	0	0	0	0	113.8	A92	G88-A92 WeakPolarHBondContact O-CB 3.39Å; G88-A92 PolarHBondContact O-N 2.9Å
89	L	95.5	Very high	93.8	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-68.7	-48.7	176.9	179.1	62.9	0	0	0	112.2	N87 L91 A92 V93 V101 L104 I110 I112 A122 Y142	N87-L89 PolarHBondContact O-N 3.27Å; N87-L89 WeakPolarHBondContact OD1-CB 3.35Å; N87-L89 PolarHBondContact OD1-N 3.44Å; L89-L91 PolarHBondContact O-N 3.21Å; L89-A92 WeakPolarHBondContact O-CB 3.36Å; L89-A92 PolarHBondContact O-N 3.28Å; L89-A92 VanDerWaalsContact O-N 3.16Å; L89-V93 HydrophobicContact CD1-CG2 4.15Å; L89-V93 HydrophobicContact CG-CG2 4.35Å; L89-V93 WeakPolarHBondContact O-CB 3.34Å; L89-V93 VanDerWaalsContact O-CG2 3.25Å; L89-V93 WeakPolarHBondContact O-CG2 3.36Å; L89-V93 PolarHBondContact O-N 3.09Å; L89-V101 HydrophobicContact CD1-CB 4.34Å; L89-V101 HydrophobicContact CD1-CG1 4.06Å; L89-V101 HydrophobicContact CD1-CG2 4.02Å; L89-L104 HydrophobicContact CB-CD1 3.99Å; L89-L104 HydrophobicContact CD1-CB 4.39Å; L89-L104 HydrophobicContact CD1-CD1 3.87Å; L89-I110 HydrophobicContact CB-CG2 4.06Å; L89-I110 HydrophobicContact CD2-CG2 4.09Å; L89-I112 HydrophobicContact CD2-CD1 3.2Å; L89-A122 HydrophobicContact CD2-CB 4.29Å; L89-A122 HydrophobicContact CG-CB 4.31Å; L89-Y142 WeakPolarHBondContact CD1-OH 3.3Å; L89-Y142 HydrophobicContact CD2-CD1 4.47Å; L89-Y142 HydrophobicContact CD2-CE1 3.83Å
90	M	95.8	Very high	94.2	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-60.3	-37.8	177.5	-71.6	175.7	78.4	0	0	111.3	R86 N87 V93 S94 D116 N120 A122 I125	R86-M90 HydrophobicContact CB-CB 3.96Å; R86-M90 HydrophobicContact CG-CB 4.33Å; R86-M90 HydrophobicContact CG-CE 4.29Å; N87-M90 PolarHBondContact O-N 3.35Å; N87-M90 WeakPolarHBondContact OD1-CB 3.47Å; N87-M90 WeakPolarHBondContact OD1-CG 3.27Å; N87-M90 PolarHBondContact OD1-N 2.99Å; M90-V93 PolarHBondContact O-N 3.4Å; M90-S94 VanDerWaalsContact O-CB 3.29Å; M90-S94 WeakPolarHBondContact O-CB 3.45Å; M90-S94 PolarHBondContact O-N 2.85Å; M90-S94 PolarHBondContact O-OG 3Å; M90-D116 HydrophobicContact CE-CB 3.49Å; M90-D116 VanDerWaalsContact CE-CB 3.49Å; M90-D116 HydrophobicContact SD-CB 4.49Å; M90-N120 WeakPolarHBondContact CE-O 3.38Å; M90-A122 HydrophobicContact CG-CB 3.88Å; M90-I125 HydrophobicContact CB-CD1 4.2Å; M90-I125 HydrophobicContact CE-CD1 3.54Å; M90-I125 HydrophobicContact CG-CD1 4.4Å
91	L	94.9	Very high	94.5	Very high	5 Å²	5	37 Å²	37	3%	0.026	20%	0.198	C	C	.	.	H	α-helix	trans	-61.5	-51	173	-175.5	69.8	0	0	0	111.3	Y54 A58 N87 L89 V93 S94 K95	Y54-L91 HydrophobicContact CE1-CD2 4.3Å; Y54-L91 HydrophobicContact CE2-CB 4.46Å; Y54-L91 HydrophobicContact CE2-CD2 3.9Å; Y54-L91 WeakPolarHBondContact OH-CD2 3.27Å; A58-L91 VanDerWaalsContact CA-CD2 3.43Å; A58-L91 HydrophobicContact CB-CD2 3.57Å; N87-L91 PolarHBondContact O-N 3.42Å; L89-L91 PolarHBondContact O-N 3.21Å; L91-V93 VanDerWaalsContact C-N 3.31Å; L91-V93 PolarHBondContact O-N 3.16Å; L91-S94 PolarHBondContact O-N 3.04Å; L91-S94 PolarHBondContact O-OG 3.19Å; L91-K95 PolarHBondContact O-N 3.09Å
92	A	95.6	Very high	94.6	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58.6	-43.2	178.1	0	0	0	0	0	111.9	G88 L89 K95 G96 F97 I100 V101 L104	G88-A92 WeakPolarHBondContact O-CB 3.39Å; G88-A92 PolarHBondContact O-N 2.9Å; L89-A92 WeakPolarHBondContact O-CB 3.36Å; L89-A92 PolarHBondContact O-N 3.28Å; L89-A92 VanDerWaalsContact O-N 3.16Å; A92-K95 PolarHBondContact O-N 3.44Å; A92-G96 PolarHBondContact O-N 3.05Å; A92-F97 HydrophobicContact CB-CB 4.23Å; A92-F97 PolarHBondContact O-N 3.28Å; A92-I100 HydrophobicContact CB-CB 4.01Å; A92-I100 HydrophobicContact CB-CG2 3.48Å; A92-I100 VanDerWaalsContact CB-CG2 3.48Å; A92-V101 HydrophobicContact CB-CG2 3.99Å; A92-L104 HydrophobicContact CB-CD1 4.48Å
93	V	96.5	Very high	94.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.2	-44.4	176	173.3	0	0	0	0	111.3	L89 M90 L91 K95 G96 V101 A122 I125 A126 F131 I134 I138	L89-V93 HydrophobicContact CD1-CG2 4.15Å; L89-V93 HydrophobicContact CG-CG2 4.35Å; L89-V93 WeakPolarHBondContact O-CB 3.34Å; L89-V93 VanDerWaalsContact O-CG2 3.25Å; L89-V93 WeakPolarHBondContact O-CG2 3.36Å; L89-V93 PolarHBondContact O-N 3.09Å; M90-V93 PolarHBondContact O-N 3.4Å; L91-V93 VanDerWaalsContact C-N 3.31Å; L91-V93 PolarHBondContact O-N 3.16Å; V93-K95 PolarHBondContact O-N 3.41Å; V93-G96 PolarHBondContact O-N 2.64Å; V93-G96 VanDerWaalsContact O-N 3.14Å; V93-V101 HydrophobicContact CG2-CG2 3.79Å; V93-A122 WeakPolarHBondContact CG1-O 3.32Å; V93-A122 HydrophobicContact CG2-CB 4.34Å; V93-I125 HydrophobicContact CG1-CB 4.16Å; V93-I125 HydrophobicContact CG1-CG2 4.02Å; V93-A126 HydrophobicContact CG1-CB 3.66Å; V93-F131 VanDerWaalsContact O-CD2 3.24Å; V93-F131 WeakPolarHBondContact O-CD2 3.37Å; V93-F131 WeakPolarHBondContact O-CE2 3.37Å; V93-I134 HydrophobicContact CB-CG2 4.37Å; V93-I134 HydrophobicContact CG1-CG2 4.08Å; V93-I134 HydrophobicContact CG2-CG2 3.76Å; V93-I138 HydrophobicContact CG2-CD1 3.92Å
94	S	95.3	Very high	94.8	Very high	39 Å²	39	27.8 Å²	27.8	27%	0.273	15%	0.152	S	C	.	.	H	α-helix	trans	-62.4	-32.5	179.7	74.1	0	0	0	0	112.9	M90 L91	M90-S94 VanDerWaalsContact O-CB 3.29Å; M90-S94 WeakPolarHBondContact O-CB 3.45Å; M90-S94 PolarHBondContact O-N 2.85Å; M90-S94 PolarHBondContact O-OG 3Å; L91-S94 PolarHBondContact O-N 3.04Å; L91-S94 PolarHBondContact O-OG 3.19Å
95	K	94.3	Very high	94.7	Very high	104 Å²	104	27.1 Å²	27.1	45%	0.452	15%	0.146	S	C	.	.	H	α-helix	trans	-91	-7.2	177.7	-65.2	-171.7	177.5	-173.1	0	113.9	A58 L91 A92 V93 F97	A58-K95 PolarHBondContact O-NZ 3.39Å; L91-K95 PolarHBondContact O-N 3.09Å; A92-K95 PolarHBondContact O-N 3.44Å; V93-K95 PolarHBondContact O-N 3.41Å; K95-F97 HydrophobicContact CB-CD1 3.97Å; K95-F97 HydrophobicContact CB-CD2 3.97Å; K95-F97 HydrophobicContact CB-CE1 3.71Å; K95-F97 HydrophobicContact CB-CE2 3.71Å; K95-F97 HydrophobicContact CB-CG 4.1Å; K95-F97 HydrophobicContact CB-CZ 3.57Å; K95-F97 HydrophobicContact CD-CD2 4.28Å; K95-F97 HydrophobicContact CD-CE1 4.34Å; K95-F97 HydrophobicContact CD-CE2 3.35Å; K95-F97 HydrophobicContact CD-CZ 3.39Å; K95-F97 HydrophobicContact CG-CE2 4.17Å; K95-F97 HydrophobicContact CG-CZ 4.13Å
96	G	94.7	Very high	94.4	Very high	23 Å²	23	31.8 Å²	31.8	24%	0.237	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	77	23.9	-179.6	0	0	0	0	0	114.8	A92 V93 V98	A92-G96 PolarHBondContact O-N 3.05Å; V93-G96 PolarHBondContact O-N 2.64Å; V93-G96 VanDerWaalsContact O-N 3.14Å; G96-V98 PolarHBondContact O-N 3.5Å
97	F	96.5	Very high	94.2	Very high	40 Å²	40	29.7 Å²	29.7	18%	0.175	16%	0.158	C	C	.	.			trans	-78.5	83.5	-178.1	-61.5	-20.5	0	0	0	111.7	C57 N60 A92 K95 D99 I100 V101	C57-F97 WeakPolarHBondContact O-CD2 3.33Å; C57-F97 WeakPolarHBondContact O-CE2 3.44Å; N60-F97 HydrophobicContact CB-CD1 4.05Å; N60-F97 HydrophobicContact CB-CD2 3.73Å; N60-F97 HydrophobicContact CB-CE1 3.85Å; N60-F97 HydrophobicContact CB-CE2 3.5Å; N60-F97 HydrophobicContact CB-CG 4Å; N60-F97 HydrophobicContact CB-CZ 3.57Å; N60-F97 WeakPolarHBondContact OD1-CB 3.43Å; N60-F97 VanDerWaalsContact OD1-CG 3.23Å; N60-F97 WeakPolarHBondContact OD1-CG 3.5Å; A92-F97 HydrophobicContact CB-CB 4.23Å; A92-F97 PolarHBondContact O-N 3.28Å; K95-F97 HydrophobicContact CB-CD1 3.97Å; K95-F97 HydrophobicContact CB-CD2 3.97Å; K95-F97 HydrophobicContact CB-CE1 3.71Å; K95-F97 HydrophobicContact CB-CE2 3.71Å; K95-F97 HydrophobicContact CB-CG 4.1Å; K95-F97 HydrophobicContact CB-CZ 3.57Å; K95-F97 HydrophobicContact CD-CD2 4.28Å; K95-F97 HydrophobicContact CD-CE1 4.34Å; K95-F97 HydrophobicContact CD-CE2 3.35Å; K95-F97 HydrophobicContact CD-CZ 3.39Å; K95-F97 HydrophobicContact CG-CE2 4.17Å; K95-F97 HydrophobicContact CG-CZ 4.13Å; F97-D99 PolarHBondContact O-N 3.1Å; F97-I100 HydrophobicContact CB-CB 3.94Å; F97-I100 HydrophobicContact CB-CG1 3.91Å; F97-I100 HydrophobicContact CD2-CG1 4.45Å; F97-I100 PolarHBondContact O-N 3.2Å; F97-V101 WeakPolarHBondContact O-CG2 3.44Å; F97-V101 PolarHBondContact O-N 3.05Å; F97-V101 VanDerWaalsContact O-N 3.09Å
98	V	95.6	Very high	93.7	Very high	58 Å²	58	34.5 Å²	34.5	35%	0.352	19%	0.19	S	C	.	.	H	α-helix	trans	-55.1	-49.8	-177.7	-178.1	0	0	0	0	111.5	G96 I100 V101 T102 I134	G96-V98 PolarHBondContact O-N 3.5Å; V98-I100 VanDerWaalsContact C-N 3.34Å; V98-I100 PolarHBondContact O-N 3.26Å; V98-V101 PolarHBondContact O-N 3.2Å; V98-V101 VanDerWaalsContact O-N 3.16Å; V98-T102 HydrophobicContact CG1-CG2 4.29Å; V98-T102 VanDerWaalsContact O-CG2 3.29Å; V98-T102 WeakPolarHBondContact O-CG2 3.41Å; V98-T102 PolarHBondContact O-N 3.32Å; V98-I134 HydrophobicContact CG2-CD1 4.19Å; V98-I134 HydrophobicContact CG2-CG1 3.91Å
99	D	95.6	Very high	93.5	Very high	97 Å²	97	39.1 Å²	39.1	52%	0.519	21%	0.209	S	C	.	.	H	α-helix	trans	-61.3	-42.6	-175.5	-61.2	-28.3	0	0	0	111.8	P62 F97 T102 L103	P62-D99 HydrophobicContact CB-CB 4.3Å; F97-D99 PolarHBondContact O-N 3.1Å; D99-T102 PolarHBondContact O-N 2.96Å; D99-T102 PolarHBondContact O-OG1 3.15Å; D99-L103 WeakPolarHBondContact O-CG 3.21Å; D99-L103 PolarHBondContact O-N 3.24Å
100	I	95.9	Very high	93.3	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61	-48.7	175.4	-61	-62.9	0	0	0	110.6	C57 N60 P62 L65 A92 F97 V98 T102 L103 L104	C57-I100 HydrophobicContact CB-CG2 4.06Å; N60-I100 WeakPolarHBondContact OD1-CG1 3.34Å; P62-I100 HydrophobicContact CB-CD1 4.35Å; L65-I100 HydrophobicContact CB-CD1 4.39Å; L65-I100 HydrophobicContact CD2-CB 4.37Å; L65-I100 HydrophobicContact CD2-CD1 3.71Å; L65-I100 HydrophobicContact CD2-CG2 3.82Å; A92-I100 HydrophobicContact CB-CB 4.01Å; A92-I100 HydrophobicContact CB-CG2 3.48Å; A92-I100 VanDerWaalsContact CB-CG2 3.48Å; F97-I100 HydrophobicContact CB-CB 3.94Å; F97-I100 HydrophobicContact CB-CG1 3.91Å; F97-I100 HydrophobicContact CD2-CG1 4.45Å; F97-I100 PolarHBondContact O-N 3.2Å; V98-I100 VanDerWaalsContact C-N 3.34Å; V98-I100 PolarHBondContact O-N 3.26Å; I100-T102 PolarHBondContact O-N 3.13Å; I100-L103 PolarHBondContact O-N 3.12Å; I100-L104 HydrophobicContact CG2-CD1 3.76Å; I100-L104 HydrophobicContact CG2-CG 4.12Å; I100-L104 VanDerWaalsContact O-CG 3.28Å; I100-L104 WeakPolarHBondContact O-CG 3.45Å; I100-L104 PolarHBondContact O-N 3.04Å
101	V	96	Very high	93.1	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.006	24%	0.237	C	C	.	.	H	α-helix	trans	-58.3	-37.5	176.8	174.5	0	0	0	0	111.4	L89 A92 V93 F97 V98 I134 Y137 I138 Y142	L89-V101 HydrophobicContact CD1-CB 4.34Å; L89-V101 HydrophobicContact CD1-CG1 4.06Å; L89-V101 HydrophobicContact CD1-CG2 4.02Å; A92-V101 HydrophobicContact CB-CG2 3.99Å; V93-V101 HydrophobicContact CG2-CG2 3.79Å; F97-V101 WeakPolarHBondContact O-CG2 3.44Å; F97-V101 PolarHBondContact O-N 3.05Å; F97-V101 VanDerWaalsContact O-N 3.09Å; V98-V101 PolarHBondContact O-N 3.2Å; V98-V101 VanDerWaalsContact O-N 3.16Å; V101-I134 HydrophobicContact CG1-CG2 4.24Å; V101-I134 HydrophobicContact CG2-CD1 4.48Å; V101-I134 HydrophobicContact CG2-CG2 4.17Å; V101-Y137 HydrophobicContact CG1-CD1 4.11Å; V101-I138 HydrophobicContact CG1-CG1 4.28Å; V101-Y142 HydrophobicContact CG1-CE2 4.27Å; V101-Y142 PolarHBondContact O-OH 3.33Å
102	T	94.4	Very high	93	Very high	39 Å²	39	44.7 Å²	44.7	24%	0.239	24%	0.239	C	C	.	.	H	α-helix	trans	-70.4	-31	177	70.2	0	0	0	0	113.5	V98 D99 I100 H105 Y137	V98-T102 HydrophobicContact CG1-CG2 4.29Å; V98-T102 VanDerWaalsContact O-CG2 3.29Å; V98-T102 WeakPolarHBondContact O-CG2 3.41Å; V98-T102 PolarHBondContact O-N 3.32Å; D99-T102 PolarHBondContact O-N 2.96Å; D99-T102 PolarHBondContact O-OG1 3.15Å; I100-T102 PolarHBondContact O-N 3.13Å; T102-H105 PolarHBondContact O-ND1 2.92Å; T102-Y137 HydrophobicContact CG2-CD1 4.36Å; T102-Y137 HydrophobicContact CG2-CD2 3.8Å; T102-Y137 HydrophobicContact CG2-CE1 4.12Å; T102-Y137 HydrophobicContact CG2-CE2 3.52Å; T102-Y137 HydrophobicContact CG2-CG 4.2Å; T102-Y137 PolarHBondContact O-OH 2.88Å
103	L	94	Very high	93	Very high	30 Å²	30	46.3 Å²	46.3	16%	0.157	25%	0.247	C	C	.	.	H	α-helix	trans	-77.3	-39	176.6	-72.2	171.5	0	0	0	112	P62 L65 L69 D99 I100 H105 K106	P62-L103 HydrophobicContact CB-CD1 3.59Å; P62-L103 VanDerWaalsContact O-CD1 3.23Å; P62-L103 WeakPolarHBondContact O-CD1 3.32Å; L65-L103 HydrophobicContact CB-CD1 4.39Å; L65-L103 HydrophobicContact CD2-CB 3.78Å; L65-L103 HydrophobicContact CD2-CD1 4.16Å; L65-L103 HydrophobicContact CG-CB 4.3Å; L65-L103 HydrophobicContact CG-CD1 4.43Å; L69-L103 HydrophobicContact CD1-CB 4.12Å; L69-L103 WeakPolarHBondContact CD1-O 3.41Å; D99-L103 WeakPolarHBondContact O-CG 3.21Å; D99-L103 PolarHBondContact O-N 3.24Å; I100-L103 PolarHBondContact O-N 3.12Å; L103-H105 PolarHBondContact O-N 2.84Å; L103-K106 WeakPolarHBondContact O-CB 3.48Å; L103-K106 PolarHBondContact O-N 3.16Å; L103-K106 VanDerWaalsContact O-N 3.11Å
104	L	92.6	Very high	92.9	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.5	-23.1	-177.6	-70.9	175.4	0	0	0	113.8	L53 L65 L89 A92 I100 K106 C107 I110 Y142	L53-L104 HydrophobicContact CD1-CD2 4.23Å; L53-L104 HydrophobicContact CD2-CD2 3.9Å; L53-L104 HydrophobicContact CG-CD2 4.24Å; L65-L104 HydrophobicContact CD1-CD2 3.99Å; L65-L104 HydrophobicContact CD2-CD2 3.98Å; L65-L104 HydrophobicContact CD2-CG 4.11Å; L89-L104 HydrophobicContact CB-CD1 3.99Å; L89-L104 HydrophobicContact CD1-CB 4.39Å; L89-L104 HydrophobicContact CD1-CD1 3.87Å; A92-L104 HydrophobicContact CB-CD1 4.48Å; I100-L104 HydrophobicContact CG2-CD1 3.76Å; I100-L104 HydrophobicContact CG2-CG 4.12Å; I100-L104 VanDerWaalsContact O-CG 3.28Å; I100-L104 WeakPolarHBondContact O-CG 3.45Å; I100-L104 PolarHBondContact O-N 3.04Å; L104-K106 PolarHBondContact O-N 3.35Å; L104-K106 VanDerWaalsContact O-N 3.12Å; L104-C107 WeakPolarHBondContact O-CB 3.38Å; L104-C107 PolarHBondContact O-N 3.31Å; L104-I110 HydrophobicContact CB-CD1 3.77Å; L104-I110 HydrophobicContact CD1-CD1 4.47Å; L104-I110 HydrophobicContact CD2-CD1 3.5Å; L104-I110 HydrophobicContact CG-CD1 4.08Å; L104-Y142 WeakPolarHBondContact CB-OH 3.39Å
105	H	90.1	Very high	92.9	Very high	60 Å²	60	50.2 Å²	50.2	28%	0.278	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-23.3	176.4	96.9	-88.1	0	0	0	112.7	T102 L103 C107 Y137 Y142	T102-H105 PolarHBondContact O-ND1 2.92Å; L103-H105 PolarHBondContact O-N 2.84Å; H105-C107 PolarHBondContact O-N 3.15Å; H105-Y137 HydrophobicContact CB-CE1 4.09Å; H105-Y137 PolarHBondContact CE1-OH 3.4Å; H105-Y137 PolarHBondContact ND1-OH 3.18Å; H105-Y142 HydrophobicContact CB-CD2 4.14Å; H105-Y142 HydrophobicContact CB-CE1 4.19Å; H105-Y142 HydrophobicContact CB-CE2 3.64Å; H105-Y142 PolarHBondContact N-OH 2.86Å
106	K	88.8	Confident	93	Very high	105 Å²	105	46 Å²	46	46%	0.457	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-15.7	177.4	-61.3	-176.7	175.3	-175.9	0	112.3	L103 L104 P108 A340	L103-K106 WeakPolarHBondContact O-CB 3.48Å; L103-K106 PolarHBondContact O-N 3.16Å; L103-K106 VanDerWaalsContact O-N 3.11Å; L104-K106 PolarHBondContact O-N 3.35Å; L104-K106 VanDerWaalsContact O-N 3.12Å; K106-P108 WeakPolarHBondContact O-CD 3.38Å; K106-A340 PolarHBondContact NZ-O 2.92Å
107	C	89.3	Confident	93	Very high	9 Å²	9	50.4 Å²	50.4	6%	0.061	26%	0.262	C	S	.	.			trans	-86.6	114.2	179.2	-167.8	0	0	0	0	109.8	L69 L104 H105 F109 I110	L69-C107 HydrophobicContact CD2-CB 3.75Å; L104-C107 WeakPolarHBondContact O-CB 3.38Å; L104-C107 PolarHBondContact O-N 3.31Å; H105-C107 PolarHBondContact O-N 3.15Å; C107-F109 PolarHBondContact O-N 2.93Å; C107-I110 HydrophobicContact CB-CD1 3.57Å; C107-I110 HydrophobicContact CB-CG1 3.85Å
108	P	83.9	Confident	92.9	Very high	109 Å²	109	54 Å²	54	71%	0.708	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-15.8	-177.6	30.2	-35.5	0	0	0	113.4	K106	K106-P108 WeakPolarHBondContact O-CD 3.38Å
109	F	88.8	Confident	92.9	Very high	100 Å²	100	51.7 Å²	51.7	44%	0.439	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-5.4	-173.5	-54.4	-60.9	0	0	0	114	V73 A78 C107 D111	V73-F109 WeakPolarHBondContact O-CD2 3.42Å; V73-F109 VanDerWaalsContact O-CE2 3.22Å; V73-F109 WeakPolarHBondContact O-CE2 3.4Å; A78-F109 HydrophobicContact CB-CB 3.69Å; C107-F109 PolarHBondContact O-N 2.93Å; F109-D111 PolarHBondContact O-N 3.25Å
110	I	90.4	Very high	92.9	Very high	21 Å²	21	47.9 Å²	47.9	11%	0.108	25%	0.25	C	S	.	.			trans	-78.2	120.6	-179.7	-67	175.6	0	0	0	109.3	A78 L89 L104 C107 I112	A78-I110 HydrophobicContact CB-CG1 4.36Å; L89-I110 HydrophobicContact CB-CG2 4.06Å; L89-I110 HydrophobicContact CD2-CG2 4.09Å; L104-I110 HydrophobicContact CB-CD1 3.77Å; L104-I110 HydrophobicContact CD1-CD1 4.47Å; L104-I110 HydrophobicContact CD2-CD1 3.5Å; L104-I110 HydrophobicContact CG-CD1 4.08Å; C107-I110 HydrophobicContact CB-CD1 3.57Å; C107-I110 HydrophobicContact CB-CG1 3.85Å; I110-I112 PolarHBondContact O-N 3.21Å
111	D	91.4	Very high	93	Very high	90 Å²	90	48 Å²	48	48%	0.481	25%	0.251	S	S	.	.			trans	-78.4	108.8	171.4	-173.7	0.6	0	0	0	110.6	N87 F109 N113 H114	N87-D111 PolarHBondContact ND2-O 3.45Å; F109-D111 PolarHBondContact O-N 3.25Å; D111-N113 VanDerWaalsContact C-N 3.31Å; D111-N113 PolarHBondContact OD1-N 3.46Å; D111-H114 HydrophobicContact CB-CB 4.14Å; D111-H114 WeakPolarHBondContact O-CB 3.48Å; D111-H114 PolarHBondContact OD1-N 2.85Å
112	I	93.6	Very high	93	Very high	14 Å²	14	48 Å²	48	7%	0.072	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-26.8	178.4	-172.2	57.8	0	0	0	112.9	L89 I110 A122 I138 Y142 V145	L89-I112 HydrophobicContact CD2-CD1 3.2Å; I110-I112 PolarHBondContact O-N 3.21Å; I112-A122 HydrophobicContact CD1-CB 4.34Å; I112-I138 HydrophobicContact CD1-CG1 4.48Å; I112-I138 HydrophobicContact CD1-CG2 3.85Å; I112-I138 HydrophobicContact CG1-CG2 4.23Å; I112-Y142 HydrophobicContact CB-CD1 4.3Å; I112-Y142 HydrophobicContact CD1-CD1 3.77Å; I112-Y142 HydrophobicContact CD1-CE1 4.21Å; I112-Y142 HydrophobicContact CD1-CG 4.06Å; I112-Y142 HydrophobicContact CG1-CD1 4.11Å; I112-Y142 HydrophobicContact CG1-CG 4.32Å; I112-V145 HydrophobicContact CG1-CG2 3.81Å; I112-V145 HydrophobicContact CG2-CG2 4.4Å
113	N	94.9	Very high	93.1	Very high	34 Å²	34	46.4 Å²	46.4	18%	0.182	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	3.1	-175.5	-68.3	-32.4	0	0	0	112.2	D111 Q115 G144 E146 L149	D111-N113 VanDerWaalsContact C-N 3.31Å; D111-N113 PolarHBondContact OD1-N 3.46Å; N113-Q115 PolarHBondContact O-N 2.87Å; N113-G144 PolarHBondContact ND2-O 3.23Å; N113-E146 PolarHBondContact OD1-N 3.34Å; N113-L149 HydrophobicContact CB-CD1 3.75Å
114	H	95.2	Very high	93.3	Very high	44 Å²	44	45 Å²	45	20%	0.204	23%	0.233	C	C	.	.			trans	-54	137.9	174.2	-176.2	73.3	0	0	0	111.2	G85 D111	G85-H114 PolarHBondContact O-CD2 3.31Å; G85-H114 PolarHBondContact O-NE2 3.07Å; D111-H114 HydrophobicContact CB-CB 4.14Å; D111-H114 WeakPolarHBondContact O-CB 3.48Å; D111-H114 PolarHBondContact OD1-N 2.85Å
115	Q	95.6	Very high	93.5	Very high	76 Å²	76	46.2 Å²	46.2	36%	0.355	24%	0.239	S	C	.	.			trans	-107.8	132.2	179.4	-72.7	-172	-58.9	0	0	110.1	N113 G119 N120 T121 R150	N113-Q115 PolarHBondContact O-N 2.87Å; Q115-G119 PolarHBondContact NE2-O 3.14Å; Q115-N120 WeakPolarHBondContact CA-O 3.44Å; Q115-T121 HydrophobicContact CG-CG2 3.78Å; Q115-R150 PolarHBondContact NE2-O 2.92Å
116	D	95.8	Very high	93.8	Very high	16 Å²	16	43.3 Å²	43.3	9%	0.086	23%	0.226	C	C	.	.			trans	-72	-179.3	172	62.6	18.3	0	0	0	112	N84 R86 M90 D118 G119 N120	N84-D116 WeakPolarHBondContact O-CB 3.16Å; R86-D116 HydrophobicContact CG-CB 3.78Å; M90-D116 HydrophobicContact CE-CB 3.49Å; M90-D116 VanDerWaalsContact CE-CB 3.49Å; M90-D116 HydrophobicContact SD-CB 4.49Å; D116-D118 PolarHBondContact O-N 3.48Å; D116-D118 VanDerWaalsContact O-N 3.14Å; D116-D118 WeakPolarHBondContact OD1-CA 3.3Å; D116-D118 WeakPolarHBondContact OD1-CB 3.35Å; D116-D118 PolarHBondContact OD1-N 2.98Å; D116-G119 WeakPolarHBondContact O-CA 3.47Å; D116-G119 PolarHBondContact O-N 2.79Å; D116-G119 PolarHBondContact OD1-N 3.3Å; D116-N120 PolarHBondContact N-O 2.88Å; D116-N120 WeakPolarHBondContact OD1-CB 3.32Å; D116-N120 PolarHBondContact OD1-N 3.17Å
117	N	95.6	Very high	94.3	Very high	116 Å²	116	38.3 Å²	38.3	62%	0.62	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-22.5	179.1	-67.3	-10.4	0	0	0	113.3	I83 N84 G119	I83-N117 PolarHBondContact O-ND2 3.48Å; N84-N117 WeakPolarHBondContact CA-ND2 3.33Å; N84-N117 WeakPolarHBondContact O-CB 3.34Å; N84-N117 PolarHBondContact O-N 3.06Å; N84-N117 PolarHBondContact O-ND2 2.88Å; N84-N117 PolarHBondContact O-OD1 3.41Å; N117-G119 VanDerWaalsContact C-N 3.32Å
118	D	94.2	Very high	94.6	Very high	116 Å²	116	41.5 Å²	41.5	62%	0.62	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.6	0.2	174.7	-67.7	-39.1	0	0	0	112.4	D116 N120 P152	D116-D118 PolarHBondContact O-N 3.48Å; D116-D118 VanDerWaalsContact O-N 3.14Å; D116-D118 WeakPolarHBondContact OD1-CA 3.3Å; D116-D118 WeakPolarHBondContact OD1-CB 3.35Å; D116-D118 PolarHBondContact OD1-N 2.98Å; D118-N120 VanDerWaalsContact C-N 3.3Å; D118-N120 VanDerWaalsContact CB-ND2 3.29Å; D118-N120 WeakPolarHBondContact CB-ND2 3.34Å; D118-N120 PolarHBondContact O-N 3.25Å; D118-P152 WeakPolarHBondContact O-CD 3.3Å
119	G	95	Very high	95.1	Very high	8 Å²	8	38 Å²	38	8%	0.082	20%	0.198	C	C	.	.			trans	71.4	17	-176.8	0	0	0	0	0	114.8	Q115 D116 N117	Q115-G119 PolarHBondContact NE2-O 3.14Å; D116-G119 WeakPolarHBondContact O-CA 3.47Å; D116-G119 PolarHBondContact O-N 2.79Å; D116-G119 PolarHBondContact OD1-N 3.3Å; N117-G119 VanDerWaalsContact C-N 3.32Å
120	N	96.4	Very high	95.4	Very high	18 Å²	18	34.3 Å²	34.3	10%	0.096	19%	0.188	C	C	.	.			trans	-80.5	142.8	174	-57.1	-65.7	0	0	0	110.6	M90 Q115 D116 D118 M124 I125 K160	M90-N120 WeakPolarHBondContact CE-O 3.38Å; Q115-N120 WeakPolarHBondContact CA-O 3.44Å; D116-N120 PolarHBondContact N-O 2.88Å; D116-N120 WeakPolarHBondContact OD1-CB 3.32Å; D116-N120 PolarHBondContact OD1-N 3.17Å; D118-N120 VanDerWaalsContact C-N 3.3Å; D118-N120 VanDerWaalsContact CB-ND2 3.29Å; D118-N120 WeakPolarHBondContact CB-ND2 3.34Å; D118-N120 PolarHBondContact O-N 3.25Å; N120-M124 HydrophobicContact CB-CB 4.32Å; N120-M124 HydrophobicContact CB-SD 4.42Å; N120-I125 HydrophobicContact CB-CD1 4.45Å; N120-I125 HydrophobicContact CB-CG1 4.04Å; N120-K160 WeakPolarHBondContact OD1-CE 3.3Å; N120-K160 PolarHBondContact OD1-NZ 3.25Å
121	T	96.9	Very high	95.8	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.018	20%	0.197	C	C	.	.			trans	-95.3	167.5	167.4	64.4	0	0	0	0	111.3	Q115 L123 M124 I125 L149	Q115-T121 HydrophobicContact CG-CG2 3.78Å; T121-L123 PolarHBondContact O-N 3.32Å; T121-M124 HydrophobicContact CG2-CE 4.44Å; T121-M124 WeakPolarHBondContact O-CB 3.49Å; T121-M124 PolarHBondContact O-N 2.95Å; T121-M124 VanDerWaalsContact O-N 3.08Å; T121-M124 WeakPolarHBondContact OG1-CG 3.29Å; T121-M124 PolarHBondContact OG1-N 2.9Å; T121-I125 WeakPolarHBondContact O-CG1 3.26Å; T121-I125 PolarHBondContact O-N 3.34Å; T121-L149 HydrophobicContact CG2-CB 4.18Å; T121-L149 HydrophobicContact CG2-CD1 3.77Å
122	A	96.3	Very high	96	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-52.8	-41.2	171.8	0	0	0	0	0	112.1	L89 M90 V93 I112 M124 I125 A126 I138	L89-A122 HydrophobicContact CD2-CB 4.29Å; L89-A122 HydrophobicContact CG-CB 4.31Å; M90-A122 HydrophobicContact CG-CB 3.88Å; V93-A122 WeakPolarHBondContact CG1-O 3.32Å; V93-A122 HydrophobicContact CG2-CB 4.34Å; I112-A122 HydrophobicContact CD1-CB 4.34Å; A122-M124 PolarHBondContact O-N 3.34Å; A122-I125 PolarHBondContact O-N 3.02Å; A122-A126 PolarHBondContact O-N 3.11Å; A122-I138 HydrophobicContact CB-CD1 4.5Å
123	L	97.2	Very high	96.1	Very high	5 Å²	5	37.8 Å²	37.8	3%	0.026	21%	0.207	C	C	.	.	H	α-helix	trans	-63.5	-42.1	177.6	-169.7	74.4	0	0	0	112.1	T121 A126 A127 L135 I138 L139 V145 T147 A157 L173	T121-L123 PolarHBondContact O-N 3.32Å; L123-A126 PolarHBondContact O-N 3.13Å; L123-A127 WeakPolarHBondContact O-CB 3.36Å; L123-A127 PolarHBondContact O-N 3.39Å; L123-L135 HydrophobicContact CD1-CD1 3.49Å; L123-L135 VanDerWaalsContact CD1-CD1 3.49Å; L123-L135 HydrophobicContact CD1-CG 4.36Å; L123-L135 HydrophobicContact CG-CD1 4.15Å; L123-I138 HydrophobicContact CD1-CG2 4.01Å; L123-L139 HydrophobicContact CD1-CD2 3.8Å; L123-L139 HydrophobicContact CD1-CG 3.93Å; L123-L139 HydrophobicContact CD2-CD2 4.31Å; L123-V145 HydrophobicContact CD1-CG1 4.44Å; L123-V145 HydrophobicContact CD2-CG1 4.05Å; L123-T147 HydrophobicContact CD2-CG2 4.14Å; L123-A157 HydrophobicContact CD2-CB 3.95Å; L123-A157 HydrophobicContact CG-CB 3.99Å; L123-L173 HydrophobicContact CD1-CD2 4.31Å; L123-L173 HydrophobicContact CD2-CD2 3.96Å; L123-L173 HydrophobicContact CG-CD2 4.24Å
124	M	97.6	Very high	96.2	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-62.6	-43.4	176.4	-73.2	178.8	-170.1	0	0	112.4	N120 T121 A122 A127 Q128 L149 D151 F155 A157 K160	N120-M124 HydrophobicContact CB-CB 4.32Å; N120-M124 HydrophobicContact CB-SD 4.42Å; T121-M124 HydrophobicContact CG2-CE 4.44Å; T121-M124 WeakPolarHBondContact O-CB 3.49Å; T121-M124 PolarHBondContact O-N 2.95Å; T121-M124 VanDerWaalsContact O-N 3.08Å; T121-M124 WeakPolarHBondContact OG1-CG 3.29Å; T121-M124 PolarHBondContact OG1-N 2.9Å; A122-M124 PolarHBondContact O-N 3.34Å; M124-A127 PolarHBondContact O-N 3.05Å; M124-Q128 WeakPolarHBondContact O-CB 3.3Å; M124-Q128 PolarHBondContact O-N 3.38Å; M124-L149 HydrophobicContact CE-CB 4.14Å; M124-L149 WeakPolarHBondContact CE-O 3.47Å; M124-D151 HydrophobicContact SD-CB 4.35Å; M124-F155 WeakPolarHBondContact CE-O 3.09Å; M124-A157 HydrophobicContact CG-CB 4.04Å; M124-K160 HydrophobicContact CB-CD 3.78Å; M124-K160 HydrophobicContact CG-CD 4.08Å; M124-K160 HydrophobicContact SD-CD 4.34Å
125	I	96.9	Very high	96.3	Very high	24 Å²	24	34.2 Å²	34.2	12%	0.123	19%	0.189	C	C	.	.	H	α-helix	trans	-63.2	-47	178.4	-63.2	168.7	0	0	0	110	M90 V93 N120 T121 A122 A127 Q128 A129	M90-I125 HydrophobicContact CB-CD1 4.2Å; M90-I125 HydrophobicContact CE-CD1 3.54Å; M90-I125 HydrophobicContact CG-CD1 4.4Å; V93-I125 HydrophobicContact CG1-CB 4.16Å; V93-I125 HydrophobicContact CG1-CG2 4.02Å; N120-I125 HydrophobicContact CB-CD1 4.45Å; N120-I125 HydrophobicContact CB-CG1 4.04Å; T121-I125 WeakPolarHBondContact O-CG1 3.26Å; T121-I125 PolarHBondContact O-N 3.34Å; A122-I125 PolarHBondContact O-N 3.02Å; I125-A127 VanDerWaalsContact C-N 3.34Å; I125-A127 PolarHBondContact O-N 2.7Å; I125-Q128 PolarHBondContact O-N 3.25Å; I125-A129 WeakPolarHBondContact O-CB 3.44Å; I125-A129 PolarHBondContact O-N 3.38Å
126	A	97.2	Very high	96.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-59.6	-44.4	177.1	0	0	0	0	0	112	V93 A122 L123 A129 G130 F131 I134 L135	V93-A126 HydrophobicContact CG1-CB 3.66Å; A122-A126 PolarHBondContact O-N 3.11Å; L123-A126 PolarHBondContact O-N 3.13Å; A126-A129 PolarHBondContact O-N 3.24Å; A126-G130 PolarHBondContact O-N 3.46Å; A126-F131 PolarHBondContact O-N 3.1Å; A126-I134 HydrophobicContact CB-CG2 4.21Å; A126-L135 HydrophobicContact CB-CB 4.3Å; A126-L135 HydrophobicContact CB-CD1 3.94Å
127	A	97.3	Very high	96.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.7	-41.6	-180	0	0	0	0	0	112.4	L123 M124 I125 L135 A157 A161 L173	L123-A127 WeakPolarHBondContact O-CB 3.36Å; L123-A127 PolarHBondContact O-N 3.39Å; M124-A127 PolarHBondContact O-N 3.05Å; I125-A127 VanDerWaalsContact C-N 3.34Å; I125-A127 PolarHBondContact O-N 2.7Å; A127-L135 HydrophobicContact CB-CD1 4.09Å; A127-A157 HydrophobicContact CB-CB 4.12Å; A127-A157 WeakPolarHBondContact CB-O 3.34Å; A127-A161 HydrophobicContact CB-CB 4.12Å; A127-L173 HydrophobicContact CB-CD1 4.04Å
128	Q	96.2	Very high	96.2	Very high	76 Å²	76	29.1 Å²	29.1	36%	0.355	16%	0.162	S	C	.	.	H	α-helix	trans	-68.4	-45.6	176.6	-173.5	174.1	-25.2	0	0	111.7	M124 I125 G130 K160 Q164	M124-Q128 WeakPolarHBondContact O-CB 3.3Å; M124-Q128 PolarHBondContact O-N 3.38Å; I125-Q128 PolarHBondContact O-N 3.25Å; Q128-G130 VanDerWaalsContact C-N 3.26Å; Q128-G130 PolarHBondContact O-N 3.47Å; Q128-K160 HydrophobicContact CB-CB 4.23Å; Q128-Q164 HydrophobicContact CG-CG 3.81Å; Q128-Q164 WeakPolarHBondContact O-CG 3.34Å
129	A	95.6	Very high	96.2	Very high	34 Å²	34	24 Å²	24	28%	0.281	13%	0.134	S	C	.	.	H	α-helix	trans	-67.2	-28.2	179.2	0	0	0	0	0	112.5	I125 A126 F131 R166	I125-A129 WeakPolarHBondContact O-CB 3.44Å; I125-A129 PolarHBondContact O-N 3.38Å; A126-A129 PolarHBondContact O-N 3.24Å; A129-F131 HydrophobicContact CB-CD1 4.4Å; A129-F131 HydrophobicContact CB-CD2 3.58Å; A129-F131 HydrophobicContact CB-CE1 4.38Å; A129-F131 HydrophobicContact CB-CE2 3.55Å; A129-F131 HydrophobicContact CB-CG 4.03Å; A129-F131 HydrophobicContact CB-CZ 3.98Å; A129-R166 PolarHBondContact O-NE 3.21Å; A129-R166 PolarHBondContact O-NH2 2.99Å; A129-R166 VanDerWaalsContact O-NH2 3.1Å
130	G	95.1	Very high	96.1	Very high	23 Å²	23	26 Å²	26	24%	0.237	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.4	21.3	-175.9	0	0	0	0	0	113.4	A126 Q128 I132	A126-G130 PolarHBondContact O-N 3.46Å; Q128-G130 VanDerWaalsContact C-N 3.26Å; Q128-G130 PolarHBondContact O-N 3.47Å; G130-I132 VanDerWaalsContact C-N 3.27Å; G130-I132 PolarHBondContact O-N 3.22Å
131	F	96.9	Very high	95.9	Very high	67 Å²	67	29.8 Å²	29.8	29%	0.294	16%	0.157	S	C	.	.			trans	-78.5	75.3	180	-62.8	-35.6	0	0	0	111.1	V93 A126 A129 T133 I134 L135	V93-F131 VanDerWaalsContact O-CD2 3.24Å; V93-F131 WeakPolarHBondContact O-CD2 3.37Å; V93-F131 WeakPolarHBondContact O-CE2 3.37Å; A126-F131 PolarHBondContact O-N 3.1Å; A129-F131 HydrophobicContact CB-CD1 4.4Å; A129-F131 HydrophobicContact CB-CD2 3.58Å; A129-F131 HydrophobicContact CB-CE1 4.38Å; A129-F131 HydrophobicContact CB-CE2 3.55Å; A129-F131 HydrophobicContact CB-CG 4.03Å; A129-F131 HydrophobicContact CB-CZ 3.98Å; F131-T133 VanDerWaalsContact C-N 3.26Å; F131-T133 PolarHBondContact O-N 2.63Å; F131-I134 HydrophobicContact CB-CB 3.97Å; F131-I134 HydrophobicContact CB-CD1 4.03Å; F131-I134 HydrophobicContact CB-CG1 4.22Å; F131-I134 HydrophobicContact CD2-CD1 4.11Å; F131-I134 HydrophobicContact CG-CD1 4.23Å; F131-I134 PolarHBondContact O-N 3.41Å; F131-L135 WeakPolarHBondContact O-CB 3.27Å; F131-L135 PolarHBondContact O-N 2.92Å
132	I	96.2	Very high	95.6	Very high	46 Å²	46	30.1 Å²	30.1	24%	0.236	16%	0.158	C	C	.	.	H	α-helix	trans	-57.5	-36.4	-175.9	-173.9	57.9	0	0	0	113.4	G130 L135 N136 D168 A172	G130-I132 VanDerWaalsContact C-N 3.27Å; G130-I132 PolarHBondContact O-N 3.22Å; I132-L135 HydrophobicContact CD1-CD2 4.25Å; I132-N136 VanDerWaalsContact O-CB 3.3Å; I132-N136 WeakPolarHBondContact O-CB 3.34Å; I132-N136 VanDerWaalsContact O-CG 3.31Å; I132-N136 PolarHBondContact O-N 3.46Å; I132-N136 PolarHBondContact O-ND2 2.83Å; I132-D168 HydrophobicContact CB-CB 4.34Å; I132-D168 HydrophobicContact CD1-CB 3.9Å; I132-D168 HydrophobicContact CG1-CB 3.9Å; I132-A172 HydrophobicContact CD1-CB 3.89Å
133	T	96.2	Very high	95.3	Very high	86 Å²	86	33.7 Å²	33.7	53%	0.528	18%	0.181	S	C	.	.	H	α-helix	trans	-65	-47.4	178.6	49.3	0	0	0	0	111.4	F131 Y137	F131-T133 VanDerWaalsContact C-N 3.26Å; F131-T133 PolarHBondContact O-N 2.63Å; T133-Y137 WeakPolarHBondContact O-CB 3.34Å; T133-Y137 PolarHBondContact O-N 3.35Å
134	I	96.8	Very high	94.9	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-65.2	-46	176.7	-66.5	-179.8	0	0	0	110.6	V93 V98 V101 A126 F131 N136 Y137 I138	V93-I134 HydrophobicContact CB-CG2 4.37Å; V93-I134 HydrophobicContact CG1-CG2 4.08Å; V93-I134 HydrophobicContact CG2-CG2 3.76Å; V98-I134 HydrophobicContact CG2-CD1 4.19Å; V98-I134 HydrophobicContact CG2-CG1 3.91Å; V101-I134 HydrophobicContact CG1-CG2 4.24Å; V101-I134 HydrophobicContact CG2-CD1 4.48Å; V101-I134 HydrophobicContact CG2-CG2 4.17Å; A126-I134 HydrophobicContact CB-CG2 4.21Å; F131-I134 HydrophobicContact CB-CB 3.97Å; F131-I134 HydrophobicContact CB-CD1 4.03Å; F131-I134 HydrophobicContact CB-CG1 4.22Å; F131-I134 HydrophobicContact CD2-CD1 4.11Å; F131-I134 HydrophobicContact CG-CD1 4.23Å; F131-I134 PolarHBondContact O-N 3.41Å; I134-N136 PolarHBondContact O-N 3.23Å; I134-Y137 WeakPolarHBondContact O-CB 3.46Å; I134-Y137 PolarHBondContact O-N 3.47Å; I134-Y137 VanDerWaalsContact O-N 3.13Å; I134-I138 HydrophobicContact CG2-CD1 3.86Å; I134-I138 HydrophobicContact CG2-CG1 4.49Å; I134-I138 WeakPolarHBondContact O-CG1 3.26Å; I134-I138 PolarHBondContact O-N 3.46Å
135	L	96.8	Very high	94.6	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58.1	-50.7	179	-171.9	83.4	0	0	0	111.4	L123 A126 A127 F131 I132 Y137 I138 L139 C169 A172 L173	L123-L135 HydrophobicContact CD1-CD1 3.49Å; L123-L135 VanDerWaalsContact CD1-CD1 3.49Å; L123-L135 HydrophobicContact CD1-CG 4.36Å; L123-L135 HydrophobicContact CG-CD1 4.15Å; A126-L135 HydrophobicContact CB-CB 4.3Å; A126-L135 HydrophobicContact CB-CD1 3.94Å; A127-L135 HydrophobicContact CB-CD1 4.09Å; F131-L135 WeakPolarHBondContact O-CB 3.27Å; F131-L135 PolarHBondContact O-N 2.92Å; I132-L135 HydrophobicContact CD1-CD2 4.25Å; L135-Y137 VanDerWaalsContact C-N 3.26Å; L135-Y137 PolarHBondContact O-N 3.29Å; L135-I138 PolarHBondContact O-N 3.03Å; L135-L139 HydrophobicContact CD2-CD1 4.47Å; L135-L139 HydrophobicContact CG-CD1 4.05Å; L135-L139 WeakPolarHBondContact O-CB 3.47Å; L135-L139 VanDerWaalsContact O-CG 3.31Å; L135-L139 WeakPolarHBondContact O-CG 3.46Å; L135-L139 PolarHBondContact O-N 2.88Å; L135-C169 HydrophobicContact CD2-CB 3.66Å; L135-A172 HydrophobicContact CD2-CB 4Å; L135-L173 HydrophobicContact CD1-CD2 4.37Å; L135-L173 HydrophobicContact CD2-CG 4.23Å
136	N	95.3	Very high	94.4	Very high	57 Å²	57	39.1 Å²	39.1	31%	0.305	22%	0.215	S	C	.	.	H	α-helix	trans	-62.3	-36.6	176.5	-77.2	-27	0	0	0	111.5	I132 I134 N140 A172	I132-N136 VanDerWaalsContact O-CB 3.3Å; I132-N136 WeakPolarHBondContact O-CB 3.34Å; I132-N136 VanDerWaalsContact O-CG 3.31Å; I132-N136 PolarHBondContact O-N 3.46Å; I132-N136 PolarHBondContact O-ND2 2.83Å; I134-N136 PolarHBondContact O-N 3.23Å; N136-N140 VanDerWaalsContact O-CB 3.31Å; N136-N140 WeakPolarHBondContact O-CB 3.45Å; N136-N140 PolarHBondContact O-N 3.07Å; N136-N140 VanDerWaalsContact O-N 3.08Å; N136-N140 PolarHBondContact O-ND2 2.96Å; N136-A172 WeakPolarHBondContact OD1-CB 3.36Å
137	Y	95.4	Very high	94.2	Very high	44 Å²	44	40.2 Å²	40.2	17%	0.173	22%	0.222	C	C	.	.	H	α-helix	trans	-65.6	-46.4	177.6	-164.9	-85.9	0	0	0	111.5	V101 T102 H105 T133 I134 L135 N140 Y141 Y142	V101-Y137 HydrophobicContact CG1-CD1 4.11Å; T102-Y137 HydrophobicContact CG2-CD1 4.36Å; T102-Y137 HydrophobicContact CG2-CD2 3.8Å; T102-Y137 HydrophobicContact CG2-CE1 4.12Å; T102-Y137 HydrophobicContact CG2-CE2 3.52Å; T102-Y137 HydrophobicContact CG2-CG 4.2Å; T102-Y137 PolarHBondContact O-OH 2.88Å; H105-Y137 HydrophobicContact CB-CE1 4.09Å; H105-Y137 PolarHBondContact CE1-OH 3.4Å; H105-Y137 PolarHBondContact ND1-OH 3.18Å; T133-Y137 WeakPolarHBondContact O-CB 3.34Å; T133-Y137 PolarHBondContact O-N 3.35Å; I134-Y137 WeakPolarHBondContact O-CB 3.46Å; I134-Y137 PolarHBondContact O-N 3.47Å; I134-Y137 VanDerWaalsContact O-N 3.13Å; L135-Y137 VanDerWaalsContact C-N 3.26Å; L135-Y137 PolarHBondContact O-N 3.29Å; Y137-N140 PolarHBondContact O-N 3.26Å; Y137-Y141 HydrophobicContact CD1-CD2 4.19Å; Y137-Y141 AromaticContact CD2-CD2 3.52Å; Y137-Y141 HydrophobicContact CD2-CD2 3.52Å; Y137-Y141 AromaticContact CD2-CE2 3.79Å; Y137-Y141 HydrophobicContact CD2-CE2 3.79Å; Y137-Y141 HydrophobicContact CD2-CG 4.44Å; Y137-Y141 HydrophobicContact CE1-CD2 4.14Å; Y137-Y141 HydrophobicContact CE1-CG 4.2Å; Y137-Y141 AromaticContact CE2-CD2 3.49Å; Y137-Y141 HydrophobicContact CE2-CD2 3.49Å; Y137-Y141 VanDerWaalsContact CE2-CD2 3.49Å; Y137-Y141 AromaticContact CE2-CE2 3.73Å; Y137-Y141 HydrophobicContact CE2-CE2 3.73Å; Y137-Y141 HydrophobicContact CE2-CG 4.05Å; Y137-Y141 AromaticContact CG-CD2 3.89Å; Y137-Y141 HydrophobicContact CG-CD2 3.89Å; Y137-Y141 AromaticContact CZ-CD2 3.82Å; Y137-Y141 AromaticContact CZ-CG 3.93Å; Y137-Y141 WeakPolarHBondContact O-CB 3.45Å; Y137-Y141 PolarHBondContact O-N 3.25Å; Y137-Y142 HydrophobicContact CD1-CD2 4.38Å; Y137-Y142 AromaticContact CD1-CE2 3.9Å; Y137-Y142 HydrophobicContact CD1-CE2 3.9Å; Y137-Y142 AromaticContact CE1-CE2 3.93Å; Y137-Y142 HydrophobicContact CE1-CE2 3.93Å
138	I	95	Very high	94	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-57	-53.1	175.4	-69.7	168.6	0	0	0	110.3	V93 V101 I112 A122 L123 I134 L135 N140 Y142 V145	V93-I138 HydrophobicContact CG2-CD1 3.92Å; V101-I138 HydrophobicContact CG1-CG1 4.28Å; I112-I138 HydrophobicContact CD1-CG1 4.48Å; I112-I138 HydrophobicContact CD1-CG2 3.85Å; I112-I138 HydrophobicContact CG1-CG2 4.23Å; A122-I138 HydrophobicContact CB-CD1 4.5Å; L123-I138 HydrophobicContact CD1-CG2 4.01Å; I134-I138 HydrophobicContact CG2-CD1 3.86Å; I134-I138 HydrophobicContact CG2-CG1 4.49Å; I134-I138 WeakPolarHBondContact O-CG1 3.26Å; I134-I138 PolarHBondContact O-N 3.46Å; L135-I138 PolarHBondContact O-N 3.03Å; I138-N140 PolarHBondContact O-N 2.97Å; I138-Y142 HydrophobicContact CB-CD2 4.47Å; I138-Y142 HydrophobicContact CG1-CD2 4.33Å; I138-Y142 HydrophobicContact CG1-CE2 4.38Å; I138-Y142 WeakPolarHBondContact O-CB 3.24Å; I138-Y142 PolarHBondContact O-N 3.5Å; I138-Y142 VanDerWaalsContact O-N 3.13Å; I138-V145 HydrophobicContact CG2-CG1 4.25Å; I138-V145 HydrophobicContact CG2-CG2 3.85Å
139	L	94	Very high	93.9	Very high	8 Å²	8	41.6 Å²	41.6	4%	0.042	23%	0.229	C	C	.	.	H	α-helix	trans	-63.7	-25.4	-176.9	-70.1	170.9	0	0	0	114.3	L123 L135 V145 T147 A172 L173 H176	L123-L139 HydrophobicContact CD1-CD2 3.8Å; L123-L139 HydrophobicContact CD1-CG 3.93Å; L123-L139 HydrophobicContact CD2-CD2 4.31Å; L135-L139 HydrophobicContact CD2-CD1 4.47Å; L135-L139 HydrophobicContact CG-CD1 4.05Å; L135-L139 WeakPolarHBondContact O-CB 3.47Å; L135-L139 VanDerWaalsContact O-CG 3.31Å; L135-L139 WeakPolarHBondContact O-CG 3.46Å; L135-L139 PolarHBondContact O-N 2.88Å; L139-V145 HydrophobicContact CD2-CG1 4.2Å; L139-T147 HydrophobicContact CD2-CG2 4.17Å; L139-A172 HydrophobicContact CD1-CB 4.45Å; L139-L173 HydrophobicContact CD1-CD2 4.23Å; L139-L173 HydrophobicContact CD2-CD2 4.47Å; L139-H176 HydrophobicContact CD1-CB 4.22Å; L139-H176 HydrophobicContact CD2-CB 4.11Å; L139-H176 PolarHBondContact O-CE1 3.08Å
140	N	92.4	Very high	93.9	Very high	51 Å²	51	44.7 Å²	44.7	27%	0.273	23%	0.234	S	C	.	.	H	α-helix	trans	-100.5	-31.1	-177.6	-72.1	-62.4	0	0	0	113.9	N136 Y137 I138 H176 A305 V306	N136-N140 VanDerWaalsContact O-CB 3.31Å; N136-N140 WeakPolarHBondContact O-CB 3.45Å; N136-N140 PolarHBondContact O-N 3.07Å; N136-N140 VanDerWaalsContact O-N 3.08Å; N136-N140 PolarHBondContact O-ND2 2.96Å; Y137-N140 PolarHBondContact O-N 3.26Å; I138-N140 PolarHBondContact O-N 2.97Å; N140-H176 PolarHBondContact OD1-CE1 2.96Å; N140-A305 CarbonylContact O-C 3.52Å; N140-A305 WeakPolarHBondContact O-CA 3.19Å; N140-V306 WeakPolarHBondContact O-CG2 3.32Å; N140-V306 PolarHBondContact O-N 2.84Å
141	Y	92.3	Very high	93.9	Very high	97 Å²	97	44 Å²	44	38%	0.38	23%	0.225	S	C	.	.	H	α-helix	trans	-112	-21.8	-171.1	-68.6	-81.5	0	0	0	114.3	Y137 V306 P307	Y137-Y141 HydrophobicContact CD1-CD2 4.19Å; Y137-Y141 AromaticContact CD2-CD2 3.52Å; Y137-Y141 HydrophobicContact CD2-CD2 3.52Å; Y137-Y141 AromaticContact CD2-CE2 3.79Å; Y137-Y141 HydrophobicContact CD2-CE2 3.79Å; Y137-Y141 HydrophobicContact CD2-CG 4.44Å; Y137-Y141 HydrophobicContact CE1-CD2 4.14Å; Y137-Y141 HydrophobicContact CE1-CG 4.2Å; Y137-Y141 AromaticContact CE2-CD2 3.49Å; Y137-Y141 HydrophobicContact CE2-CD2 3.49Å; Y137-Y141 VanDerWaalsContact CE2-CD2 3.49Å; Y137-Y141 AromaticContact CE2-CE2 3.73Å; Y137-Y141 HydrophobicContact CE2-CE2 3.73Å; Y137-Y141 HydrophobicContact CE2-CG 4.05Å; Y137-Y141 AromaticContact CG-CD2 3.89Å; Y137-Y141 HydrophobicContact CG-CD2 3.89Å; Y137-Y141 AromaticContact CZ-CD2 3.82Å; Y137-Y141 AromaticContact CZ-CG 3.93Å; Y137-Y141 WeakPolarHBondContact O-CB 3.45Å; Y137-Y141 PolarHBondContact O-N 3.25Å; Y141-V306 HydrophobicContact CD1-CB 4.33Å; Y141-V306 HydrophobicContact CD1-CG2 4.44Å; Y141-V306 HydrophobicContact CE1-CB 4.44Å; Y141-V306 HydrophobicContact CE1-CG2 4.25Å; Y141-P307 WeakPolarHBondContact O-CG 3.46Å
142	Y	91.9	Very high	93.8	Very high	11 Å²	11	45.7 Å²	45.7	4%	0.043	24%	0.242	C	C	.	.	S	Bend	trans	-89.3	123	177.2	-73.7	-106.2	0	0	0	109.6	L89 V101 L104 H105 I112 Y137 I138 V145 A305	L89-Y142 WeakPolarHBondContact CD1-OH 3.3Å; L89-Y142 HydrophobicContact CD2-CD1 4.47Å; L89-Y142 HydrophobicContact CD2-CE1 3.83Å; V101-Y142 HydrophobicContact CG1-CE2 4.27Å; V101-Y142 PolarHBondContact O-OH 3.33Å; L104-Y142 WeakPolarHBondContact CB-OH 3.39Å; H105-Y142 HydrophobicContact CB-CD2 4.14Å; H105-Y142 HydrophobicContact CB-CE1 4.19Å; H105-Y142 HydrophobicContact CB-CE2 3.64Å; H105-Y142 PolarHBondContact N-OH 2.86Å; I112-Y142 HydrophobicContact CB-CD1 4.3Å; I112-Y142 HydrophobicContact CD1-CD1 3.77Å; I112-Y142 HydrophobicContact CD1-CE1 4.21Å; I112-Y142 HydrophobicContact CD1-CG 4.06Å; I112-Y142 HydrophobicContact CG1-CD1 4.11Å; I112-Y142 HydrophobicContact CG1-CG 4.32Å; Y137-Y142 HydrophobicContact CD1-CD2 4.38Å; Y137-Y142 AromaticContact CD1-CE2 3.9Å; Y137-Y142 HydrophobicContact CD1-CE2 3.9Å; Y137-Y142 AromaticContact CE1-CE2 3.93Å; Y137-Y142 HydrophobicContact CE1-CE2 3.93Å; I138-Y142 HydrophobicContact CB-CD2 4.47Å; I138-Y142 HydrophobicContact CG1-CD2 4.33Å; I138-Y142 HydrophobicContact CG1-CE2 4.38Å; I138-Y142 WeakPolarHBondContact O-CB 3.24Å; I138-Y142 PolarHBondContact O-N 3.5Å; I138-Y142 VanDerWaalsContact O-N 3.13Å; Y142-V145 WeakPolarHBondContact O-CG2 3.35Å; Y142-A305 WeakPolarHBondContact O-CB 3.39Å
143	P	89.5	Confident	93.6	Very high	74 Å²	74	49.3 Å²	49.3	48%	0.481	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	150.7	175.7	30.5	-33.6	0	0	0	110.9	V145 E308	P143-V145 VanDerWaalsContact C-N 3.3Å; P143-V145 PolarHBondContact O-N 2.88Å; P143-E308 HydrophobicContact CB-CG 4.12Å
144	G	88.1	Confident	93.5	Very high	31 Å²	31	45.2 Å²	45.2	32%	0.32	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	71	14.7	172.1	0	0	0	0	0	116.4	N113 E146 E308	N113-G144 PolarHBondContact ND2-O 3.23Å; G144-E146 PolarHBondContact O-N 2.84Å; G144-E308 PolarHBondContact N-OE1 3.07Å
145	V	92.6	Very high	93.5	Very high	17 Å²	17	45.2 Å²	45.2	10%	0.103	23%	0.228	C	C	.	.			trans	-59.9	125	176.2	176.6	0	0	0	0	110.7	I112 L123 I138 L139 Y142 P143	I112-V145 HydrophobicContact CG1-CG2 3.81Å; I112-V145 HydrophobicContact CG2-CG2 4.4Å; L123-V145 HydrophobicContact CD1-CG1 4.44Å; L123-V145 HydrophobicContact CD2-CG1 4.05Å; I138-V145 HydrophobicContact CG2-CG1 4.25Å; I138-V145 HydrophobicContact CG2-CG2 3.85Å; L139-V145 HydrophobicContact CD2-CG1 4.2Å; Y142-V145 WeakPolarHBondContact O-CG2 3.35Å; P143-V145 VanDerWaalsContact C-N 3.3Å; P143-V145 PolarHBondContact O-N 2.88Å
146	E	92.2	Very high	93.4	Very high	97 Å²	97	45.3 Å²	45.3	45%	0.453	23%	0.228	S	C	.	.			trans	-99.5	115.9	175.8	-68.4	-174.5	-174.5	0	0	111.3	N113 G144 L149	N113-E146 PolarHBondContact OD1-N 3.34Å; G144-E146 PolarHBondContact O-N 2.84Å; E146-L149 HydrophobicContact CB-CD1 3.82Å; E146-L149 HydrophobicContact CB-CG 3.8Å; E146-L149 WeakPolarHBondContact OE2-CD2 3.23Å
147	T	92.6	Very high	93.5	Very high	24 Å²	24	42.7 Å²	42.7	15%	0.147	21%	0.214	C	C	.	.	S	Bend	trans	-80	-21.3	179.7	56.4	0	0	0	0	113.5	L123 L139	L123-T147 HydrophobicContact CD2-CG2 4.14Å; L139-T147 HydrophobicContact CD2-CG2 4.17Å
148	E	93.3	Very high	93.5	Very high	66 Å²	66	40.7 Å²	40.7	31%	0.308	21%	0.207	S	C	.	.	S	Bend	trans	-97	1.9	-170.6	-57.6	-47.3	123.8	0	0	114.2	R150 A178 D179	E148-R150 WeakPolarHBondContact O-CG 3.29Å; E148-A178 VanDerWaalsContact OE1-CA 3.25Å; E148-A178 WeakPolarHBondContact OE1-CA 3.4Å; E148-D179 PolarHBondContact OE1-N 2.95Å; E148-D179 VanDerWaalsContact OE2-CB 3.3Å; E148-D179 WeakPolarHBondContact OE2-CB 3.33Å
149	L	94.9	Very high	93.5	Very high	38 Å²	38	40.7 Å²	40.7	20%	0.199	21%	0.207	C	C	.	.			trans	-57.5	146.8	171	-72.1	172	0	0	0	109.8	N113 T121 M124 E146	N113-L149 HydrophobicContact CB-CD1 3.75Å; T121-L149 HydrophobicContact CG2-CB 4.18Å; T121-L149 HydrophobicContact CG2-CD1 3.77Å; M124-L149 HydrophobicContact CE-CB 4.14Å; M124-L149 WeakPolarHBondContact CE-O 3.47Å; E146-L149 HydrophobicContact CB-CD1 3.82Å; E146-L149 HydrophobicContact CB-CG 3.8Å; E146-L149 WeakPolarHBondContact OE2-CD2 3.23Å
150	R	94.8	Very high	93.6	Very high	99 Å²	99	41 Å²	41	37%	0.374	21%	0.208	S	C	.	.			trans	-126.6	139.4	-174.5	-62.2	-175.2	-173.5	-171	-0.6	110.4	Q115 E148 T156	Q115-R150 PolarHBondContact NE2-O 2.92Å; E148-R150 WeakPolarHBondContact O-CG 3.29Å; R150-T156 HydrophobicContact CG-CG2 3.9Å
151	D	94.7	Very high	93.8	Very high	10 Å²	10	38.6 Å²	38.6	5%	0.053	20%	0.195	C	C	.	.			trans	-71.2	173.7	166.6	78.6	1.3	0	0	0	110.5	M124 R153 G154 F155 K160	M124-D151 HydrophobicContact SD-CB 4.35Å; D151-R153 PolarHBondContact O-N 3.41Å; D151-R153 WeakPolarHBondContact OD1-CA 3Å; D151-R153 WeakPolarHBondContact OD1-CB 3.5Å; D151-R153 PolarHBondContact OD1-N 3.11Å; D151-G154 WeakPolarHBondContact O-CA 3.41Å; D151-G154 PolarHBondContact O-N 3.25Å; D151-G154 PolarHBondContact OD1-N 2.98Å; D151-F155 PolarHBondContact N-O 2.89Å; D151-F155 VanDerWaalsContact N-O 3.11Å; D151-F155 WeakPolarHBondContact OD1-CB 3.42Å; D151-F155 PolarHBondContact OD1-N 3.01Å; D151-K160 VanDerWaalsContact OD2-CE 3.26Å; D151-K160 WeakPolarHBondContact OD2-CE 3.41Å; D151-K160 IonicContact OD2-NZ 3.64Å; D151-K160 PolarHBondContact OD2-NZ 3.31Å
152	P	94.8	Very high	94	Very high	101 Å²	101	34 Å²	34	66%	0.656	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-16.8	-179.6	-24.5	36.2	0	0	0	113.8	D118	D118-P152 WeakPolarHBondContact O-CD 3.3Å
153	R	92.8	Very high	94.1	Very high	123 Å²	123	35.2 Å²	35.2	46%	0.464	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-6	175.4	-58.6	173.1	58.8	179.8	-0.5	112.1	D151 F155 L185 V186	D151-R153 PolarHBondContact O-N 3.41Å; D151-R153 WeakPolarHBondContact OD1-CA 3Å; D151-R153 WeakPolarHBondContact OD1-CB 3.5Å; D151-R153 PolarHBondContact OD1-N 3.11Å; R153-F155 HydrophobicContact CB-CD2 4.4Å; R153-F155 HydrophobicContact CB-CG 4.45Å; R153-L185 PolarHBondContact O-N 3.38Å; R153-V186 HydrophobicContact CB-CG2 3.97Å; R153-V186 HydrophobicContact CG-CG2 4.35Å
154	G	94	Very high	94.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.175	C	C	.	.			trans	86.1	9.7	-175.7	0	0	0	0	0	114.4	D151	D151-G154 WeakPolarHBondContact O-CA 3.41Å; D151-G154 PolarHBondContact O-N 3.25Å; D151-G154 PolarHBondContact OD1-N 2.98Å
155	F	95.3	Very high	94.7	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.009	17%	0.169	C	C	.	.			trans	-79.7	125.1	179.9	-62.8	-21.5	0	0	0	111.2	M124 D151 R153 I159 K160 D184 W194	M124-F155 WeakPolarHBondContact CE-O 3.09Å; D151-F155 PolarHBondContact N-O 2.89Å; D151-F155 VanDerWaalsContact N-O 3.11Å; D151-F155 WeakPolarHBondContact OD1-CB 3.42Å; D151-F155 PolarHBondContact OD1-N 3.01Å; R153-F155 HydrophobicContact CB-CD2 4.4Å; R153-F155 HydrophobicContact CB-CG 4.45Å; F155-I159 HydrophobicContact CB-CB 4.41Å; F155-I159 HydrophobicContact CB-CG2 4.27Å; F155-I159 HydrophobicContact CD1-CG2 3.64Å; F155-I159 HydrophobicContact CE1-CG2 4.08Å; F155-I159 HydrophobicContact CG-CG2 4.02Å; F155-K160 HydrophobicContact CB-CG 4.08Å; F155-D184 HydrophobicContact CD1-CB 3.5Å; F155-D184 HydrophobicContact CE1-CB 3.36Å; F155-W194 AromaticContact CE1-CE2 3.88Å; F155-W194 AromaticContact CE1-CZ2 3.86Å; F155-W194 HydrophobicContact CE1-CZ2 3.86Å; F155-W194 AromaticContact CE1-NE1 3.79Å; F155-W194 HydrophobicContact CZ-CH2 4.21Å; F155-W194 AromaticContact CZ-CZ2 3.7Å; F155-W194 HydrophobicContact CZ-CZ2 3.7Å
156	T	95.9	Very high	94.9	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.006	18%	0.183	C	C	.	.			trans	-82.1	168.6	166.9	61.8	0	0	0	0	110.8	R150 L158 I159 K160 A182	R150-T156 HydrophobicContact CG-CG2 3.9Å; T156-L158 PolarHBondContact O-N 3.1Å; T156-I159 PolarHBondContact O-N 2.95Å; T156-I159 PolarHBondContact OG1-N 2.87Å; T156-K160 PolarHBondContact O-N 2.85Å; T156-A182 HydrophobicContact CG2-CB 4.02Å
157	A	96.4	Very high	95	Very high	2 Å²	2	37 Å²	37	2%	0.017	18%	0.177	C	C	.	.	H	α-helix	trans	-55.2	-36.4	173.2	0	0	0	0	0	111.9	L123 M124 A127 K160 A161 L173	L123-A157 HydrophobicContact CD2-CB 3.95Å; L123-A157 HydrophobicContact CG-CB 3.99Å; M124-A157 HydrophobicContact CG-CB 4.04Å; A127-A157 HydrophobicContact CB-CB 4.12Å; A127-A157 WeakPolarHBondContact CB-O 3.34Å; A157-K160 PolarHBondContact O-N 3.34Å; A157-A161 PolarHBondContact O-N 3.05Å; A157-L173 HydrophobicContact CB-CD1 4.13Å; A157-L173 HydrophobicContact CB-CD2 4.24Å
158	L	96.3	Very high	95.2	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-65.7	-45.6	178.1	-176.4	65.6	0	0	0	112.2	T156 K160 A161 G162 V170 L173 L174 A178 D179 L191	T156-L158 PolarHBondContact O-N 3.1Å; L158-K160 VanDerWaalsContact C-N 3.34Å; L158-K160 PolarHBondContact O-N 3.43Å; L158-A161 PolarHBondContact O-N 3.11Å; L158-G162 PolarHBondContact O-N 2.88Å; L158-V170 HydrophobicContact CD1-CB 4.4Å; L158-V170 HydrophobicContact CD1-CG1 4.04Å; L158-V170 HydrophobicContact CD1-CG2 4.44Å; L158-L173 HydrophobicContact CB-CD1 4.38Å; L158-L173 HydrophobicContact CD1-CB 3.94Å; L158-L173 HydrophobicContact CD1-CD1 4.39Å; L158-L174 HydrophobicContact CD1-CD2 4.19Å; L158-L174 HydrophobicContact CD1-CG 3.99Å; L158-L174 HydrophobicContact CD2-CD2 3.81Å; L158-A178 HydrophobicContact CB-CB 4.3Å; L158-A178 HydrophobicContact CD2-CB 4.16Å; L158-D179 WeakPolarHBondContact CD2-O 3.41Å; L158-L191 HydrophobicContact CD1-CD2 4.08Å; L158-L191 HydrophobicContact CD2-CD2 3.86Å; L158-L191 HydrophobicContact CG-CD1 4.29Å; L158-L191 HydrophobicContact CG-CD2 3.78Å; L158-L191 WeakPolarHBondContact O-CD1 3.37Å
159	I	95.8	Very high	95.3	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-62.2	-42.7	177	-64.7	172.5	0	0	0	110.3	F155 T156 G162 L163 A182 W194	F155-I159 HydrophobicContact CB-CB 4.41Å; F155-I159 HydrophobicContact CB-CG2 4.27Å; F155-I159 HydrophobicContact CD1-CG2 3.64Å; F155-I159 HydrophobicContact CE1-CG2 4.08Å; F155-I159 HydrophobicContact CG-CG2 4.02Å; T156-I159 PolarHBondContact O-N 2.95Å; T156-I159 PolarHBondContact OG1-N 2.87Å; I159-G162 PolarHBondContact O-N 3.27Å; I159-L163 WeakPolarHBondContact O-CB 3.5Å; I159-L163 PolarHBondContact O-N 3.21Å; I159-A182 HydrophobicContact CD1-CB 4.19Å; I159-W194 HydrophobicContact CG2-CG 4.48Å
160	K	95.9	Very high	95.3	Very high	14 Å²	14	35 Å²	35	6%	0.061	17%	0.168	C	C	.	.	H	α-helix	trans	-63.1	-42.1	177.4	-71.6	178.1	-171.9	-85.7	0	112.7	N120 M124 Q128 D151 F155 T156 A157 L158 L163 Q164	N120-K160 WeakPolarHBondContact OD1-CE 3.3Å; N120-K160 PolarHBondContact OD1-NZ 3.25Å; M124-K160 HydrophobicContact CB-CD 3.78Å; M124-K160 HydrophobicContact CG-CD 4.08Å; M124-K160 HydrophobicContact SD-CD 4.34Å; Q128-K160 HydrophobicContact CB-CB 4.23Å; D151-K160 VanDerWaalsContact OD2-CE 3.26Å; D151-K160 WeakPolarHBondContact OD2-CE 3.41Å; D151-K160 IonicContact OD2-NZ 3.64Å; D151-K160 PolarHBondContact OD2-NZ 3.31Å; F155-K160 HydrophobicContact CB-CG 4.08Å; T156-K160 PolarHBondContact O-N 2.85Å; A157-K160 PolarHBondContact O-N 3.34Å; L158-K160 VanDerWaalsContact C-N 3.34Å; L158-K160 PolarHBondContact O-N 3.43Å; K160-L163 PolarHBondContact O-N 3.38Å; K160-Q164 PolarHBondContact O-N 3.11Å
161	A	96.6	Very high	95.3	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61.9	-44.1	174.1	0	0	0	0	0	112	A127 A157 L158 Q164 G165 R166 C169 V170 L173	A127-A161 HydrophobicContact CB-CB 4.12Å; A157-A161 PolarHBondContact O-N 3.05Å; L158-A161 PolarHBondContact O-N 3.11Å; A161-Q164 PolarHBondContact O-N 2.89Å; A161-G165 PolarHBondContact O-N 3.1Å; A161-R166 HydrophobicContact CB-CB 4.36Å; A161-R166 PolarHBondContact O-N 3.29Å; A161-C169 HydrophobicContact CB-CB 4.03Å; A161-V170 HydrophobicContact CB-CG2 3.65Å; A161-L173 HydrophobicContact CB-CD1 4.23Å
162	G	95.5	Very high	95.3	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64.6	-41.9	177.6	0	0	0	0	0	113.3	L158 I159 Q164 G165	L158-G162 PolarHBondContact O-N 2.88Å; I159-G162 PolarHBondContact O-N 3.27Å; G162-Q164 VanDerWaalsContact C-N 3.26Å; G162-Q164 PolarHBondContact O-N 2.86Å; G162-G165 PolarHBondContact O-N 3.35Å
163	L	94.4	Very high	95.3	Very high	38 Å²	38	26.3 Å²	26.3	20%	0.199	13%	0.125	C	C	.	.	H	α-helix	trans	-56.4	-42.8	176.3	-171.6	75.5	0	0	0	111.3	I159 K160 G165 W194 T198	I159-L163 WeakPolarHBondContact O-CB 3.5Å; I159-L163 PolarHBondContact O-N 3.21Å; K160-L163 PolarHBondContact O-N 3.38Å; L163-G165 VanDerWaalsContact C-N 3.35Å; L163-W194 HydrophobicContact CD1-CB 4.41Å; L163-W194 HydrophobicContact CD1-CD2 3.94Å; L163-W194 HydrophobicContact CD1-CE3 3.33Å; L163-W194 HydrophobicContact CD1-CG 4.42Å; L163-W194 HydrophobicContact CD1-CZ3 3.85Å; L163-T198 HydrophobicContact CD1-CG2 3.7Å; L163-T198 HydrophobicContact CG-CG2 4.39Å
164	Q	95.3	Very high	95.3	Very high	63 Å²	63	20.6 Å²	20.6	29%	0.294	10%	0.103	S	C	.	.	H	α-helix	trans	-84.8	-5.1	179.6	-62.3	-59.7	-12.3	0	0	114.2	Q128 K160 A161 G162 R166	Q128-Q164 HydrophobicContact CG-CG 3.81Å; Q128-Q164 WeakPolarHBondContact O-CG 3.34Å; K160-Q164 PolarHBondContact O-N 3.11Å; A161-Q164 PolarHBondContact O-N 2.89Å; G162-Q164 VanDerWaalsContact C-N 3.26Å; G162-Q164 PolarHBondContact O-N 2.86Å; Q164-R166 HydrophobicContact CB-CG 3.91Å
165	G	94.6	Very high	95.1	Very high	18 Å²	18	22.4 Å²	22.4	19%	0.186	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.1	27.7	-179	0	0	0	0	0	114.3	A161 G162 L163 E167 T203	A161-G165 PolarHBondContact O-N 3.1Å; G162-G165 PolarHBondContact O-N 3.35Å; L163-G165 VanDerWaalsContact C-N 3.35Å; G165-E167 VanDerWaalsContact C-N 3.34Å; G165-E167 PolarHBondContact O-N 3.35Å; G165-T203 WeakPolarHBondContact CA-OG1 3.25Å; G165-T203 PolarHBondContact O-OG1 2.61Å
166	R	96.3	Very high	94.8	Very high	107 Å²	107	23 Å²	23	40%	0.404	12%	0.115	S	C	.	.			trans	-81.5	79.2	-179.7	-54.9	-54.1	-169.7	-175.6	2.7	110.1	A129 A161 Q164 D168 C169 V170	A129-R166 PolarHBondContact O-NE 3.21Å; A129-R166 PolarHBondContact O-NH2 2.99Å; A129-R166 VanDerWaalsContact O-NH2 3.1Å; A161-R166 HydrophobicContact CB-CB 4.36Å; A161-R166 PolarHBondContact O-N 3.29Å; Q164-R166 HydrophobicContact CB-CG 3.91Å; R166-D168 VanDerWaalsContact C-N 3.34Å; R166-D168 PolarHBondContact O-N 3.11Å; R166-C169 HydrophobicContact CB-CB 3.83Å; R166-C169 PolarHBondContact O-N 3.29Å; R166-C169 VanDerWaalsContact O-N 3.13Å; R166-V170 WeakPolarHBondContact O-CG2 3.23Å; R166-V170 PolarHBondContact O-N 3.01Å
167	E	95.2	Very high	94.5	Very high	69 Å²	69	23.7 Å²	23.7	32%	0.322	12%	0.123	S	C	.	.	H	α-helix	trans	-56.5	-42.5	-172.9	60.9	173.6	-164.6	0	0	114	G165 C169 V170 T171	G165-E167 VanDerWaalsContact C-N 3.34Å; G165-E167 PolarHBondContact O-N 3.35Å; E167-C169 PolarHBondContact O-N 2.83Å; E167-V170 PolarHBondContact O-N 3.37Å; E167-T171 WeakPolarHBondContact O-CG2 3.48Å; E167-T171 PolarHBondContact O-N 3.27Å
168	D	95.4	Very high	94.4	Very high	84 Å²	84	23.7 Å²	23.7	45%	0.449	12%	0.123	S	C	.	.	H	α-helix	trans	-64.5	-42	178.7	-67	-36.2	0	0	0	111.5	I132 R166 T171 A172	I132-D168 HydrophobicContact CB-CB 4.34Å; I132-D168 HydrophobicContact CD1-CB 3.9Å; I132-D168 HydrophobicContact CG1-CB 3.9Å; R166-D168 VanDerWaalsContact C-N 3.34Å; R166-D168 PolarHBondContact O-N 3.11Å; D168-T171 PolarHBondContact O-N 3.29Å; D168-T171 PolarHBondContact O-OG1 3.17Å; D168-A172 PolarHBondContact O-N 3.41Å
169	C	96.6	Very high	94.1	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.014	14%	0.139	C	C	.	.	H	α-helix	trans	-65.9	-41.4	178	-65.5	0	0	0	0	111.2	L135 A161 R166 E167 T171 A172 L173	L135-C169 HydrophobicContact CD2-CB 3.66Å; A161-C169 HydrophobicContact CB-CB 4.03Å; R166-C169 HydrophobicContact CB-CB 3.83Å; R166-C169 PolarHBondContact O-N 3.29Å; R166-C169 VanDerWaalsContact O-N 3.13Å; E167-C169 PolarHBondContact O-N 2.83Å; C169-T171 VanDerWaalsContact C-N 3.3Å; C169-T171 PolarHBondContact O-N 2.98Å; C169-A172 PolarHBondContact O-N 3.37Å; C169-L173 WeakPolarHBondContact O-CB 3.42Å; C169-L173 VanDerWaalsContact O-CG 3.29Å; C169-L173 WeakPolarHBondContact O-CG 3.12Å; C169-L173 PolarHBondContact O-N 2.99Å
170	V	95.6	Very high	93.9	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-58.3	-44.6	172.4	169.1	0	0	0	0	110.5	L158 A161 R166 E167 L174 T203 I207	L158-V170 HydrophobicContact CD1-CB 4.4Å; L158-V170 HydrophobicContact CD1-CG1 4.04Å; L158-V170 HydrophobicContact CD1-CG2 4.44Å; A161-V170 HydrophobicContact CB-CG2 3.65Å; R166-V170 WeakPolarHBondContact O-CG2 3.23Å; R166-V170 PolarHBondContact O-N 3.01Å; E167-V170 PolarHBondContact O-N 3.37Å; V170-L174 HydrophobicContact CG1-CD1 3.84Å; V170-L174 HydrophobicContact CG1-CG 4.44Å; V170-L174 WeakPolarHBondContact O-CB 3.4Å; V170-L174 VanDerWaalsContact O-CG 3.26Å; V170-L174 WeakPolarHBondContact O-CG 3.38Å; V170-L174 PolarHBondContact O-N 2.94Å; V170-T203 HydrophobicContact CB-CG2 4.13Å; V170-T203 HydrophobicContact CG1-CG2 4.17Å; V170-T203 HydrophobicContact CG2-CG2 3.75Å; V170-I207 HydrophobicContact CG1-CD1 3.97Å; V170-I207 HydrophobicContact CG1-CG1 3.79Å
171	T	93.8	Very high	93.6	Very high	19 Å²	19	34.2 Å²	34.2	12%	0.117	17%	0.174	C	C	.	.	H	α-helix	trans	-65.1	-44.3	179.2	69.2	0	0	0	0	112.2	E167 D168 C169 L174 M175 R206 L210	E167-T171 WeakPolarHBondContact O-CG2 3.48Å; E167-T171 PolarHBondContact O-N 3.27Å; D168-T171 PolarHBondContact O-N 3.29Å; D168-T171 PolarHBondContact O-OG1 3.17Å; C169-T171 VanDerWaalsContact C-N 3.3Å; C169-T171 PolarHBondContact O-N 2.98Å; T171-L174 PolarHBondContact O-N 3.22Å; T171-M175 WeakPolarHBondContact O-CB 3.26Å; T171-M175 WeakPolarHBondContact O-CG 3.3Å; T171-M175 PolarHBondContact O-N 3.36Å; T171-R206 HydrophobicContact CG2-CG 3.31Å; T171-R206 VanDerWaalsContact CG2-NE 3.27Å; T171-L210 HydrophobicContact CG2-CD1 3.68Å
172	A	94.1	Very high	93.3	Very high	8 Å²	8	34.3 Å²	34.3	7%	0.066	18%	0.175	C	C	.	.	H	α-helix	trans	-61.5	-46.2	178.7	0	0	0	0	0	111.5	I132 L135 N136 L139 D168 C169 M175 H176	I132-A172 HydrophobicContact CD1-CB 3.89Å; L135-A172 HydrophobicContact CD2-CB 4Å; N136-A172 WeakPolarHBondContact OD1-CB 3.36Å; L139-A172 HydrophobicContact CD1-CB 4.45Å; D168-A172 PolarHBondContact O-N 3.41Å; C169-A172 PolarHBondContact O-N 3.37Å; A172-M175 PolarHBondContact O-N 3.05Å; A172-H176 PolarHBondContact O-CD2 3.34Å; A172-H176 VanDerWaalsContact O-CD2 3.29Å; A172-H176 PolarHBondContact O-N 2.99Å
173	L	94.8	Very high	93.2	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.2	-45.4	178.2	-71.9	166.7	0	0	0	112.1	L123 A127 L135 L139 A157 L158 A161 C169 M175 H176 G177 A178	L123-L173 HydrophobicContact CD1-CD2 4.31Å; L123-L173 HydrophobicContact CD2-CD2 3.96Å; L123-L173 HydrophobicContact CG-CD2 4.24Å; A127-L173 HydrophobicContact CB-CD1 4.04Å; L135-L173 HydrophobicContact CD1-CD2 4.37Å; L135-L173 HydrophobicContact CD2-CG 4.23Å; L139-L173 HydrophobicContact CD1-CD2 4.23Å; L139-L173 HydrophobicContact CD2-CD2 4.47Å; A157-L173 HydrophobicContact CB-CD1 4.13Å; A157-L173 HydrophobicContact CB-CD2 4.24Å; L158-L173 HydrophobicContact CB-CD1 4.38Å; L158-L173 HydrophobicContact CD1-CB 3.94Å; L158-L173 HydrophobicContact CD1-CD1 4.39Å; A161-L173 HydrophobicContact CB-CD1 4.23Å; C169-L173 WeakPolarHBondContact O-CB 3.42Å; C169-L173 VanDerWaalsContact O-CG 3.29Å; C169-L173 WeakPolarHBondContact O-CG 3.12Å; C169-L173 PolarHBondContact O-N 2.99Å; L173-M175 VanDerWaalsContact C-N 3.32Å; L173-M175 PolarHBondContact O-N 3.41Å; L173-H176 CarbonylContact O-C 3.59Å; L173-H176 PolarHBondContact O-N 3.21Å; L173-H176 VanDerWaalsContact O-N 3.11Å; L173-G177 PolarHBondContact O-N 3.13Å; L173-A178 HydrophobicContact CB-CB 3.98Å; L173-A178 VanDerWaalsContact O-CB 3.23Å; L173-A178 WeakPolarHBondContact O-CB 3.36Å; L173-A178 PolarHBondContact O-N 3.04Å
174	L	93.6	Very high	93.1	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.01	19%	0.185	C	C	.	.	H	α-helix	trans	-62	-39.3	176.5	-72.6	173.5	0	0	0	112.3	L158 V170 T171 H176 G177 M180 I207 L210 I299 G300	L158-L174 HydrophobicContact CD1-CD2 4.19Å; L158-L174 HydrophobicContact CD1-CG 3.99Å; L158-L174 HydrophobicContact CD2-CD2 3.81Å; V170-L174 HydrophobicContact CG1-CD1 3.84Å; V170-L174 HydrophobicContact CG1-CG 4.44Å; V170-L174 WeakPolarHBondContact O-CB 3.4Å; V170-L174 VanDerWaalsContact O-CG 3.26Å; V170-L174 WeakPolarHBondContact O-CG 3.38Å; V170-L174 PolarHBondContact O-N 2.94Å; T171-L174 PolarHBondContact O-N 3.22Å; L174-H176 PolarHBondContact O-N 3.4Å; L174-G177 PolarHBondContact O-N 3Å; L174-M180 HydrophobicContact CD2-CB 3.95Å; L174-M180 HydrophobicContact CD2-CG 4.49Å; L174-I207 HydrophobicContact CD1-CG1 4.22Å; L174-L210 HydrophobicContact CD1-CD1 4.03Å; L174-I299 HydrophobicContact CB-CG2 4.37Å; L174-I299 HydrophobicContact CD2-CG2 4.41Å; L174-G300 PolarHBondContact O-N 3.04Å; L174-G300 VanDerWaalsContact O-N 3.11Å
175	M	89.7	Confident	92.9	Very high	38 Å²	38	38.5 Å²	38.5	19%	0.187	20%	0.201	C	C	.	.	H	α-helix	trans	-68.6	-21.4	175.6	-68.9	-71.4	97.1	0	0	113.6	T171 A172 L173 L210 P297 I299 R303	T171-M175 WeakPolarHBondContact O-CB 3.26Å; T171-M175 WeakPolarHBondContact O-CG 3.3Å; T171-M175 PolarHBondContact O-N 3.36Å; A172-M175 PolarHBondContact O-N 3.05Å; L173-M175 VanDerWaalsContact C-N 3.32Å; L173-M175 PolarHBondContact O-N 3.41Å; M175-L210 HydrophobicContact CE-CD2 4.16Å; M175-P297 HydrophobicContact SD-CB 3.93Å; M175-I299 HydrophobicContact CE-CB 4.2Å; M175-I299 HydrophobicContact CE-CD1 4.16Å; M175-I299 HydrophobicContact CE-CG1 3.15Å; M175-R303 VanDerWaalsContact O-CD 3.29Å; M175-R303 WeakPolarHBondContact O-CD 3.43Å
176	H	90	Very high	92.8	Very high	15 Å²	15	41.8 Å²	41.8	7%	0.069	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	5.5	176.2	-85.3	-93.5	0	0	0	113.7	L139 N140 A172 L173 L174	L139-H176 HydrophobicContact CD1-CB 4.22Å; L139-H176 HydrophobicContact CD2-CB 4.11Å; L139-H176 PolarHBondContact O-CE1 3.08Å; N140-H176 PolarHBondContact OD1-CE1 2.96Å; A172-H176 PolarHBondContact O-CD2 3.34Å; A172-H176 VanDerWaalsContact O-CD2 3.29Å; A172-H176 PolarHBondContact O-N 2.99Å; L173-H176 CarbonylContact O-C 3.59Å; L173-H176 PolarHBondContact O-N 3.21Å; L173-H176 VanDerWaalsContact O-N 3.11Å; L174-H176 PolarHBondContact O-N 3.4Å
177	G	89.6	Confident	92.4	Very high	16 Å²	16	41.7 Å²	41.7	17%	0.165	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.7	16.5	173	0	0	0	0	0	115.5	L173 L174	L173-G177 PolarHBondContact O-N 3.13Å; L174-G177 PolarHBondContact O-N 3Å
178	A	92.7	Very high	92.3	Very high	2 Å²	2	40.9 Å²	40.9	2%	0.017	23%	0.232	C	C	.	.			trans	-63.1	138.9	175.9	0	0	0	0	0	111.9	E148 L158 L173 M180	E148-A178 VanDerWaalsContact OE1-CA 3.25Å; E148-A178 WeakPolarHBondContact OE1-CA 3.4Å; L158-A178 HydrophobicContact CB-CB 4.3Å; L158-A178 HydrophobicContact CD2-CB 4.16Å; L173-A178 HydrophobicContact CB-CB 3.98Å; L173-A178 VanDerWaalsContact O-CB 3.23Å; L173-A178 WeakPolarHBondContact O-CB 3.36Å; L173-A178 PolarHBondContact O-N 3.04Å; A178-M180 PolarHBondContact O-N 3.11Å
179	D	91.3	Very high	92.1	Very high	66 Å²	66	38.3 Å²	38.3	35%	0.353	22%	0.216	S	C	.	.			trans	-72	113.3	-179.4	-175.1	12.8	0	0	0	111.7	E148 L158 H181 A182	E148-D179 PolarHBondContact OE1-N 2.95Å; E148-D179 VanDerWaalsContact OE2-CB 3.3Å; E148-D179 WeakPolarHBondContact OE2-CB 3.33Å; L158-D179 WeakPolarHBondContact CD2-O 3.41Å; D179-H181 PolarHBondContact O-N 3.37Å; D179-H181 WeakPolarHBondContact OD1-CB 3.3Å; D179-H181 IonicContact OD1-CD2 2.72Å; D179-H181 PolarHBondContact OD1-N 3.46Å; D179-A182 WeakPolarHBondContact O-CB 3.38Å; D179-A182 PolarHBondContact O-N 2.72Å
180	M	90	Very high	91.9	Very high	33 Å²	33	38.8 Å²	38.8	16%	0.163	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-23.5	176.1	178.1	174.3	49.6	0	0	113.2	L174 A178 A182 I207 Q211	L174-M180 HydrophobicContact CD2-CB 3.95Å; L174-M180 HydrophobicContact CD2-CG 4.49Å; A178-M180 PolarHBondContact O-N 3.11Å; M180-A182 VanDerWaalsContact C-N 3.34Å; M180-I207 HydrophobicContact SD-CG2 4.21Å; M180-Q211 HydrophobicContact CE-CG 4.31Å; M180-Q211 HydrophobicContact SD-CG 3.99Å; M180-Q211 PolarHBondContact SD-NE2 3.29Å
181	H	90.6	Very high	91.8	Very high	139 Å²	139	38.9 Å²	38.9	64%	0.644	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.8	5.8	-178.7	-62.7	-69.1	0	0	0	113	D179 V183	D179-H181 PolarHBondContact O-N 3.37Å; D179-H181 WeakPolarHBondContact OD1-CB 3.3Å; D179-H181 IonicContact OD1-CD2 2.72Å; D179-H181 PolarHBondContact OD1-N 3.46Å; H181-V183 PolarHBondContact O-N 3.17Å
182	A	89.8	Confident	91.8	Very high	2 Å²	2	41.6 Å²	41.6	2%	0.017	23%	0.232	C	C	.	.			trans	-55.5	132.1	172.2	0	0	0	0	0	110.8	T156 I159 D179 M180 G190	T156-A182 HydrophobicContact CG2-CB 4.02Å; I159-A182 HydrophobicContact CD1-CB 4.19Å; D179-A182 WeakPolarHBondContact O-CB 3.38Å; D179-A182 PolarHBondContact O-N 2.72Å; M180-A182 VanDerWaalsContact C-N 3.34Å; A182-G190 WeakPolarHBondContact O-CA 3.27Å
183	V	93.6	Very high	91.8	Very high	65 Å²	65	44.8 Å²	44.8	39%	0.394	25%	0.247	S	C	.	.	B	Isolated β-bridge	trans	-117.8	146.4	178	-65.8	0	0	0	0	110.3	H181 R189	H181-V183 PolarHBondContact O-N 3.17Å; V183-R189 WeakPolarHBondContact CA-O 3.48Å
184	D	92.5	Very high	91.8	Very high	3 Å²	3	46.1 Å²	46.1	2%	0.016	25%	0.252	C	S	.	.			trans	-74	152.3	173.9	81.1	-70.4	0	0	0	112	F155 V186 Q187 G188 R189 W194	F155-D184 HydrophobicContact CD1-CB 3.5Å; F155-D184 HydrophobicContact CE1-CB 3.36Å; D184-V186 PolarHBondContact OD2-N 3.38Å; D184-Q187 VanDerWaalsContact OD2-CB 3.31Å; D184-Q187 WeakPolarHBondContact OD2-CB 3.49Å; D184-Q187 PolarHBondContact OD2-N 3.22Å; D184-G188 VanDerWaalsContact O-CA 3.27Å; D184-G188 WeakPolarHBondContact O-CA 3.33Å; D184-G188 PolarHBondContact O-N 3.14Å; D184-G188 VanDerWaalsContact O-N 3.09Å; D184-G188 PolarHBondContact OD1-N 3.03Å; D184-R189 PolarHBondContact N-O 3.16Å; D184-R189 WeakPolarHBondContact OD1-CA 3.41Å; D184-R189 WeakPolarHBondContact OD1-CB 3.38Å; D184-R189 PolarHBondContact OD1-N 2.92Å; D184-R189 VanDerWaalsContact OD1-O 3.05Å; D184-W194 PolarHBondContact OD1-NE1 3.34Å
185	L	92.3	Very high	91.8	Very high	120 Å²	120	46 Å²	46	63%	0.628	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-22.1	-176.5	-66	173.7	0	0	0	112.3	R153	R153-L185 PolarHBondContact O-N 3.38Å
186	V	90.9	Very high	92.1	Very high	87 Å²	87	48.3 Å²	48.3	53%	0.527	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-41	-175.3	-175	0	0	0	0	111.4	R153 D184	R153-V186 HydrophobicContact CB-CG2 3.97Å; R153-V186 HydrophobicContact CG-CG2 4.35Å; D184-V186 PolarHBondContact OD2-N 3.38Å
187	Q	89	Confident	92.2	Very high	106 Å²	106	55.5 Å²	55.5	50%	0.495	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	-6.8	-170.3	-59.8	-79	-48.6	0	0	113.4	D184 R189 W194	D184-Q187 VanDerWaalsContact OD2-CB 3.31Å; D184-Q187 WeakPolarHBondContact OD2-CB 3.49Å; D184-Q187 PolarHBondContact OD2-N 3.22Å; Q187-R189 HydrophobicContact CB-CG 4.17Å; Q187-R189 VanDerWaalsContact CB-CZ 3.47Å; Q187-R189 PolarHBondContact O-N 2.92Å; Q187-W194 HydrophobicContact CG-CZ2 4.49Å
188	G	92.3	Very high	92.4	Very high	52 Å²	52	57.2 Å²	57.2	54%	0.536	30%	0.298	S	S	.	.			trans	63.4	22.1	-178.2	0	0	0	0	0	113.8	D184	D184-G188 VanDerWaalsContact O-CA 3.27Å; D184-G188 WeakPolarHBondContact O-CA 3.33Å; D184-G188 PolarHBondContact O-N 3.14Å; D184-G188 VanDerWaalsContact O-N 3.09Å; D184-G188 PolarHBondContact OD1-N 3.03Å
189	R	91.8	Very high	92.5	Very high	29 Å²	29	58.8 Å²	58.8	11%	0.109	32%	0.315	C	S	.	.			trans	-93.7	139.3	-178.2	-73.7	-163.7	-71.9	-90.5	6.2	111.2	V183 D184 Q187 D193	V183-R189 WeakPolarHBondContact CA-O 3.48Å; D184-R189 PolarHBondContact N-O 3.16Å; D184-R189 WeakPolarHBondContact OD1-CA 3.41Å; D184-R189 WeakPolarHBondContact OD1-CB 3.38Å; D184-R189 PolarHBondContact OD1-N 2.92Å; D184-R189 VanDerWaalsContact OD1-O 3.05Å; Q187-R189 HydrophobicContact CB-CG 4.17Å; Q187-R189 VanDerWaalsContact CB-CZ 3.47Å; Q187-R189 PolarHBondContact O-N 2.92Å; R189-D193 HydrophobicContact CB-CB 3.98Å; R189-D193 HydrophobicContact CG-CB 4.14Å
190	G	92.9	Very high	92.6	Very high	12 Å²	12	61 Å²	61	12%	0.124	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-85.5	177.7	174.9	0	0	0	0	0	113	A182 K192 D193 W194	A182-G190 WeakPolarHBondContact O-CA 3.27Å; G190-K192 VanDerWaalsContact C-N 3.31Å; G190-K192 PolarHBondContact O-N 3.34Å; G190-D193 PolarHBondContact N-OD2 3.48Å; G190-D193 VanDerWaalsContact N-OD2 3.16Å; G190-D193 PolarHBondContact O-N 3.27Å; G190-W194 PolarHBondContact O-N 3.46Å
191	L	93.6	Very high	92.7	Very high	2 Å²	2	65.4 Å²	65.4	1%	0.01	34%	0.337	C	S	.	.	H	α-helix	trans	-51	-47.5	174.6	176.8	65.9	0	0	0	112.8	L158 D193 W194 I195 I207	L158-L191 HydrophobicContact CD1-CD2 4.08Å; L158-L191 HydrophobicContact CD2-CD2 3.86Å; L158-L191 HydrophobicContact CG-CD1 4.29Å; L158-L191 HydrophobicContact CG-CD2 3.78Å; L158-L191 WeakPolarHBondContact O-CD1 3.37Å; L191-D193 VanDerWaalsContact C-N 3.34Å; L191-D193 PolarHBondContact O-N 3.29Å; L191-W194 PolarHBondContact O-N 3.42Å; L191-I195 HydrophobicContact CD1-CD1 3.79Å; L191-I195 HydrophobicContact CD1-CG1 4.28Å; L191-I195 HydrophobicContact CD2-CD1 4.43Å; L191-I195 HydrophobicContact CG-CD1 3.71Å; L191-I195 VanDerWaalsContact O-CG1 3.25Å; L191-I195 WeakPolarHBondContact O-CG1 2.89Å; L191-I195 PolarHBondContact O-N 3.46Å; L191-I207 HydrophobicContact CD2-CD1 3.68Å; L191-I207 HydrophobicContact CG-CD1 4.17Å
192	K	93.8	Very high	92.8	Very high	77 Å²	77	65.7 Å²	65.7	34%	0.335	34%	0.339	S	S	.	.	H	α-helix	trans	-62.8	-40	-177	-68.1	-178.6	178.2	-179.2	0	112	G190 I195 L196 L204	G190-K192 VanDerWaalsContact C-N 3.31Å; G190-K192 PolarHBondContact O-N 3.34Å; K192-I195 PolarHBondContact O-N 3.3Å; K192-L196 WeakPolarHBondContact O-CG 3.25Å; K192-L196 PolarHBondContact O-N 2.89Å; K192-L204 HydrophobicContact CG-CD1 4.46Å
193	D	93.8	Very high	93	Very high	74 Å²	74	65.6 Å²	65.6	40%	0.396	34%	0.338	S	S	.	.	H	α-helix	trans	-68.4	-40.5	-179.3	-56.9	-32.4	0	0	0	111.2	R189 G190 L191 L196 R197	R189-D193 HydrophobicContact CB-CB 3.98Å; R189-D193 HydrophobicContact CG-CB 4.14Å; G190-D193 PolarHBondContact N-OD2 3.48Å; G190-D193 VanDerWaalsContact N-OD2 3.16Å; G190-D193 PolarHBondContact O-N 3.27Å; L191-D193 VanDerWaalsContact C-N 3.34Å; L191-D193 PolarHBondContact O-N 3.29Å; D193-L196 PolarHBondContact O-N 3.11Å; D193-R197 WeakPolarHBondContact O-CB 3.44Å; D193-R197 WeakPolarHBondContact O-CG 3.44Å; D193-R197 PolarHBondContact O-N 3.04Å
194	W	93.8	Very high	93	Very high	28 Å²	28	63 Å²	63	11%	0.106	32%	0.322	C	S	.	.	H	α-helix	trans	-63.7	-45.5	175.3	-81.6	111.5	0	0	0	111.9	F155 I159 L163 D184 Q187 G190 L191 L196 R197 T198	F155-W194 AromaticContact CE1-CE2 3.88Å; F155-W194 AromaticContact CE1-CZ2 3.86Å; F155-W194 HydrophobicContact CE1-CZ2 3.86Å; F155-W194 AromaticContact CE1-NE1 3.79Å; F155-W194 HydrophobicContact CZ-CH2 4.21Å; F155-W194 AromaticContact CZ-CZ2 3.7Å; F155-W194 HydrophobicContact CZ-CZ2 3.7Å; I159-W194 HydrophobicContact CG2-CG 4.48Å; L163-W194 HydrophobicContact CD1-CB 4.41Å; L163-W194 HydrophobicContact CD1-CD2 3.94Å; L163-W194 HydrophobicContact CD1-CE3 3.33Å; L163-W194 HydrophobicContact CD1-CG 4.42Å; L163-W194 HydrophobicContact CD1-CZ3 3.85Å; D184-W194 PolarHBondContact OD1-NE1 3.34Å; Q187-W194 HydrophobicContact CG-CZ2 4.49Å; G190-W194 PolarHBondContact O-N 3.46Å; L191-W194 PolarHBondContact O-N 3.42Å; W194-L196 VanDerWaalsContact C-N 3.33Å; W194-L196 PolarHBondContact O-N 3.34Å; W194-R197 PolarHBondContact O-N 3.33Å; W194-T198 WeakPolarHBondContact O-CG2 3.33Å; W194-T198 PolarHBondContact O-N 3.28Å; W194-T198 PolarHBondContact O-OG1 2.96Å
195	I	95	Very high	93	Very high	1 Å²	1	66.2 Å²	66.2	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-59.2	-42.7	177.1	-72.2	170.2	0	0	0	111.8	L191 K192 T198 G199 R200 T203 L204 I207	L191-I195 HydrophobicContact CD1-CD1 3.79Å; L191-I195 HydrophobicContact CD1-CG1 4.28Å; L191-I195 HydrophobicContact CD2-CD1 4.43Å; L191-I195 HydrophobicContact CG-CD1 3.71Å; L191-I195 VanDerWaalsContact O-CG1 3.25Å; L191-I195 WeakPolarHBondContact O-CG1 2.89Å; L191-I195 PolarHBondContact O-N 3.46Å; K192-I195 PolarHBondContact O-N 3.3Å; I195-T198 PolarHBondContact O-OG1 3.4Å; I195-G199 PolarHBondContact O-N 3.03Å; I195-G199 VanDerWaalsContact O-N 3.14Å; I195-R200 HydrophobicContact CG2-CB 4.05Å; I195-R200 WeakPolarHBondContact CG2-O 3.37Å; I195-R200 PolarHBondContact O-N 3.29Å; I195-T203 HydrophobicContact CD1-CG2 3.73Å; I195-T203 HydrophobicContact CG1-CG2 4.37Å; I195-L204 HydrophobicContact CG2-CB 3.76Å; I195-L204 HydrophobicContact CG2-CD1 4.35Å; I195-I207 HydrophobicContact CD1-CD1 3.34Å
196	L	94.6	Very high	93	Very high	85 Å²	85	64.8 Å²	64.8	45%	0.445	33%	0.325	S	S	.	.	H	α-helix	trans	-65.4	-44	177.7	-75.5	169.9	0	0	0	111.6	K192 D193 W194 T198 G199 F201 L204	K192-L196 WeakPolarHBondContact O-CG 3.25Å; K192-L196 PolarHBondContact O-N 2.89Å; D193-L196 PolarHBondContact O-N 3.11Å; W194-L196 VanDerWaalsContact C-N 3.33Å; W194-L196 PolarHBondContact O-N 3.34Å; L196-T198 VanDerWaalsContact C-N 3.34Å; L196-T198 PolarHBondContact O-N 2.99Å; L196-G199 PolarHBondContact O-N 3.21Å; L196-F201 HydrophobicContact CD2-CE1 4.46Å; L196-L204 HydrophobicContact CD2-CD2 3.62Å; L196-L204 HydrophobicContact CG-CD2 4.33Å
197	R	92.7	Very high	93.1	Very high	166 Å²	166	60.7 Å²	60.7	63%	0.626	30%	0.3	S	S	*	.	H	α-helix	trans	-65.5	-35.5	178.7	-77	179.7	172.8	-132.9	2.8	113.2	D193 W194 G199	D193-R197 WeakPolarHBondContact O-CB 3.44Å; D193-R197 WeakPolarHBondContact O-CG 3.44Å; D193-R197 PolarHBondContact O-N 3.04Å; W194-R197 PolarHBondContact O-N 3.33Å; R197-G199 VanDerWaalsContact C-N 3.29Å
198	T	93.7	Very high	93.2	Very high	52 Å²	52	62.4 Å²	62.4	32%	0.319	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-0.2	177.5	56.9	0	0	0	0	113.3	L163 W194 I195 L196 R200	L163-T198 HydrophobicContact CD1-CG2 3.7Å; L163-T198 HydrophobicContact CG-CG2 4.39Å; W194-T198 WeakPolarHBondContact O-CG2 3.33Å; W194-T198 PolarHBondContact O-N 3.28Å; W194-T198 PolarHBondContact O-OG1 2.96Å; I195-T198 PolarHBondContact O-OG1 3.4Å; L196-T198 VanDerWaalsContact C-N 3.34Å; L196-T198 PolarHBondContact O-N 2.99Å; T198-R200 VanDerWaalsContact C-N 3.33Å; T198-R200 PolarHBondContact O-N 3.08Å; T198-R200 VanDerWaalsContact OG1-CG 3.29Å; T198-R200 WeakPolarHBondContact OG1-CG 3.48Å
199	G	93.9	Very high	93.1	Very high	36 Å²	36	67.8 Å²	67.8	37%	0.371	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	23.4	178.1	0	0	0	0	0	114.4	I195 L196 R197 F201	I195-G199 PolarHBondContact O-N 3.03Å; I195-G199 VanDerWaalsContact O-N 3.14Å; L196-G199 PolarHBondContact O-N 3.21Å; R197-G199 VanDerWaalsContact C-N 3.29Å; G199-F201 VanDerWaalsContact C-N 3.29Å; G199-F201 WeakPolarHBondContact O-CD2 3.29Å; G199-F201 PolarHBondContact O-N 2.74Å
200	R	94.1	Very high	93	Very high	111 Å²	111	67.4 Å²	67.4	42%	0.419	31%	0.307	S	S	.	.			trans	-86.6	61.4	-175.5	-57.7	-60.5	-169.4	-175.8	-1.4	112.2	I195 T198 E202 T203 L204	I195-R200 HydrophobicContact CG2-CB 4.05Å; I195-R200 WeakPolarHBondContact CG2-O 3.37Å; I195-R200 PolarHBondContact O-N 3.29Å; T198-R200 VanDerWaalsContact C-N 3.33Å; T198-R200 PolarHBondContact O-N 3.08Å; T198-R200 VanDerWaalsContact OG1-CG 3.29Å; T198-R200 WeakPolarHBondContact OG1-CG 3.48Å; R200-E202 VanDerWaalsContact C-N 3.29Å; R200-E202 PolarHBondContact O-N 3.44Å; R200-T203 PolarHBondContact O-N 3.41Å; R200-L204 PolarHBondContact O-N 3.25Å
201	F	92.4	Very high	92.8	Very high	126 Å²	126	70.1 Å²	70.1	55%	0.553	32%	0.316	S	S	*	.	H	α-helix	trans	-62	-30.2	-172.8	-59.6	-72.4	0	0	0	114.6	L196 G199 L204 N205	L196-F201 HydrophobicContact CD2-CE1 4.46Å; G199-F201 VanDerWaalsContact C-N 3.29Å; G199-F201 WeakPolarHBondContact O-CD2 3.29Å; G199-F201 PolarHBondContact O-N 2.74Å; F201-L204 WeakPolarHBondContact O-CB 3.43Å; F201-L204 PolarHBondContact O-N 2.92Å; F201-N205 WeakPolarHBondContact O-CB 3.31Å; F201-N205 PolarHBondContact O-N 3.01Å; F201-N205 PolarHBondContact O-ND2 2.95Å
202	E	92.6	Very high	92.6	Very high	145 Å²	145	73.2 Å²	73.2	68%	0.678	34%	0.342	S	S	*	.	H	α-helix	trans	-61	-48.5	175.6	-67.7	171.6	171.6	0	0	111.1	R200 L204 N205 R206	R200-E202 VanDerWaalsContact C-N 3.29Å; R200-E202 PolarHBondContact O-N 3.44Å; E202-L204 VanDerWaalsContact C-N 3.3Å; E202-L204 PolarHBondContact O-N 3.09Å; E202-N205 PolarHBondContact O-N 3.31Å; E202-R206 WeakPolarHBondContact O-CB 3.43Å; E202-R206 PolarHBondContact O-N 3.18Å
203	T	93.9	Very high	92.2	Very high	1 Å²	1	74.4 Å²	74.4	1%	0.006	35%	0.348	C	S	.	.	H	α-helix	trans	-60.6	-40.2	175.1	-48.1	0	0	0	0	111.5	G165 V170 I195 R200 R206 I207	G165-T203 WeakPolarHBondContact CA-OG1 3.25Å; G165-T203 PolarHBondContact O-OG1 2.61Å; V170-T203 HydrophobicContact CB-CG2 4.13Å; V170-T203 HydrophobicContact CG1-CG2 4.17Å; V170-T203 HydrophobicContact CG2-CG2 3.75Å; I195-T203 HydrophobicContact CD1-CG2 3.73Å; I195-T203 HydrophobicContact CG1-CG2 4.37Å; R200-T203 PolarHBondContact O-N 3.41Å; T203-R206 PolarHBondContact O-N 3.08Å; T203-I207 HydrophobicContact CG2-CD1 4.28Å; T203-I207 VanDerWaalsContact O-CG1 3.3Å; T203-I207 WeakPolarHBondContact O-CG1 3.42Å; T203-I207 PolarHBondContact O-N 3.05Å
204	L	94.5	Very high	91.9	Very high	9 Å²	9	73.6 Å²	73.6	5%	0.047	35%	0.347	C	S	.	.	H	α-helix	trans	-62.6	-46.4	175.7	-171	68.2	0	0	0	112	K192 I195 L196 R200 F201 E202 R206 I207 R208	K192-L204 HydrophobicContact CG-CD1 4.46Å; I195-L204 HydrophobicContact CG2-CB 3.76Å; I195-L204 HydrophobicContact CG2-CD1 4.35Å; L196-L204 HydrophobicContact CD2-CD2 3.62Å; L196-L204 HydrophobicContact CG-CD2 4.33Å; R200-L204 PolarHBondContact O-N 3.25Å; F201-L204 WeakPolarHBondContact O-CB 3.43Å; F201-L204 PolarHBondContact O-N 2.92Å; E202-L204 VanDerWaalsContact C-N 3.3Å; E202-L204 PolarHBondContact O-N 3.09Å; L204-R206 VanDerWaalsContact C-N 3.29Å; L204-R206 PolarHBondContact O-N 3.25Å; L204-I207 PolarHBondContact O-N 2.71Å; L204-R208 WeakPolarHBondContact O-CG 3.12Å; L204-R208 PolarHBondContact O-N 3.07Å
205	N	92.3	Very high	91.5	Very high	71 Å²	71	75.2 Å²	75.2	38%	0.38	36%	0.36	S	S	.	.	H	α-helix	trans	-63.5	-38.5	177.7	-75.6	-21.7	0	0	0	111.2	F201 E202 R208 R209	F201-N205 WeakPolarHBondContact O-CB 3.31Å; F201-N205 PolarHBondContact O-N 3.01Å; F201-N205 PolarHBondContact O-ND2 2.95Å; E202-N205 PolarHBondContact O-N 3.31Å; N205-R208 PolarHBondContact O-N 3.39Å; N205-R209 WeakPolarHBondContact O-CG 3.38Å; N205-R209 PolarHBondContact O-N 3.02Å
206	R	91.6	Very high	90.6	Very high	91 Å²	91	77.2 Å²	77.2	34%	0.343	38%	0.377	S	S	.	.	H	α-helix	trans	-62.6	-46.2	174.8	-170.1	61.7	168.9	154.9	2	111.7	T171 E202 T203 L204 R208 R209 L210	T171-R206 HydrophobicContact CG2-CG 3.31Å; T171-R206 VanDerWaalsContact CG2-NE 3.27Å; E202-R206 WeakPolarHBondContact O-CB 3.43Å; E202-R206 PolarHBondContact O-N 3.18Å; T203-R206 PolarHBondContact O-N 3.08Å; L204-R206 VanDerWaalsContact C-N 3.29Å; L204-R206 PolarHBondContact O-N 3.25Å; R206-R208 PolarHBondContact O-N 3.18Å; R206-R209 PolarHBondContact O-N 3.24Å; R206-L210 WeakPolarHBondContact O-CB 3.46Å; R206-L210 WeakPolarHBondContact O-CG 3.47Å; R206-L210 PolarHBondContact O-N 3.44Å
207	I	92.2	Very high	89.6	Confident	1 Å²	1	75.9 Å²	75.9	1%	0.005	38%	0.383	C	S	.	.	H	α-helix	trans	-60.4	-44.1	174.6	-68	165.5	0	0	0	111	V170 L174 M180 L191 I195 T203 L204 R209 L210 Q211	V170-I207 HydrophobicContact CG1-CD1 3.97Å; V170-I207 HydrophobicContact CG1-CG1 3.79Å; L174-I207 HydrophobicContact CD1-CG1 4.22Å; M180-I207 HydrophobicContact SD-CG2 4.21Å; L191-I207 HydrophobicContact CD2-CD1 3.68Å; L191-I207 HydrophobicContact CG-CD1 4.17Å; I195-I207 HydrophobicContact CD1-CD1 3.34Å; T203-I207 HydrophobicContact CG2-CD1 4.28Å; T203-I207 VanDerWaalsContact O-CG1 3.3Å; T203-I207 WeakPolarHBondContact O-CG1 3.42Å; T203-I207 PolarHBondContact O-N 3.05Å; L204-I207 PolarHBondContact O-N 2.71Å; I207-R209 PolarHBondContact O-N 3.16Å; I207-L210 WeakPolarHBondContact O-CB 3.36Å; I207-L210 PolarHBondContact O-N 3.43Å; I207-Q211 HydrophobicContact CG2-CG 4.27Å; I207-Q211 WeakPolarHBondContact O-CG 3.31Å; I207-Q211 PolarHBondContact O-N 3.07Å
208	R	92.2	Very high	88.5	Confident	141 Å²	141	70.9 Å²	70.9	53%	0.532	37%	0.367	S	S	.	.	H	α-helix	trans	-60.2	-44.4	178	-73.6	173.2	-180	167.9	-4.3	112.2	L204 N205 R206 L210 Q211 A212	L204-R208 WeakPolarHBondContact O-CG 3.12Å; L204-R208 PolarHBondContact O-N 3.07Å; N205-R208 PolarHBondContact O-N 3.39Å; R206-R208 PolarHBondContact O-N 3.18Å; R208-L210 VanDerWaalsContact C-N 3.35Å; R208-Q211 PolarHBondContact O-N 2.93Å; R208-A212 PolarHBondContact O-N 3.03Å
209	R	89.4	Confident	87.4	Confident	165 Å²	165	71.1 Å²	71.1	62%	0.623	36%	0.363	S	S	*	.	H	α-helix	trans	-62.5	-42.8	176.3	-72.4	178.5	-172.8	155.1	1.7	111.9	N205 R206 I207 A212 H213	N205-R209 WeakPolarHBondContact O-CG 3.38Å; N205-R209 PolarHBondContact O-N 3.02Å; R206-R209 PolarHBondContact O-N 3.24Å; I207-R209 PolarHBondContact O-N 3.16Å; R209-A212 PolarHBondContact O-N 3.36Å; R209-H213 PolarHBondContact O-N 3.22Å; R209-H213 VanDerWaalsContact O-N 3.13Å
210	L	89.6	Confident	86.1	Confident	22 Å²	22	70.1 Å²	70.1	12%	0.115	35%	0.351	C	S	.	.	H	α-helix	trans	-61.8	-44.9	174.9	-78.5	-178.6	0	0	0	111	T171 L174 M175 R206 I207 R208 A212 H213 P214 I299	T171-L210 HydrophobicContact CG2-CD1 3.68Å; L174-L210 HydrophobicContact CD1-CD1 4.03Å; M175-L210 HydrophobicContact CE-CD2 4.16Å; R206-L210 WeakPolarHBondContact O-CB 3.46Å; R206-L210 WeakPolarHBondContact O-CG 3.47Å; R206-L210 PolarHBondContact O-N 3.44Å; I207-L210 WeakPolarHBondContact O-CB 3.36Å; I207-L210 PolarHBondContact O-N 3.43Å; R208-L210 VanDerWaalsContact C-N 3.35Å; L210-A212 VanDerWaalsContact C-N 3.31Å; L210-A212 PolarHBondContact O-N 3Å; L210-H213 CarbonylContact O-C 2.96Å; L210-H213 PolarHBondContact O-N 3.37Å; L210-H213 VanDerWaalsContact O-N 3.11Å; L210-H213 VanDerWaalsContact O-O 3.07Å; L210-P214 WeakPolarHBondContact O-CA 3.33Å; L210-P214 VanDerWaalsContact O-N 3.14Å; L210-I299 HydrophobicContact CB-CD1 3.54Å; L210-I299 HydrophobicContact CD2-CD1 4.48Å; L210-I299 HydrophobicContact CG-CD1 4.49Å; L210-I299 WeakPolarHBondContact O-CD1 3.37Å
211	Q	89.9	Confident	84.7	Confident	69 Å²	69	70.3 Å²	70.3	32%	0.322	36%	0.357	S	S	.	.	H	α-helix	trans	-64	-33.5	176.6	-72.8	-178.3	-57	0	0	113.5	M180 I207 R208 H213	M180-Q211 HydrophobicContact CE-CG 4.31Å; M180-Q211 HydrophobicContact SD-CG 3.99Å; M180-Q211 PolarHBondContact SD-NE2 3.29Å; I207-Q211 HydrophobicContact CG2-CG 4.27Å; I207-Q211 WeakPolarHBondContact O-CG 3.31Å; I207-Q211 PolarHBondContact O-N 3.07Å; R208-Q211 PolarHBondContact O-N 2.93Å; Q211-H213 VanDerWaalsContact C-N 3.29Å
212	A	89.2	Confident	83.4	Confident	67 Å²	67	69.3 Å²	69.3	55%	0.554	37%	0.365	S	S	*	.	H	α-helix	trans	-68.1	-31.8	174.2	0	0	0	0	0	112.1	R208 R209 L210	R208-A212 PolarHBondContact O-N 3.03Å; R209-A212 PolarHBondContact O-N 3.36Å; L210-A212 VanDerWaalsContact C-N 3.31Å; L210-A212 PolarHBondContact O-N 3Å
213	H	85.7	Confident	82.5	Confident	102 Å²	102	63.8 Å²	63.8	47%	0.472	34%	0.338	S	S	.	.	S	Bend	trans	-129	72.2	-178.8	-58.9	106.3	0	0	0	110.7	R209 L210 Q211 V215 E265	R209-H213 PolarHBondContact O-N 3.22Å; R209-H213 VanDerWaalsContact O-N 3.13Å; L210-H213 CarbonylContact O-C 2.96Å; L210-H213 PolarHBondContact O-N 3.37Å; L210-H213 VanDerWaalsContact O-N 3.11Å; L210-H213 VanDerWaalsContact O-O 3.07Å; Q211-H213 VanDerWaalsContact C-N 3.29Å; H213-V215 VanDerWaalsContact C-N 3.27Å; H213-V215 PolarHBondContact O-N 3.34Å; H213-E265 IonicContact CE1-OE1 3.86Å; H213-E265 PolarHBondContact CE1-OE1 3.49Å; H213-E265 IonicContact CE1-OE2 2.79Å; H213-E265 IonicContact ND1-OE1 3.85Å; H213-E265 IonicContact NE2-OE1 3.19Å; H213-E265 PolarHBondContact NE2-OE1 3.3Å
214	P	86.1	Confident	81.5	Confident	56 Å²	56	71.2 Å²	71.2	36%	0.364	37%	0.37	S	S	.	.			trans	-71.1	-23.9	-170.2	27.4	-34.8	0	0	0	113.5	L210 E298 I299	L210-P214 WeakPolarHBondContact O-CA 3.33Å; L210-P214 VanDerWaalsContact O-N 3.14Å; P214-E298 CarbonylContact O-C 3.57Å; P214-E298 VanDerWaalsContact O-CA 3.3Å; P214-E298 WeakPolarHBondContact O-CA 3.23Å; P214-I299 HydrophobicContact CB-CB 4.41Å; P214-I299 HydrophobicContact CB-CD1 4.12Å; P214-I299 HydrophobicContact CB-CG1 4.46Å; P214-I299 PolarHBondContact O-N 3.27Å
215	V	85.6	Confident	80.6	Confident	63 Å²	63	74 Å²	74	38%	0.382	39%	0.389	S	S	.	.	B	Isolated β-bridge	trans	-110.6	127.8	179.6	-177.8	0	0	0	0	108.7	H213 G217 P296 E298	H213-V215 VanDerWaalsContact C-N 3.27Å; H213-V215 PolarHBondContact O-N 3.34Å; V215-G217 PolarHBondContact O-N 2.89Å; V215-P296 HydrophobicContact CG1-CB 4.22Å; V215-P296 HydrophobicContact CG1-CG 3.65Å; V215-E298 HydrophobicContact CG2-CB 4.18Å; V215-E298 HydrophobicContact CG2-CG 3.75Å
216	A	76.4	Confident	79.9	Confident	43 Å²	43	76 Å²	76	36%	0.355	40%	0.396	S	S	.	.			trans	-67.6	125.4	170.8	0	0	0	0	0	109.8	Q218 P296 P297	A216-Q218 PolarHBondContact O-N 2.93Å; A216-P296 WeakPolarHBondContact O-CB 3.47Å; A216-P297 HydrophobicContact CB-CB 4.12Å; A216-P297 HydrophobicContact CB-CG 3.62Å; A216-P297 PolarHBondContact N-O 3Å
217	G	73.3	Confident	79.3	Confident	56 Å²	56	73.5 Å²	73.5	58%	0.577	39%	0.387	S	S	*	.			trans	-61.6	110.3	175.2	0	0	0	0	0	110.6	V215	V215-G217 PolarHBondContact O-N 2.89Å
218	Q	70.9	Confident	78.7	Confident	62 Å²	62	78 Å²	78	29%	0.29	42%	0.416	S	S	.	.			trans	-91.8	116.5	176.9	-144.9	176.5	-12.5	0	0	110.2	A216 C220 P293 P296	A216-Q218 PolarHBondContact O-N 2.93Å; Q218-C220 VanDerWaalsContact C-N 3.28Å; Q218-C220 WeakPolarHBondContact CG-SG 3.38Å; Q218-C220 PolarHBondContact O-N 3.19Å; Q218-C220 VanDerWaalsContact O-N 3.08Å; Q218-P293 PolarHBondContact NE2-O 2.92Å; Q218-P293 PolarHBondContact OE1-O 3.3Å; Q218-P296 HydrophobicContact CB-CB 4.14Å
219	F	70.6	Confident	78.1	Confident	56 Å²	56	75.6 Å²	75.6	25%	0.246	41%	0.411	C	S	.	.			trans	-88.7	71.8	177.3	-52	-61.4	0	0	0	110.1	Y223 R274 S278 I279	F219-Y223 HydrophobicContact CB-CD1 4.15Å; F219-Y223 HydrophobicContact CB-CD2 4.41Å; F219-Y223 HydrophobicContact CB-CG 3.92Å; F219-Y223 AromaticContact CD1-CD2 3.57Å; F219-Y223 HydrophobicContact CD1-CD2 3.57Å; F219-Y223 AromaticContact CD1-CE2 3.9Å; F219-Y223 HydrophobicContact CD1-CE2 3.9Å; F219-Y223 AromaticContact CD1-CG 3.97Å; F219-Y223 HydrophobicContact CD1-CG 3.97Å; F219-Y223 HydrophobicContact CE1-CD2 4.37Å; F219-Y223 HydrophobicContact CE1-CE2 4.4Å; F219-Y223 HydrophobicContact CG-CD2 4.36Å; F219-Y223 HydrophobicContact CG-CG 4.34Å; F219-R274 HydrophobicContact CD1-CG 3.48Å; F219-R274 VanDerWaalsContact CD1-CG 3.48Å; F219-R274 HydrophobicContact CD2-CG 3.72Å; F219-R274 HydrophobicContact CE1-CG 3.32Å; F219-R274 HydrophobicContact CE2-CB 4.46Å; F219-R274 HydrophobicContact CE2-CG 3.56Å; F219-R274 HydrophobicContact CG-CG 3.69Å; F219-R274 HydrophobicContact CZ-CB 4.48Å; F219-R274 VanDerWaalsContact CZ-CD 3.46Å; F219-R274 HydrophobicContact CZ-CG 3.37Å; F219-R274 VanDerWaalsContact CZ-NE 3.33Å; F219-S278 VanDerWaalsContact CB-CB 3.47Å; F219-I279 PolarHBondContact O-N 3.49Å; F219-I279 VanDerWaalsContact O-N 3.1Å
220	C	66.6	Low	77.8	Confident	16 Å²	16	71.7 Å²	71.7	11%	0.108	40%	0.402	C	S	.	.			trans	-83	-166.5	-179.9	-69.1	0	0	0	0	112.4	Q218 S222 Y223 P293	Q218-C220 VanDerWaalsContact C-N 3.28Å; Q218-C220 WeakPolarHBondContact CG-SG 3.38Å; Q218-C220 PolarHBondContact O-N 3.19Å; Q218-C220 VanDerWaalsContact O-N 3.08Å; C220-S222 PolarHBondContact O-N 3.36Å; C220-Y223 VanDerWaalsContact O-CB 3.27Å; C220-Y223 WeakPolarHBondContact O-CB 3.47Å; C220-Y223 PolarHBondContact O-N 3.45Å; C220-P293 PolarHBondContact SG-O 3.22Å
221	E	64	Low	77.5	Confident	115 Å²	115	76.6 Å²	76.6	54%	0.537	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-22.8	177.5	-64.9	173.1	-170.2	0	0	113.7	Y223 R289	E221-Y223 VanDerWaalsContact C-N 3.34Å; E221-R289 IonicContact OE1-CZ 3.96Å; E221-R289 VanDerWaalsContact OE1-CZ 3.27Å; E221-R289 IonicContact OE1-NH1 3.72Å; E221-R289 PolarHBondContact OE1-NH1 2.96Å; E221-R289 IonicContact OE1-NH2 2.84Å; E221-R289 PolarHBondContact OE1-NH2 3Å
222	S	65.1	Low	77.2	Confident	104 Å²	104	80.1 Å²	80.1	73%	0.727	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-11	175.1	55.2	0	0	0	0	114.1	C220 K224	C220-S222 PolarHBondContact O-N 3.36Å; S222-K224 PolarHBondContact O-N 2.91Å
223	Y	74	Confident	76.9	Confident	30 Å²	30	80.7 Å²	80.7	12%	0.118	43%	0.432	C	S	.	.			trans	-72.9	115.9	180	178.3	-112.6	0	0	0	110.7	F219 C220 E221 P225 H271 R274	F219-Y223 HydrophobicContact CB-CD1 4.15Å; F219-Y223 HydrophobicContact CB-CD2 4.41Å; F219-Y223 HydrophobicContact CB-CG 3.92Å; F219-Y223 AromaticContact CD1-CD2 3.57Å; F219-Y223 HydrophobicContact CD1-CD2 3.57Å; F219-Y223 AromaticContact CD1-CE2 3.9Å; F219-Y223 HydrophobicContact CD1-CE2 3.9Å; F219-Y223 AromaticContact CD1-CG 3.97Å; F219-Y223 HydrophobicContact CD1-CG 3.97Å; F219-Y223 HydrophobicContact CE1-CD2 4.37Å; F219-Y223 HydrophobicContact CE1-CE2 4.4Å; F219-Y223 HydrophobicContact CG-CD2 4.36Å; F219-Y223 HydrophobicContact CG-CG 4.34Å; C220-Y223 VanDerWaalsContact O-CB 3.27Å; C220-Y223 WeakPolarHBondContact O-CB 3.47Å; C220-Y223 PolarHBondContact O-N 3.45Å; E221-Y223 VanDerWaalsContact C-N 3.34Å; Y223-P225 HydrophobicContact CE1-CB 4.32Å; Y223-H271 PolarHBondContact OH-NE2 2.91Å; Y223-R274 HydrophobicContact CE1-CG 4.18Å; Y223-R274 VanDerWaalsContact CE2-CD 3.42Å; Y223-R274 HydrophobicContact CE2-CG 3.73Å; Y223-R274 VanDerWaalsContact CZ-CG 3.49Å; Y223-R274 WeakPolarHBondContact OH-CD 3.38Å; Y223-R274 VanDerWaalsContact OH-CG 3.32Å; Y223-R274 WeakPolarHBondContact OH-CG 3.06Å
224	K	72.8	Confident	76.9	Confident	156 Å²	156	79.4 Å²	79.4	68%	0.678	43%	0.431	S	S	*	.			trans	-86.6	124.8	170.7	-64.6	-177.2	-178.7	180	0	108.7	S222 E226	S222-K224 PolarHBondContact O-N 2.91Å; K224-E226 PolarHBondContact O-N 3.2Å
225	P	74.2	Confident	76.9	Confident	68 Å²	68	82.9 Å²	82.9	44%	0.442	44%	0.443	S	S	.	.			trans	-75.6	44.1	177.6	33.3	-36	0	0	0	111.8	Y223 I275	Y223-P225 HydrophobicContact CE1-CB 4.32Å; P225-I275 HydrophobicContact CB-CG1 4.16Å
226	E	78.3	Confident	76.9	Confident	114 Å²	114	87.8 Å²	87.8	53%	0.533	46%	0.459	S	S	.	.			trans	-105.5	138	171.7	-68.1	-173.2	-160.6	0	0	108.2	K224 P228 K231 H271	K224-E226 PolarHBondContact O-N 3.2Å; E226-P228 VanDerWaalsContact O-CD 3.29Å; E226-P228 WeakPolarHBondContact O-CD 3.49Å; E226-K231 IonicContact OE2-NZ 3.08Å; E226-K231 PolarHBondContact OE2-NZ 2.75Å; E226-K231 VanDerWaalsContact OE2-NZ 3.08Å; E226-H271 PolarHBondContact O-NE2 3.32Å
227	W	80	Confident	77.2	Confident	37 Å²	37	88.7 Å²	88.7	14%	0.14	47%	0.466	C	S	.	.			trans	-86	111.7	171.4	-169.6	18.5	0	0	0	108.3	E229 L230 L233 N266 V268 H271	W227-E229 VanDerWaalsContact C-N 3.28Å; W227-E229 PolarHBondContact O-N 3.13Å; W227-L230 HydrophobicContact CB-CB 3.85Å; W227-L230 HydrophobicContact CD2-CB 4.11Å; W227-L230 HydrophobicContact CE3-CB 3.83Å; W227-L230 HydrophobicContact CE3-CD1 3.97Å; W227-L230 HydrophobicContact CE3-CG 4.36Å; W227-L230 HydrophobicContact CG-CB 4.17Å; W227-L230 HydrophobicContact CZ3-CD1 4.14Å; W227-L230 WeakPolarHBondContact O-CB 3.32Å; W227-L230 PolarHBondContact O-N 2.85Å; W227-L233 HydrophobicContact CH2-CD1 3.75Å; W227-L233 HydrophobicContact CZ2-CD1 4.12Å; W227-L233 HydrophobicContact CZ3-CD1 4.35Å; W227-N266 PolarHBondContact NE1-O 3.5Å; W227-N266 VanDerWaalsContact NE1-O 3.1Å; W227-V268 HydrophobicContact CH2-CB 4.02Å; W227-V268 HydrophobicContact CH2-CG2 3.2Å; W227-V268 HydrophobicContact CZ2-CG2 4.11Å; W227-V268 HydrophobicContact CZ3-CB 4.23Å; W227-V268 HydrophobicContact CZ3-CG1 4.43Å; W227-V268 HydrophobicContact CZ3-CG2 3.55Å; W227-H271 VanDerWaalsContact CA-NE2 3.27Å; W227-H271 WeakPolarHBondContact CA-NE2 3.38Å; W227-H271 VanDerWaalsContact CB-CE1 3.44Å; W227-H271 WeakPolarHBondContact CB-CE1 3.31Å; W227-H271 AromaticContact CD1-CD2 3.7Å; W227-H271 AromaticContact CD1-CG 3.75Å; W227-H271 HydrophobicContact CD2-CB 4.37Å; W227-H271 HydrophobicContact CG-CB 4.11Å; W227-H271 AromaticContact CG-CD2 3.89Å; W227-H271 AromaticContact CG-CG 3.7Å; W227-H271 AromaticContact CG-ND1 3.94Å; W227-H271 PolarHBondContact N-CE1 2.94Å; W227-H271 PolarHBondContact N-NE2 3.47Å
228	P	78.9	Confident	77.8	Confident	97 Å²	97	91.1 Å²	91.1	63%	0.63	47%	0.47	S	S	*	.	H	α-helix	trans	-61.4	-38.9	-172.4	-24.7	36.1	0	0	0	112.5	E226 L230	E226-P228 VanDerWaalsContact O-CD 3.29Å; E226-P228 WeakPolarHBondContact O-CD 3.49Å; P228-L230 VanDerWaalsContact C-N 3.29Å; P228-L230 PolarHBondContact O-N 3.13Å
229	E	80	Confident	78.6	Confident	90 Å²	90	90.4 Å²	90.4	42%	0.421	48%	0.475	S	S	.	.	H	α-helix	trans	-74.1	-19.4	-178	-61.6	-176.5	-176.8	0	0	113.1	W227 K231 Q232 L233	W227-E229 VanDerWaalsContact C-N 3.28Å; W227-E229 PolarHBondContact O-N 3.13Å; E229-K231 VanDerWaalsContact C-N 3.26Å; E229-K231 PolarHBondContact O-N 2.96Å; E229-Q232 PolarHBondContact O-N 3.49Å; E229-L233 HydrophobicContact CB-CD1 4.45Å; E229-L233 WeakPolarHBondContact O-CB 3.46Å; E229-L233 VanDerWaalsContact O-CG 3.32Å; E229-L233 WeakPolarHBondContact O-CG 3.38Å; E229-L233 PolarHBondContact O-N 2.92Å
230	L	82.2	Confident	79.2	Confident	82 Å²	82	94 Å²	94	43%	0.429	50%	0.504	S	S	.	.	H	α-helix	trans	-59.9	-37.5	-179.1	-177.8	64.6	0	0	0	111.9	W227 P228 L233 V234	W227-L230 HydrophobicContact CB-CB 3.85Å; W227-L230 HydrophobicContact CD2-CB 4.11Å; W227-L230 HydrophobicContact CE3-CB 3.83Å; W227-L230 HydrophobicContact CE3-CD1 3.97Å; W227-L230 HydrophobicContact CE3-CG 4.36Å; W227-L230 HydrophobicContact CG-CB 4.17Å; W227-L230 HydrophobicContact CZ3-CD1 4.14Å; W227-L230 WeakPolarHBondContact O-CB 3.32Å; W227-L230 PolarHBondContact O-N 2.85Å; P228-L230 VanDerWaalsContact C-N 3.29Å; P228-L230 PolarHBondContact O-N 3.13Å; L230-L233 PolarHBondContact O-N 3.39Å; L230-V234 HydrophobicContact CD1-CG2 3.9Å; L230-V234 HydrophobicContact CG-CG2 4.13Å; L230-V234 VanDerWaalsContact O-CB 3.28Å; L230-V234 WeakPolarHBondContact O-CB 3.33Å; L230-V234 WeakPolarHBondContact O-CG2 3.48Å; L230-V234 PolarHBondContact O-N 2.72Å
231	K	83.1	Confident	80.1	Confident	126 Å²	126	96.4 Å²	96.4	55%	0.548	51%	0.512	S	S	.	.	H	α-helix	trans	-60.8	-50.3	178.2	-66.5	178.3	-174.5	165.8	0	110.5	E226 E229 L233 V234 E235	E226-K231 IonicContact OE2-NZ 3.08Å; E226-K231 PolarHBondContact OE2-NZ 2.75Å; E226-K231 VanDerWaalsContact OE2-NZ 3.08Å; E229-K231 VanDerWaalsContact C-N 3.26Å; E229-K231 PolarHBondContact O-N 2.96Å; K231-L233 PolarHBondContact O-N 2.87Å; K231-V234 PolarHBondContact O-N 3.32Å; K231-E235 WeakPolarHBondContact O-CB 3.33Å; K231-E235 VanDerWaalsContact O-CG 3.29Å; K231-E235 WeakPolarHBondContact O-CG 3.49Å; K231-E235 PolarHBondContact O-N 2.88Å
232	Q	84.9	Confident	81.2	Confident	142 Å²	142	93.8 Å²	93.8	66%	0.664	51%	0.507	S	S	*	.	H	α-helix	trans	-65.5	-39.3	178.5	-63.9	-178.3	3.8	0	0	112.4	E229 E235 K236	E229-Q232 PolarHBondContact O-N 3.49Å; Q232-E235 PolarHBondContact O-N 3.45Å; Q232-K236 VanDerWaalsContact O-CB 3.26Å; Q232-K236 WeakPolarHBondContact O-CB 3.34Å; Q232-K236 PolarHBondContact O-N 3Å
233	L	82.9	Confident	82	Confident	80 Å²	80	94.5 Å²	94.5	42%	0.419	51%	0.507	S	S	.	.	H	α-helix	trans	-67.1	-39.8	177.5	-71.2	175.4	0	0	0	112.1	W227 E229 L230 K231 K236 A237	W227-L233 HydrophobicContact CH2-CD1 3.75Å; W227-L233 HydrophobicContact CZ2-CD1 4.12Å; W227-L233 HydrophobicContact CZ3-CD1 4.35Å; E229-L233 HydrophobicContact CB-CD1 4.45Å; E229-L233 WeakPolarHBondContact O-CB 3.46Å; E229-L233 VanDerWaalsContact O-CG 3.32Å; E229-L233 WeakPolarHBondContact O-CG 3.38Å; E229-L233 PolarHBondContact O-N 2.92Å; L230-L233 PolarHBondContact O-N 3.39Å; K231-L233 PolarHBondContact O-N 2.87Å; L233-K236 PolarHBondContact O-N 2.91Å; L233-A237 VanDerWaalsContact O-CB 3.22Å; L233-A237 WeakPolarHBondContact O-CB 3.47Å; L233-A237 PolarHBondContact O-N 2.9Å
234	V	84.7	Confident	82.4	Confident	75 Å²	75	96.4 Å²	96.4	46%	0.455	53%	0.525	S	S	.	.	H	α-helix	trans	-66.9	-43.7	175.2	170.3	0	0	0	0	110.4	L230 K231 A237 T238	L230-V234 HydrophobicContact CD1-CG2 3.9Å; L230-V234 HydrophobicContact CG-CG2 4.13Å; L230-V234 VanDerWaalsContact O-CB 3.28Å; L230-V234 WeakPolarHBondContact O-CB 3.33Å; L230-V234 WeakPolarHBondContact O-CG2 3.48Å; L230-V234 PolarHBondContact O-N 2.72Å; K231-V234 PolarHBondContact O-N 3.32Å; V234-A237 PolarHBondContact O-N 3.33Å; V234-T238 HydrophobicContact CG1-CG2 4.25Å; V234-T238 WeakPolarHBondContact O-CB 3.43Å; V234-T238 VanDerWaalsContact O-CG2 3.28Å; V234-T238 WeakPolarHBondContact O-CG2 3.43Å; V234-T238 PolarHBondContact O-N 2.79Å; V234-T238 PolarHBondContact O-OG1 3.36Å
235	E	86.7	Confident	82.9	Confident	129 Å²	129	93.9 Å²	93.9	60%	0.603	52%	0.515	S	S	*	.	H	α-helix	trans	-59.5	-46.7	173.8	-75.2	171.1	-168.4	0	0	111.4	K231 Q232 A237 T238 A239	K231-E235 WeakPolarHBondContact O-CB 3.33Å; K231-E235 VanDerWaalsContact O-CG 3.29Å; K231-E235 WeakPolarHBondContact O-CG 3.49Å; K231-E235 PolarHBondContact O-N 2.88Å; Q232-E235 PolarHBondContact O-N 3.45Å; E235-A237 VanDerWaalsContact C-N 3.31Å; E235-A237 PolarHBondContact O-N 3.03Å; E235-T238 WeakPolarHBondContact CA-OG1 3.5Å; E235-T238 PolarHBondContact O-N 3.19Å; E235-T238 PolarHBondContact O-OG1 3.5Å; E235-A239 WeakPolarHBondContact O-CB 3.38Å; E235-A239 PolarHBondContact O-N 2.72Å
236	K	85.6	Confident	83.3	Confident	165 Å²	165	96.3 Å²	96.3	72%	0.717	52%	0.519	S	S	*	.	H	α-helix	trans	-63.4	-35	175.8	-172.6	177.3	-177.3	177.2	0	112.8	Q232 L233	Q232-K236 VanDerWaalsContact O-CB 3.26Å; Q232-K236 WeakPolarHBondContact O-CB 3.34Å; Q232-K236 PolarHBondContact O-N 3Å; L233-K236 PolarHBondContact O-N 2.91Å
237	A	81.9	Confident	83.5	Confident	62 Å²	62	96 Å²	96	51%	0.512	52%	0.52	S	S	.	.	H	α-helix	trans	-74.5	-34.7	178.3	0	0	0	0	0	112.7	L233 V234 E235	L233-A237 VanDerWaalsContact O-CB 3.22Å; L233-A237 WeakPolarHBondContact O-CB 3.47Å; L233-A237 PolarHBondContact O-N 2.9Å; V234-A237 PolarHBondContact O-N 3.33Å; E235-A237 VanDerWaalsContact C-N 3.31Å; E235-A237 PolarHBondContact O-N 3.03Å
238	T	86.2	Confident	83.6	Confident	108 Å²	108	103.7 Å²	103.7	66%	0.663	55%	0.549	S	S	*	.	H	α-helix	trans	-87.4	-17.9	-178.8	54.2	0	0	0	0	113.3	V234 E235	V234-T238 HydrophobicContact CG1-CG2 4.25Å; V234-T238 WeakPolarHBondContact O-CB 3.43Å; V234-T238 VanDerWaalsContact O-CG2 3.28Å; V234-T238 WeakPolarHBondContact O-CG2 3.43Å; V234-T238 PolarHBondContact O-N 2.79Å; V234-T238 PolarHBondContact O-OG1 3.36Å; E235-T238 WeakPolarHBondContact CA-OG1 3.5Å; E235-T238 PolarHBondContact O-N 3.19Å; E235-T238 PolarHBondContact O-OG1 3.5Å
239	A	87.8	Confident	83.7	Confident	47 Å²	47	102.4 Å²	102.4	39%	0.388	54%	0.535	S	S	.	.	S	Bend	trans	-55.6	140	173.3	0	0	0	0	0	111.7	E235 K241	E235-A239 WeakPolarHBondContact O-CB 3.38Å; E235-A239 PolarHBondContact O-N 2.72Å; A239-K241 PolarHBondContact O-N 2.98Å
240	P	84.4	Confident	83.7	Confident	131 Å²	131	107.1 Å²	107.1	85%	0.851	55%	0.549	S	S	*	.			trans	-63.2	111.8	-178.3	24.7	-33	0	0	0	110.8
241	K	83.9	Confident	83.5	Confident	66 Å²	66	109.4 Å²	109.4	29%	0.287	56%	0.555	S	S	.	*			trans	-76.4	134	179.6	-61.4	175.9	-176.7	170.8	0	111	A239 Q245 K246	A239-K241 PolarHBondContact O-N 2.98Å; K241-Q245 HydrophobicContact CB-CB 4.23Å; K241-K246 HydrophobicContact CB-CG 3.96Å; K241-K246 VanDerWaalsContact O-CE 3.24Å; K241-K246 WeakPolarHBondContact O-CE 3.38Å
242	S	87.3	Confident	83.4	Confident	60 Å²	60	111.1 Å²	111.1	42%	0.42	56%	0.563	S	S	.	*			trans	-62.6	156.4	170.5	178.2	0	0	0	0	111.3	S244 Q245 K246	S242-S244 PolarHBondContact O-N 2.77Å; S242-Q245 VanDerWaalsContact N-OE1 3.16Å; S242-Q245 WeakPolarHBondContact O-CB 3.15Å; S242-Q245 PolarHBondContact O-N 3.01Å; S242-K246 PolarHBondContact O-N 2.93Å
243	T	82	Confident	83	Confident	119 Å²	119	110 Å²	110	73%	0.73	56%	0.558	S	S	*	*	H	α-helix	trans	-54.8	-38.8	178.6	46.4	0	0	0	0	112.3	K246 L247	T243-K246 PolarHBondContact O-N 3.04Å; T243-L247 PolarHBondContact O-N 2.98Å; T243-L247 VanDerWaalsContact O-N 3.08Å
244	S	83.4	Confident	83.1	Confident	70 Å²	70	110.8 Å²	110.8	49%	0.49	57%	0.57	S	S	.	*	H	α-helix	trans	-67.7	-36.2	176.3	61	0	0	0	0	113.2	S242 L247 R248	S242-S244 PolarHBondContact O-N 2.77Å; S244-L247 PolarHBondContact O-N 3.38Å; S244-R248 PolarHBondContact O-N 3.46Å
245	Q	83.3	Confident	82.4	Confident	104 Å²	104	112.6 Å²	112.6	49%	0.486	58%	0.576	S	S	.	*	H	α-helix	trans	-69.6	-38.2	175.6	-72.2	174.5	-17.5	0	0	111.5	K241 S242 L247 R248 Q249	K241-Q245 HydrophobicContact CB-CB 4.23Å; S242-Q245 VanDerWaalsContact N-OE1 3.16Å; S242-Q245 WeakPolarHBondContact O-CB 3.15Å; S242-Q245 PolarHBondContact O-N 3.01Å; Q245-L247 VanDerWaalsContact C-N 3.35Å; Q245-R248 PolarHBondContact O-N 2.84Å; Q245-Q249 WeakPolarHBondContact O-CB 3.42Å; Q245-Q249 PolarHBondContact O-N 2.89Å
246	K	82	Confident	81	Confident	119 Å²	119	110.5 Å²	110.5	52%	0.517	58%	0.576	S	S	.	*	H	α-helix	trans	-63.4	-41	174.1	-68.2	176.8	-178.7	169.3	0	111.6	K241 S242 T243 Q249 R250	K241-K246 HydrophobicContact CB-CG 3.96Å; K241-K246 VanDerWaalsContact O-CE 3.24Å; K241-K246 WeakPolarHBondContact O-CE 3.38Å; S242-K246 PolarHBondContact O-N 2.93Å; T243-K246 PolarHBondContact O-N 3.04Å; K246-Q249 PolarHBondContact O-N 3.22Å; K246-R250 PolarHBondContact O-N 3.48Å
247	L	83.1	Confident	80	Confident	106 Å²	106	110.5 Å²	110.5	56%	0.555	58%	0.576	S	S	*	*	H	α-helix	trans	-65.3	-46.8	176.1	-172	66.5	0	0	0	111.7	T243 S244 Q245 Q249 R250 F251	T243-L247 PolarHBondContact O-N 2.98Å; T243-L247 VanDerWaalsContact O-N 3.08Å; S244-L247 PolarHBondContact O-N 3.38Å; Q245-L247 VanDerWaalsContact C-N 3.35Å; L247-Q249 VanDerWaalsContact C-N 3.3Å; L247-Q249 PolarHBondContact O-N 3.07Å; L247-R250 PolarHBondContact O-N 3.36Å; L247-F251 HydrophobicContact CD1-CD2 4.34Å; L247-F251 HydrophobicContact CD1-CE2 4.32Å; L247-F251 HydrophobicContact CG-CD2 4.26Å; L247-F251 HydrophobicContact CG-CE2 4.46Å; L247-F251 PolarHBondContact O-N 3.02Å
248	R	82.2	Confident	78.8	Confident	199 Å²	199	113.1 Å²	113.1	75%	0.751	59%	0.591	S	S	*	*	H	α-helix	trans	-58.3	-40.7	173.8	-84.8	177.8	71.1	174.8	2.7	112.4	S244 Q245 F251 K252	S244-R248 PolarHBondContact O-N 3.46Å; Q245-R248 PolarHBondContact O-N 2.84Å; R248-F251 PolarHBondContact O-N 3.11Å; R248-K252 WeakPolarHBondContact O-CB 3.43Å; R248-K252 PolarHBondContact O-N 3.37Å
249	Q	80.9	Confident	77.5	Confident	70 Å²	70	115.4 Å²	115.4	33%	0.327	59%	0.592	S	S	.	*	H	α-helix	trans	-66.1	-42.9	179	-170.3	178.1	-18	0	0	111.5	Q245 K246 L247 F251 K252 E253	Q245-Q249 WeakPolarHBondContact O-CB 3.42Å; Q245-Q249 PolarHBondContact O-N 2.89Å; K246-Q249 PolarHBondContact O-N 3.22Å; L247-Q249 VanDerWaalsContact C-N 3.3Å; L247-Q249 PolarHBondContact O-N 3.07Å; Q249-F251 VanDerWaalsContact C-N 3.34Å; Q249-F251 PolarHBondContact O-N 3.29Å; Q249-K252 PolarHBondContact O-N 3.14Å; Q249-E253 HydrophobicContact CG-CG 4.47Å; Q249-E253 WeakPolarHBondContact CG-OE1 3.34Å; Q249-E253 PolarHBondContact NE2-OE1 3.43Å; Q249-E253 WeakPolarHBondContact O-CB 3.22Å; Q249-E253 WeakPolarHBondContact O-CG 3.48Å; Q249-E253 PolarHBondContact O-N 2.96Å
250	R	79.2	Confident	76.1	Confident	189 Å²	189	119.4 Å²	119.4	71%	0.713	61%	0.614	S	S	*	*	H	α-helix	trans	-62.8	-39.3	174.1	-75.5	-167.9	175.9	-170.4	-0.1	113	K246 L247 S254	K246-R250 PolarHBondContact O-N 3.48Å; L247-R250 PolarHBondContact O-N 3.36Å; R250-S254 VanDerWaalsContact O-CB 3.27Å; R250-S254 WeakPolarHBondContact O-CB 3.21Å; R250-S254 PolarHBondContact O-N 2.86Å
251	F	78.7	Confident	75.1	Confident	130 Å²	130	120.5 Å²	120.5	57%	0.57	61%	0.607	S	S	*	*	H	α-helix	trans	-63.4	-42.5	172.7	-99.8	-82.1	0	0	0	111.8	L247 R248 Q249 S254 L255	L247-F251 HydrophobicContact CD1-CD2 4.34Å; L247-F251 HydrophobicContact CD1-CE2 4.32Å; L247-F251 HydrophobicContact CG-CD2 4.26Å; L247-F251 HydrophobicContact CG-CE2 4.46Å; L247-F251 PolarHBondContact O-N 3.02Å; R248-F251 PolarHBondContact O-N 3.11Å; Q249-F251 VanDerWaalsContact C-N 3.34Å; Q249-F251 PolarHBondContact O-N 3.29Å; F251-S254 PolarHBondContact O-N 3.26Å; F251-L255 HydrophobicContact CD1-CD1 4.09Å; F251-L255 WeakPolarHBondContact O-CB 3.49Å; F251-L255 PolarHBondContact O-N 3.42Å; F251-L255 VanDerWaalsContact O-N 3.11Å
252	K	79.8	Confident	74.2	Confident	163 Å²	163	124.3 Å²	124.3	71%	0.709	63%	0.631	S	S	*	*	H	α-helix	trans	-64.7	-42	177.5	-167.4	178	-179.5	-177.1	0	112	R248 Q249 L255 S256	R248-K252 WeakPolarHBondContact O-CB 3.43Å; R248-K252 PolarHBondContact O-N 3.37Å; Q249-K252 PolarHBondContact O-N 3.14Å; K252-L255 PolarHBondContact O-N 2.94Å; K252-S256 WeakPolarHBondContact O-CB 3.21Å; K252-S256 PolarHBondContact O-N 2.97Å
253	E	77.5	Confident	73.3	Confident	119 Å²	119	126.3 Å²	126.3	56%	0.556	64%	0.642	S	S	*	*	H	α-helix	trans	-68.1	-33.6	176.4	-73.1	167.4	-172.7	0	0	112.2	Q249	Q249-E253 HydrophobicContact CG-CG 4.47Å; Q249-E253 WeakPolarHBondContact CG-OE1 3.34Å; Q249-E253 PolarHBondContact NE2-OE1 3.43Å; Q249-E253 WeakPolarHBondContact O-CB 3.22Å; Q249-E253 WeakPolarHBondContact O-CG 3.48Å; Q249-E253 PolarHBondContact O-N 2.96Å
254	S	83.8	Confident	72.7	Confident	96 Å²	96	127.1 Å²	127.1	67%	0.671	64%	0.638	S	S	*	*	H	α-helix	trans	-77.7	-19.7	178.1	-173.6	0	0	0	0	113.9	R250 F251	R250-S254 VanDerWaalsContact O-CB 3.27Å; R250-S254 WeakPolarHBondContact O-CB 3.21Å; R250-S254 PolarHBondContact O-N 2.86Å; F251-S254 PolarHBondContact O-N 3.26Å
255	L	70.3	Confident	72	Confident	112 Å²	112	130.2 Å²	130.2	59%	0.586	65%	0.645	S	S	*	*	S	Bend	trans	-123.3	13.1	-173.9	-65.1	173.4	0	0	0	113.2	F251 K252 F257	F251-L255 HydrophobicContact CD1-CD1 4.09Å; F251-L255 WeakPolarHBondContact O-CB 3.49Å; F251-L255 PolarHBondContact O-N 3.42Å; F251-L255 VanDerWaalsContact O-N 3.11Å; K252-L255 PolarHBondContact O-N 2.94Å; L255-F257 PolarHBondContact O-N 3.21Å
256	S	57.4	Low	71.5	Confident	85 Å²	85	128.6 Å²	128.6	59%	0.594	64%	0.639	S	S	*	*			trans	-74.2	98.5	179.5	60.7	0	0	0	0	110.7	K252	K252-S256 WeakPolarHBondContact O-CB 3.21Å; K252-S256 PolarHBondContact O-N 2.97Å
257	F	65.1	Low	71.5	Confident	166 Å²	166	123.3 Å²	123.3	73%	0.728	62%	0.619	S	S	*	*			trans	-77.2	113.8	156	-64.2	-81.4	0	0	0	107.4	L255 F259	L255-F257 PolarHBondContact O-N 3.21Å; F257-F259 HydrophobicContact CB-CD2 4.33Å; F257-F259 HydrophobicContact CB-CE2 3.81Å; F257-F259 HydrophobicContact CB-CZ 4.3Å; F257-F259 PolarHBondContact O-N 3.47Å; F257-F259 VanDerWaalsContact O-N 3.08Å
258	S	56.6	Low	71.5	Confident	117 Å²	117	122.7 Å²	122.7	82%	0.818	62%	0.619	S	S	*	*			trans	-78.1	91.4	175.3	65.7	0	0	0	0	109
259	F	60.2	Low	71.5	Confident	156 Å²	156	118.3 Å²	118.3	68%	0.684	61%	0.608	S	S	*	*			trans	-70.7	134.2	162.8	-66.2	-78.5	0	0	0	108.1	F257 H261	F257-F259 HydrophobicContact CB-CD2 4.33Å; F257-F259 HydrophobicContact CB-CE2 3.81Å; F257-F259 HydrophobicContact CB-CZ 4.3Å; F257-F259 PolarHBondContact O-N 3.47Å; F257-F259 VanDerWaalsContact O-N 3.08Å; F259-H261 PolarHBondContact O-N 3.37Å
260	P	58	Low	71.6	Confident	130 Å²	130	117.5 Å²	117.5	84%	0.844	61%	0.606	S	S	*	*			trans	-53.5	111.9	168.8	-19.9	30.7	0	0	0	108.1
261	H	62.1	Low	71.8	Confident	155 Å²	155	109.3 Å²	109.3	72%	0.718	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-88.6	142.6	169.4	-103.4	54.7	0	0	0	107.8	F259	F259-H261 PolarHBondContact O-N 3.37Å
262	D	65.3	Low	72.1	Confident	145 Å²	145	107.5 Å²	107.5	78%	0.775	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-55.3	142.2	164.8	-72.2	-34.6	0	0	0	109	E264	D262-E264 PolarHBondContact O-N 2.94Å; D262-E264 VanDerWaalsContact O-N 3.13Å
263	P	68.4	Low	72.3	Confident	102 Å²	102	103.1 Å²	103.1	66%	0.662	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-57.2	122.6	-179.1	22.9	-32.4	0	0	0	109.9	M269	P263-M269 HydrophobicContact CB-CB 4.5Å
264	E	70.7	Confident	72.5	Confident	137 Å²	137	99.9 Å²	99.9	64%	0.64	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-65.5	134.1	176.7	-65.9	177.6	175.6	0	0	110.2	D262 N266 G267	D262-E264 PolarHBondContact O-N 2.94Å; D262-E264 VanDerWaalsContact O-N 3.13Å; E264-N266 PolarHBondContact O-N 3.08Å; E264-G267 PolarHBondContact O-N 3.22Å
265	E	68.4	Low	72.4	Confident	135 Å²	135	97.1 Å²	97.1	63%	0.631	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	129.3	175.6	-169.5	161.2	-143.5	0	0	110	H213 G267	H213-E265 IonicContact CE1-OE1 3.86Å; H213-E265 PolarHBondContact CE1-OE1 3.49Å; H213-E265 IonicContact CE1-OE2 2.79Å; H213-E265 IonicContact ND1-OE1 3.85Å; H213-E265 IonicContact NE2-OE1 3.19Å; H213-E265 PolarHBondContact NE2-OE1 3.3Å; E265-G267 PolarHBondContact O-N 3.47Å
266	N	72.8	Confident	72.8	Confident	70 Å²	70	94.5 Å²	94.5	37%	0.374	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	9	-168.7	-55.9	-63	0	0	0	116.4	W227 E264 D270 R274	W227-N266 PolarHBondContact NE1-O 3.5Å; W227-N266 VanDerWaalsContact NE1-O 3.1Å; E264-N266 PolarHBondContact O-N 3.08Å; N266-D270 WeakPolarHBondContact CA-OD2 3.41Å; N266-D270 PolarHBondContact N-OD2 3.25Å; N266-R274 PolarHBondContact OD1-NH2 3Å
267	G	81.6	Confident	73.8	Confident	8 Å²	8	94.7 Å²	94.7	8%	0.082	50%	0.503	C	S	.	.	S	Bend	trans	-71.6	-176.6	175.1	0	0	0	0	0	113.9	E264 E265 M269 D270 H271	E264-G267 PolarHBondContact O-N 3.22Å; E265-G267 PolarHBondContact O-N 3.47Å; G267-M269 VanDerWaalsContact C-N 3.26Å; G267-M269 PolarHBondContact O-N 3.07Å; G267-D270 PolarHBondContact O-N 3.38Å; G267-H271 PolarHBondContact O-N 3.05Å
268	V	83.1	Confident	74.3	Confident	93 Å²	93	86.9 Å²	86.9	56%	0.564	47%	0.469	S	S	*	.	H	α-helix	trans	-54.5	-44.5	-179.1	-173.5	0	0	0	0	111.4	W227 H271 M272	W227-V268 HydrophobicContact CH2-CB 4.02Å; W227-V268 HydrophobicContact CH2-CG2 3.2Å; W227-V268 HydrophobicContact CZ2-CG2 4.11Å; W227-V268 HydrophobicContact CZ3-CB 4.23Å; W227-V268 HydrophobicContact CZ3-CG1 4.43Å; W227-V268 HydrophobicContact CZ3-CG2 3.55Å; V268-H271 PolarHBondContact O-N 3.46Å; V268-M272 WeakPolarHBondContact O-CB 3.34Å; V268-M272 PolarHBondContact O-N 3.42Å
269	M	82.9	Confident	74.9	Confident	107 Å²	107	83.6 Å²	83.6	53%	0.527	44%	0.442	S	S	.	.	H	α-helix	trans	-70.6	-40.5	-176.2	-65.5	-58.9	-70.1	0	0	111.5	P263 G267 M272 V273	P263-M269 HydrophobicContact CB-CB 4.5Å; G267-M269 VanDerWaalsContact C-N 3.26Å; G267-M269 PolarHBondContact O-N 3.07Å; M269-M272 HydrophobicContact CE-CE 3.51Å; M269-M272 PolarHBondContact O-N 3.03Å; M269-M272 HydrophobicContact SD-CE 4.01Å; M269-V273 VanDerWaalsContact O-CG2 3.32Å; M269-V273 WeakPolarHBondContact O-CG2 3.4Å; M269-V273 PolarHBondContact O-N 3.33Å
270	D	82.8	Confident	75.3	Confident	52 Å²	52	81.4 Å²	81.4	28%	0.278	43%	0.434	S	S	.	.	H	α-helix	trans	-63.7	-43.7	174.8	-176.3	54	0	0	0	111	N266 G267 M272 V273 R274	N266-D270 WeakPolarHBondContact CA-OD2 3.41Å; N266-D270 PolarHBondContact N-OD2 3.25Å; G267-D270 PolarHBondContact O-N 3.38Å; D270-M272 PolarHBondContact O-N 2.91Å; D270-V273 PolarHBondContact O-N 3.21Å; D270-R274 VanDerWaalsContact O-CB 3.29Å; D270-R274 WeakPolarHBondContact O-CB 3.4Å; D270-R274 PolarHBondContact O-N 3.32Å; D270-R274 IonicContact OD2-CZ 3.76Å; D270-R274 IonicContact OD2-NE 2.73Å; D270-R274 IonicContact OD2-NH2 2.91Å; D270-R274 PolarHBondContact OD2-NH2 2.97Å
271	H	83.1	Confident	76	Confident	17 Å²	17	75.6 Å²	75.6	8%	0.079	40%	0.397	C	S	.	.	H	α-helix	trans	-63.9	-39.7	175.1	-171	-101	0	0	0	112.9	Y223 E226 W227 G267 V268 R274 I275	Y223-H271 PolarHBondContact OH-NE2 2.91Å; E226-H271 PolarHBondContact O-NE2 3.32Å; W227-H271 VanDerWaalsContact CA-NE2 3.27Å; W227-H271 WeakPolarHBondContact CA-NE2 3.38Å; W227-H271 VanDerWaalsContact CB-CE1 3.44Å; W227-H271 WeakPolarHBondContact CB-CE1 3.31Å; W227-H271 AromaticContact CD1-CD2 3.7Å; W227-H271 AromaticContact CD1-CG 3.75Å; W227-H271 HydrophobicContact CD2-CB 4.37Å; W227-H271 HydrophobicContact CG-CB 4.11Å; W227-H271 AromaticContact CG-CD2 3.89Å; W227-H271 AromaticContact CG-CG 3.7Å; W227-H271 AromaticContact CG-ND1 3.94Å; W227-H271 PolarHBondContact N-CE1 2.94Å; W227-H271 PolarHBondContact N-NE2 3.47Å; G267-H271 PolarHBondContact O-N 3.05Å; V268-H271 PolarHBondContact O-N 3.46Å; H271-R274 WeakPolarHBondContact O-CB 3.43Å; H271-R274 PolarHBondContact O-N 2.91Å; H271-I275 WeakPolarHBondContact CE1-CD1 3.44Å; H271-I275 WeakPolarHBondContact ND1-CD1 3.45Å; H271-I275 WeakPolarHBondContact O-CG1 3.29Å; H271-I275 PolarHBondContact O-N 3.43Å
272	M	83.9	Confident	76.2	Confident	92 Å²	92	73.3 Å²	73.3	45%	0.453	40%	0.395	S	S	.	.	H	α-helix	trans	-60	-48.8	174.1	-177.7	-174	70.3	0	0	110.8	V268 M269 D270 R274 I275 T276	V268-M272 WeakPolarHBondContact O-CB 3.34Å; V268-M272 PolarHBondContact O-N 3.42Å; M269-M272 HydrophobicContact CE-CE 3.51Å; M269-M272 PolarHBondContact O-N 3.03Å; M269-M272 HydrophobicContact SD-CE 4.01Å; D270-M272 PolarHBondContact O-N 2.91Å; M272-R274 VanDerWaalsContact C-N 3.27Å; M272-R274 PolarHBondContact O-N 3.03Å; M272-I275 PolarHBondContact O-N 3.46Å; M272-T276 WeakPolarHBondContact O-CG2 3.47Å; M272-T276 PolarHBondContact O-N 3.34Å; M272-T276 PolarHBondContact O-OG1 2.69Å; M272-T276 VanDerWaalsContact O-OG1 3.07Å
273	V	83.9	Confident	76.3	Confident	72 Å²	72	72.4 Å²	72.4	44%	0.436	39%	0.39	S	S	.	.	H	α-helix	trans	-59.8	-41.5	175.6	173.7	0	0	0	0	110.3	M269 D270 I275 T276 T277	M269-V273 VanDerWaalsContact O-CG2 3.32Å; M269-V273 WeakPolarHBondContact O-CG2 3.4Å; M269-V273 PolarHBondContact O-N 3.33Å; D270-V273 PolarHBondContact O-N 3.21Å; V273-I275 PolarHBondContact O-N 3.04Å; V273-T276 WeakPolarHBondContact CA-OG1 3.26Å; V273-T276 PolarHBondContact O-N 3.05Å; V273-T276 PolarHBondContact O-OG1 2.85Å; V273-T276 VanDerWaalsContact O-OG1 3.08Å; V273-T277 HydrophobicContact CG1-CG2 4Å; V273-T277 VanDerWaalsContact O-CB 3.3Å; V273-T277 WeakPolarHBondContact O-CB 3.16Å; V273-T277 VanDerWaalsContact O-CG2 3.26Å; V273-T277 WeakPolarHBondContact O-CG2 3.3Å; V273-T277 PolarHBondContact O-N 3.13Å; V273-T277 PolarHBondContact O-OG1 3.2Å
274	R	82.4	Confident	76.1	Confident	51 Å²	51	70.4 Å²	70.4	19%	0.192	38%	0.376	C	S	.	.	H	α-helix	trans	-60.9	-45.7	177.9	-162.7	176.6	-66.2	-173.3	5.1	112.8	F219 Y223 N266 D270 H271 M272 S278	F219-R274 HydrophobicContact CD1-CG 3.48Å; F219-R274 VanDerWaalsContact CD1-CG 3.48Å; F219-R274 HydrophobicContact CD2-CG 3.72Å; F219-R274 HydrophobicContact CE1-CG 3.32Å; F219-R274 HydrophobicContact CE2-CB 4.46Å; F219-R274 HydrophobicContact CE2-CG 3.56Å; F219-R274 HydrophobicContact CG-CG 3.69Å; F219-R274 HydrophobicContact CZ-CB 4.48Å; F219-R274 VanDerWaalsContact CZ-CD 3.46Å; F219-R274 HydrophobicContact CZ-CG 3.37Å; F219-R274 VanDerWaalsContact CZ-NE 3.33Å; Y223-R274 HydrophobicContact CE1-CG 4.18Å; Y223-R274 VanDerWaalsContact CE2-CD 3.42Å; Y223-R274 HydrophobicContact CE2-CG 3.73Å; Y223-R274 VanDerWaalsContact CZ-CG 3.49Å; Y223-R274 WeakPolarHBondContact OH-CD 3.38Å; Y223-R274 VanDerWaalsContact OH-CG 3.32Å; Y223-R274 WeakPolarHBondContact OH-CG 3.06Å; N266-R274 PolarHBondContact OD1-NH2 3Å; D270-R274 VanDerWaalsContact O-CB 3.29Å; D270-R274 WeakPolarHBondContact O-CB 3.4Å; D270-R274 PolarHBondContact O-N 3.32Å; D270-R274 IonicContact OD2-CZ 3.76Å; D270-R274 IonicContact OD2-NE 2.73Å; D270-R274 IonicContact OD2-NH2 2.91Å; D270-R274 PolarHBondContact OD2-NH2 2.97Å; H271-R274 WeakPolarHBondContact O-CB 3.43Å; H271-R274 PolarHBondContact O-N 2.91Å; M272-R274 VanDerWaalsContact C-N 3.27Å; M272-R274 PolarHBondContact O-N 3.03Å; R274-S278 VanDerWaalsContact O-CB 3.29Å; R274-S278 WeakPolarHBondContact O-CB 3.29Å; R274-S278 PolarHBondContact O-N 3.24Å
275	I	80.8	Confident	75.5	Confident	38 Å²	38	69.8 Å²	69.8	20%	0.195	38%	0.381	C	S	.	.	H	α-helix	trans	-62.1	-47.7	174.2	-70.4	169	0	0	0	110.3	P225 H271 M272 V273 T277 S278 S281 L283	P225-I275 HydrophobicContact CB-CG1 4.16Å; H271-I275 WeakPolarHBondContact CE1-CD1 3.44Å; H271-I275 WeakPolarHBondContact ND1-CD1 3.45Å; H271-I275 WeakPolarHBondContact O-CG1 3.29Å; H271-I275 PolarHBondContact O-N 3.43Å; M272-I275 PolarHBondContact O-N 3.46Å; V273-I275 PolarHBondContact O-N 3.04Å; I275-T277 VanDerWaalsContact C-N 3.29Å; I275-T277 PolarHBondContact O-N 3.31Å; I275-S278 PolarHBondContact O-OG 3.29Å; I275-S281 WeakPolarHBondContact O-CB 3.36Å; I275-S281 PolarHBondContact O-OG 3.43Å; I275-L283 HydrophobicContact CG2-CD1 4.48Å
276	T	80.5	Confident	75.1	Confident	56 Å²	56	66.1 Å²	66.1	34%	0.344	37%	0.368	S	S	.	.	H	α-helix	trans	-74.1	-20	-173.9	56.9	0	0	0	0	113.3	M272 V273 L283 V284	M272-T276 WeakPolarHBondContact O-CG2 3.47Å; M272-T276 PolarHBondContact O-N 3.34Å; M272-T276 PolarHBondContact O-OG1 2.69Å; M272-T276 VanDerWaalsContact O-OG1 3.07Å; V273-T276 WeakPolarHBondContact CA-OG1 3.26Å; V273-T276 PolarHBondContact O-N 3.05Å; V273-T276 PolarHBondContact O-OG1 2.85Å; V273-T276 VanDerWaalsContact O-OG1 3.08Å; T276-L283 HydrophobicContact CG2-CD1 4.11Å; T276-V284 WeakPolarHBondContact O-CG2 3.46Å
277	T	76.8	Confident	74.5	Confident	89 Å²	89	66.6 Å²	66.6	55%	0.546	39%	0.389	S	S	.	.	H	α-helix	trans	-104.8	-12.8	-178.6	59	0	0	0	0	114.3	V273 I275	V273-T277 HydrophobicContact CG1-CG2 4Å; V273-T277 VanDerWaalsContact O-CB 3.3Å; V273-T277 WeakPolarHBondContact O-CB 3.16Å; V273-T277 VanDerWaalsContact O-CG2 3.26Å; V273-T277 WeakPolarHBondContact O-CG2 3.3Å; V273-T277 PolarHBondContact O-N 3.13Å; V273-T277 PolarHBondContact O-OG1 3.2Å; I275-T277 VanDerWaalsContact C-N 3.29Å; I275-T277 PolarHBondContact O-N 3.31Å
278	S	76.6	Confident	73.4	Confident	2 Å²	2	70.7 Å²	70.7	1%	0.014	42%	0.417	C	S	.	.	S	Bend	trans	-62.7	145.2	177.6	65.9	0	0	0	0	113.1	F219 R274 I275 H280 S281	F219-S278 VanDerWaalsContact CB-CB 3.47Å; R274-S278 VanDerWaalsContact O-CB 3.29Å; R274-S278 WeakPolarHBondContact O-CB 3.29Å; R274-S278 PolarHBondContact O-N 3.24Å; I275-S278 PolarHBondContact O-OG 3.29Å; S278-H280 PolarHBondContact O-N 2.92Å; S278-S281 WeakPolarHBondContact O-CB 3.5Å; S278-S281 PolarHBondContact O-N 2.95Å; S278-S281 WeakPolarHBondContact OG-CA 3.41Å; S278-S281 PolarHBondContact OG-N 3.12Å
279	I	69	Low	72.6	Confident	48 Å²	48	71.6 Å²	71.6	25%	0.246	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-30.4	178.1	-63.9	165.6	0	0	0	110.8	F219 S281 P290	F219-I279 PolarHBondContact O-N 3.49Å; F219-I279 VanDerWaalsContact O-N 3.1Å; I279-S281 VanDerWaalsContact C-N 3.3Å; I279-P290 HydrophobicContact CD1-CG 3.6Å
280	H	68.1	Low	72.1	Confident	111 Å²	111	68.6 Å²	68.6	51%	0.514	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	16.9	178.2	-133.5	75	0	0	0	113	S278	S278-H280 PolarHBondContact O-N 2.92Å
281	S	72.4	Confident	71.4	Confident	8 Å²	8	69.8 Å²	69.8	6%	0.056	40%	0.404	C	S	.	.			trans	-62	132.2	177.5	-171.4	0	0	0	0	110.3	I275 S278 I279 L283 V284	I275-S281 WeakPolarHBondContact O-CB 3.36Å; I275-S281 PolarHBondContact O-OG 3.43Å; S278-S281 WeakPolarHBondContact O-CB 3.5Å; S278-S281 PolarHBondContact O-N 2.95Å; S278-S281 WeakPolarHBondContact OG-CA 3.41Å; S278-S281 PolarHBondContact OG-N 3.12Å; I279-S281 VanDerWaalsContact C-N 3.3Å; S281-L283 PolarHBondContact O-N 3.18Å; S281-L283 VanDerWaalsContact O-N 3.09Å; S281-L283 PolarHBondContact OG-N 2.92Å; S281-V284 PolarHBondContact O-N 3.11Å
282	P	66.2	Low	70.7	Confident	106 Å²	106	71.2 Å²	71.2	69%	0.688	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-9.2	170.4	28.8	-34	0	0	0	112.5
283	L	67.5	Low	69.9	Low	127 Å²	127	68.2 Å²	68.2	67%	0.665	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-16	-174.9	-56.4	177.8	0	0	0	113.5	I275 T276 S281	I275-L283 HydrophobicContact CG2-CD1 4.48Å; T276-L283 HydrophobicContact CG2-CD1 4.11Å; S281-L283 PolarHBondContact O-N 3.18Å; S281-L283 VanDerWaalsContact O-N 3.09Å; S281-L283 PolarHBondContact OG-N 2.92Å
284	V	64.5	Low	69.2	Low	60 Å²	60	71 Å²	71	36%	0.364	42%	0.421	S	S	.	.			trans	-125.5	117.5	-174.9	-179.3	0	0	0	0	110	T276 S281 T286	T276-V284 WeakPolarHBondContact O-CG2 3.46Å; S281-V284 PolarHBondContact O-N 3.11Å; V284-T286 HydrophobicContact CG1-CG2 3.98Å
285	V	58.2	Low	68.8	Low	123 Å²	123	70.7 Å²	70.7	75%	0.745	43%	0.426	S	S	*	.			trans	-87.4	110.7	164.7	-179.4	0	0	0	0	106.8
286	T	60.7	Low	68.7	Low	59 Å²	59	70.2 Å²	70.2	36%	0.362	43%	0.425	S	S	.	.			trans	-82	119.7	175.5	49.3	0	0	0	0	108.8	V284 S288	V284-T286 HydrophobicContact CG1-CG2 3.98Å; T286-S288 WeakPolarHBondContact CB-O 2.98Å; T286-S288 PolarHBondContact O-N 3.06Å
287	G	58.7	Low	68.7	Low	79 Å²	79	69.2 Å²	69.2	81%	0.814	42%	0.42	S	S	*	.	S	Bend	trans	-76	-4.1	172	0	0	0	0	0	113.3
288	S	60.1	Low	69.2	Low	95 Å²	95	68.7 Å²	68.7	66%	0.664	41%	0.411	S	S	*	.	S	Bend	trans	-136.4	138	-179.5	54.4	0	0	0	0	110.6	T286	T286-S288 WeakPolarHBondContact CB-O 2.98Å; T286-S288 PolarHBondContact O-N 3.06Å
289	R	66.1	Low	69.7	Low	111 Å²	111	70 Å²	70	42%	0.419	42%	0.418	S	S	.	.			trans	-103.7	135.5	174.7	-173.3	179.3	175.6	89.1	-1.8	108.8	E221 L291	E221-R289 IonicContact OE1-CZ 3.96Å; E221-R289 VanDerWaalsContact OE1-CZ 3.27Å; E221-R289 IonicContact OE1-NH1 3.72Å; E221-R289 PolarHBondContact OE1-NH1 2.96Å; E221-R289 IonicContact OE1-NH2 2.84Å; E221-R289 PolarHBondContact OE1-NH2 3Å; R289-L291 PolarHBondContact O-N 3.27Å
290	P	71.3	Confident	70.2	Confident	45 Å²	45	70 Å²	70	29%	0.292	43%	0.429	S	S	.	.			trans	-63.2	136.9	172	28.1	-35.5	0	0	0	109.9	I279 C292 P293	I279-P290 HydrophobicContact CD1-CG 3.6Å; P290-C292 VanDerWaalsContact C-N 3.28Å; P290-C292 PolarHBondContact O-N 3.2Å; P290-P293 HydrophobicContact CG-CB 4.03Å; P290-P293 WeakPolarHBondContact O-CD 3.49Å
291	L	68.7	Low	71.1	Confident	77 Å²	77	68.9 Å²	68.9	40%	0.403	42%	0.422	S	S	.	.	S	Bend	trans	-63	-35.1	179.3	-66.2	179.8	0	0	0	112.7	R289 P293 L309 L318	R289-L291 PolarHBondContact O-N 3.27Å; L291-P293 WeakPolarHBondContact O-CD 3.34Å; L291-L309 HydrophobicContact CD1-CB 4.47Å; L291-L318 HydrophobicContact CD2-CD2 3.22Å
292	C	69.2	Low	71.6	Confident	46 Å²	46	75.6 Å²	75.6	31%	0.311	45%	0.447	S	S	.	.			trans	-122.4	74.2	179.5	-62	0	0	0	0	110.4	P290 T294 S295	P290-C292 VanDerWaalsContact C-N 3.28Å; P290-C292 PolarHBondContact O-N 3.2Å; C292-T294 PolarHBondContact O-N 3.4Å; C292-S295 PolarHBondContact O-N 2.73Å
293	P	66.8	Low	72.5	Confident	30 Å²	30	74.8 Å²	74.8	20%	0.195	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-14.7	-179	26.1	-30.9	0	0	0	113.3	Q218 C220 P290 L291	Q218-P293 PolarHBondContact NE2-O 2.92Å; Q218-P293 PolarHBondContact OE1-O 3.3Å; C220-P293 PolarHBondContact SG-O 3.22Å; P290-P293 HydrophobicContact CG-CB 4.03Å; P290-P293 WeakPolarHBondContact O-CD 3.49Å; L291-P293 WeakPolarHBondContact O-CD 3.34Å
294	T	67.9	Low	73.3	Confident	131 Å²	131	74.4 Å²	74.4	80%	0.804	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	0.3	-176.2	51.9	0	0	0	0	113.1	C292	C292-T294 PolarHBondContact O-N 3.4Å
295	S	75.7	Confident	74.4	Confident	43 Å²	43	71.7 Å²	71.7	30%	0.301	41%	0.405	S	S	.	.	S	Bend	trans	-128.4	78.6	179.5	173.2	0	0	0	0	110.4	C292 K301	C292-S295 PolarHBondContact O-N 2.73Å; S295-K301 PolarHBondContact OG-NZ 3.43Å
296	P	78.5	Confident	75.8	Confident	28 Å²	28	68.3 Å²	68.3	18%	0.182	38%	0.384	C	S	.	.			trans	-61.1	165.1	177.7	22	-31.4	0	0	0	113.5	V215 A216 Q218 E298	V215-P296 HydrophobicContact CG1-CB 4.22Å; V215-P296 HydrophobicContact CG1-CG 3.65Å; A216-P296 WeakPolarHBondContact O-CB 3.47Å; Q218-P296 HydrophobicContact CB-CB 4.14Å; P296-E298 PolarHBondContact O-N 3.11Å
297	P	80.8	Confident	77	Confident	35 Å²	35	67.6 Å²	67.6	23%	0.227	38%	0.38	C	S	.	.			trans	-53	128.7	163.2	-1.5	4	0	0	0	110.5	M175 A216 R303	M175-P297 HydrophobicContact SD-CB 3.93Å; A216-P297 HydrophobicContact CB-CB 4.12Å; A216-P297 HydrophobicContact CB-CG 3.62Å; A216-P297 PolarHBondContact N-O 3Å; P297-R303 VanDerWaalsContact CB-CZ 3.47Å; P297-R303 VanDerWaalsContact N-NH2 3.17Å
298	E	85.9	Confident	78.4	Confident	79 Å²	79	65.4 Å²	65.4	37%	0.369	35%	0.349	S	S	.	.	B	Isolated β-bridge	trans	-136.6	137.6	175.1	177.1	172	-159.3	0	0	109	P214 V215 P296 G300 K301	P214-E298 CarbonylContact O-C 3.57Å; P214-E298 VanDerWaalsContact O-CA 3.3Å; P214-E298 WeakPolarHBondContact O-CA 3.23Å; V215-E298 HydrophobicContact CG2-CB 4.18Å; V215-E298 HydrophobicContact CG2-CG 3.75Å; P296-E298 PolarHBondContact O-N 3.11Å; E298-G300 PolarHBondContact O-N 3.17Å; E298-K301 HydrophobicContact CB-CB 3.95Å; E298-K301 HydrophobicContact CB-CD 4.34Å; E298-K301 HydrophobicContact CG-CB 4.39Å; E298-K301 PolarHBondContact O-N 2.82Å
299	I	87.5	Confident	79.6	Confident	30 Å²	30	62.5 Å²	62.5	15%	0.154	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	129.2	176.4	-63.1	172.5	0	0	0	109.6	L174 M175 L210 P214 K301	L174-I299 HydrophobicContact CB-CG2 4.37Å; L174-I299 HydrophobicContact CD2-CG2 4.41Å; M175-I299 HydrophobicContact CE-CB 4.2Å; M175-I299 HydrophobicContact CE-CD1 4.16Å; M175-I299 HydrophobicContact CE-CG1 3.15Å; L210-I299 HydrophobicContact CB-CD1 3.54Å; L210-I299 HydrophobicContact CD2-CD1 4.48Å; L210-I299 HydrophobicContact CG-CD1 4.49Å; L210-I299 WeakPolarHBondContact O-CD1 3.37Å; P214-I299 HydrophobicContact CB-CB 4.41Å; P214-I299 HydrophobicContact CB-CD1 4.12Å; P214-I299 HydrophobicContact CB-CG1 4.46Å; P214-I299 PolarHBondContact O-N 3.27Å; I299-K301 PolarHBondContact O-N 3.07Å
300	G	80.3	Confident	80.4	Confident	46 Å²	46	61.9 Å²	61.9	47%	0.474	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	-8.3	178	0	0	0	0	0	114.1	L174 E298	L174-G300 PolarHBondContact O-N 3.04Å; L174-G300 VanDerWaalsContact O-N 3.11Å; E298-G300 PolarHBondContact O-N 3.17Å
301	K	85.9	Confident	81	Confident	88 Å²	88	67.9 Å²	67.9	38%	0.383	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-83.3	118.6	173	-171.4	176.4	-173.5	174.6	0	110.4	S295 E298 I299 R303	S295-K301 PolarHBondContact OG-NZ 3.43Å; E298-K301 HydrophobicContact CB-CB 3.95Å; E298-K301 HydrophobicContact CB-CD 4.34Å; E298-K301 HydrophobicContact CG-CB 4.39Å; E298-K301 PolarHBondContact O-N 2.82Å; I299-K301 PolarHBondContact O-N 3.07Å; K301-R303 PolarHBondContact O-N 3.14Å
302	R	84.1	Confident	81.6	Confident	149 Å²	149	69.4 Å²	69.4	56%	0.562	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-60.2	130.5	174.6	-175.6	174.6	176.8	166.7	1	110.7
303	R	84	Confident	81.9	Confident	90 Å²	90	69.7 Å²	69.7	34%	0.34	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-101.5	140.1	173.8	-70.9	-178.2	153.3	-157.6	-23.5	110.5	M175 P297 K301	M175-R303 VanDerWaalsContact O-CD 3.29Å; M175-R303 WeakPolarHBondContact O-CD 3.43Å; P297-R303 VanDerWaalsContact CB-CZ 3.47Å; P297-R303 VanDerWaalsContact N-NH2 3.17Å; K301-R303 PolarHBondContact O-N 3.14Å
304	Y	84.6	Confident	82	Confident	118 Å²	118	71 Å²	71	46%	0.463	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-78.4	142.9	173.6	-63.1	-70.1	0	0	0	109.8	E308 L309 K312	Y304-E308 VanDerWaalsContact CA-OE2 3.23Å; Y304-E308 WeakPolarHBondContact CA-OE2 3.48Å; Y304-E308 WeakPolarHBondContact CB-OE2 3.49Å; Y304-E308 HydrophobicContact CD1-CB 4.4Å; Y304-E308 WeakPolarHBondContact CD1-OE2 3.48Å; Y304-L309 HydrophobicContact CD2-CD2 4.29Å; Y304-L309 HydrophobicContact CG-CD2 4.45Å; Y304-K312 PolarHBondContact OH-NZ 3.37Å
305	A	87.2	Confident	81.8	Confident	4 Å²	4	69 Å²	69	3%	0.033	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-66.4	158.6	170.7	0	0	0	0	0	110	N140 Y142 P307 E308 L309	N140-A305 CarbonylContact O-C 3.52Å; N140-A305 WeakPolarHBondContact O-CA 3.19Å; Y142-A305 WeakPolarHBondContact O-CB 3.39Å; A305-P307 VanDerWaalsContact C-N 3.34Å; A305-E308 HydrophobicContact CB-CG 4.26Å; A305-E308 PolarHBondContact N-OE2 2.72Å; A305-E308 WeakPolarHBondContact O-CB 3.19Å; A305-E308 PolarHBondContact O-N 3.48Å; A305-L309 PolarHBondContact O-N 2.7Å
306	V	88.4	Confident	80.9	Confident	52 Å²	52	73.9 Å²	73.9	32%	0.315	37%	0.371	S	S	.	.	H	α-helix	trans	-53.5	-45.1	178.3	174.3	0	0	0	0	111.8	N140 Y141 E308 L309 L310	N140-V306 WeakPolarHBondContact O-CG2 3.32Å; N140-V306 PolarHBondContact O-N 2.84Å; Y141-V306 HydrophobicContact CD1-CB 4.33Å; Y141-V306 HydrophobicContact CD1-CG2 4.44Å; Y141-V306 HydrophobicContact CE1-CB 4.44Å; Y141-V306 HydrophobicContact CE1-CG2 4.25Å; V306-E308 VanDerWaalsContact C-N 3.34Å; V306-E308 PolarHBondContact O-N 2.77Å; V306-L309 PolarHBondContact O-N 3.3Å; V306-L310 HydrophobicContact CG1-CD1 3.95Å; V306-L310 HydrophobicContact CG1-CG 4.31Å; V306-L310 VanDerWaalsContact O-CG 3.3Å; V306-L310 WeakPolarHBondContact O-CG 3.5Å; V306-L310 PolarHBondContact O-N 3.41Å
307	P	85.9	Confident	80	Confident	43 Å²	43	77.9 Å²	77.9	28%	0.279	39%	0.388	S	S	.	.	H	α-helix	trans	-59	-42.8	174.9	-24.2	35.4	0	0	0	113	Y141 A305 L309 L310 E311	Y141-P307 WeakPolarHBondContact O-CG 3.46Å; A305-P307 VanDerWaalsContact C-N 3.34Å; P307-L309 VanDerWaalsContact C-N 3.31Å; P307-L309 PolarHBondContact O-N 2.73Å; P307-L310 PolarHBondContact O-N 3Å; P307-E311 WeakPolarHBondContact O-CG 3.25Å; P307-E311 PolarHBondContact O-N 3.24Å
308	E	86.6	Confident	79	Confident	34 Å²	34	78.6 Å²	78.6	16%	0.159	39%	0.389	C	S	.	.	H	α-helix	trans	-66	-32.9	178.6	-61.1	173.1	173.1	0	0	112.2	P143 G144 Y304 A305 V306 K312	P143-E308 HydrophobicContact CB-CG 4.12Å; G144-E308 PolarHBondContact N-OE1 3.07Å; Y304-E308 VanDerWaalsContact CA-OE2 3.23Å; Y304-E308 WeakPolarHBondContact CA-OE2 3.48Å; Y304-E308 WeakPolarHBondContact CB-OE2 3.49Å; Y304-E308 HydrophobicContact CD1-CB 4.4Å; Y304-E308 WeakPolarHBondContact CD1-OE2 3.48Å; A305-E308 HydrophobicContact CB-CG 4.26Å; A305-E308 PolarHBondContact N-OE2 2.72Å; A305-E308 WeakPolarHBondContact O-CB 3.19Å; A305-E308 PolarHBondContact O-N 3.48Å; V306-E308 VanDerWaalsContact C-N 3.34Å; V306-E308 PolarHBondContact O-N 2.77Å; E308-K312 VanDerWaalsContact O-CG 3.32Å; E308-K312 WeakPolarHBondContact O-CG 3.48Å; E308-K312 PolarHBondContact O-N 3.05Å
309	L	85.6	Confident	77.6	Confident	34 Å²	34	79.7 Å²	79.7	18%	0.178	39%	0.394	C	S	.	.	H	α-helix	trans	-70.9	-39.7	173.7	-71	173.4	0	0	0	111.9	L291 Y304 A305 V306 P307 E311 K312 H313	L291-L309 HydrophobicContact CD1-CB 4.47Å; Y304-L309 HydrophobicContact CD2-CD2 4.29Å; Y304-L309 HydrophobicContact CG-CD2 4.45Å; A305-L309 PolarHBondContact O-N 2.7Å; V306-L309 PolarHBondContact O-N 3.3Å; P307-L309 VanDerWaalsContact C-N 3.31Å; P307-L309 PolarHBondContact O-N 2.73Å; L309-E311 VanDerWaalsContact C-N 3.32Å; L309-K312 PolarHBondContact O-N 3.03Å; L309-H313 PolarHBondContact O-CD2 2.92Å; L309-H313 PolarHBondContact O-N 3.38Å; L309-H313 VanDerWaalsContact O-N 3.1Å
310	L	84.3	Confident	75.9	Confident	98 Å²	98	85.8 Å²	85.8	51%	0.513	42%	0.422	S	S	.	.	H	α-helix	trans	-68	-31.8	177.7	-69.9	172.8	0	0	0	112.2	V306 P307 K312	V306-L310 HydrophobicContact CG1-CD1 3.95Å; V306-L310 HydrophobicContact CG1-CG 4.31Å; V306-L310 VanDerWaalsContact O-CG 3.3Å; V306-L310 WeakPolarHBondContact O-CG 3.5Å; V306-L310 PolarHBondContact O-N 3.41Å; P307-L310 PolarHBondContact O-N 3Å; L310-K312 VanDerWaalsContact C-N 3.35Å
311	E	84.1	Confident	74.5	Confident	170 Å²	170	86.4 Å²	86.4	79%	0.794	42%	0.419	S	S	*	.	H	α-helix	trans	-69.1	-33.5	172.3	-73.7	-179.2	176.2	0	0	112.6	P307 L309	P307-E311 WeakPolarHBondContact O-CG 3.25Å; P307-E311 PolarHBondContact O-N 3.24Å; L309-E311 VanDerWaalsContact C-N 3.32Å
312	K	80.4	Confident	72.7	Confident	109 Å²	109	85.2 Å²	85.2	47%	0.474	42%	0.419	S	S	.	.	H	α-helix	trans	-77.9	-32.8	-178.5	-75.5	177.3	-179.5	-171.5	0	114	Y304 E308 L309 L310	Y304-K312 PolarHBondContact OH-NZ 3.37Å; E308-K312 VanDerWaalsContact O-CG 3.32Å; E308-K312 WeakPolarHBondContact O-CG 3.48Å; E308-K312 PolarHBondContact O-N 3.05Å; L309-K312 PolarHBondContact O-N 3.03Å; L310-K312 VanDerWaalsContact C-N 3.35Å
313	H	74.9	Confident	71	Confident	53 Å²	53	80.8 Å²	80.8	25%	0.245	41%	0.409	C	S	.	.	S	Bend	trans	-104.4	114.9	-179.2	-68.6	-67.6	0	0	0	109.7	L309 E317 L318	L309-H313 PolarHBondContact O-CD2 2.92Å; L309-H313 PolarHBondContact O-N 3.38Å; L309-H313 VanDerWaalsContact O-N 3.1Å; H313-E317 IonicContact ND1-OE2 2.72Å; H313-L318 HydrophobicContact CB-CG 4.47Å
314	S	69.4	Low	68.8	Low	58 Å²	58	81.4 Å²	81.4	41%	0.406	43%	0.427	S	S	.	.			trans	-64.2	146.8	178.7	77.7	0	0	0	0	110.8	K316 E317 L318	S314-K316 PolarHBondContact O-N 3.3Å; S314-E317 PolarHBondContact O-N 3.29Å; S314-E317 PolarHBondContact OG-N 3.38Å; S314-L318 PolarHBondContact O-N 3.43Å
315	S	63.7	Low	66.9	Low	87 Å²	87	79.4 Å²	79.4	61%	0.608	42%	0.422	S	S	*	.	H	α-helix	trans	-53.5	-29.7	176	-3.8	0	0	0	0	112.6	L318 E319	S315-L318 PolarHBondContact O-N 3.23Å; S315-E319 WeakPolarHBondContact O-CG 3.17Å; S315-E319 PolarHBondContact O-N 3.3Å; S315-E319 VanDerWaalsContact O-N 3.09Å
316	K	56.3	Low	64.8	Low	147 Å²	147	85.2 Å²	85.2	64%	0.639	46%	0.462	S	S	*	.	H	α-helix	trans	-70.8	-41.1	177.7	-67.3	-177.6	177.6	-179.4	0	113.3	S314 L318 E319 E320	S314-K316 PolarHBondContact O-N 3.3Å; K316-L318 VanDerWaalsContact C-N 3.26Å; K316-L318 PolarHBondContact O-N 2.92Å; K316-E319 PolarHBondContact O-N 3.37Å; K316-E320 WeakPolarHBondContact O-CB 3.24Å; K316-E320 WeakPolarHBondContact O-CG 3.25Å; K316-E320 PolarHBondContact O-N 3.03Å
317	E	60.2	Low	62.5	Low	112 Å²	112	90 Å²	90	52%	0.523	49%	0.485	S	S	.	.	H	α-helix	trans	-65.7	-33.1	174.9	-72.9	177.6	175.9	0	0	111.7	H313 S314 S321	H313-E317 IonicContact ND1-OE2 2.72Å; S314-E317 PolarHBondContact O-N 3.29Å; S314-E317 PolarHBondContact OG-N 3.38Å; E317-S321 WeakPolarHBondContact O-CB 3.39Å; E317-S321 PolarHBondContact O-N 2.78Å; E317-S321 PolarHBondContact O-OG 3.21Å
318	L	59.4	Low	60.2	Low	50 Å²	50	91.1 Å²	91.1	26%	0.262	51%	0.505	S	S	.	.	H	α-helix	trans	-68	-39.7	175	-66.4	167.4	0	0	0	111.9	L291 H313 S314 S315 K316 S321	L291-L318 HydrophobicContact CD2-CD2 3.22Å; H313-L318 HydrophobicContact CB-CG 4.47Å; S314-L318 PolarHBondContact O-N 3.43Å; S315-L318 PolarHBondContact O-N 3.23Å; K316-L318 VanDerWaalsContact C-N 3.26Å; K316-L318 PolarHBondContact O-N 2.92Å; L318-S321 PolarHBondContact O-OG 3.37Å
319	E	55.7	Low	58	Low	102 Å²	102	93 Å²	93	48%	0.477	52%	0.522	S	S	.	.	H	α-helix	trans	-74.9	-41.5	178.2	-74.6	176.3	-175.8	0	0	113.5	S315 K316 S321 T322 P335	S315-E319 WeakPolarHBondContact O-CG 3.17Å; S315-E319 PolarHBondContact O-N 3.3Å; S315-E319 VanDerWaalsContact O-N 3.09Å; K316-E319 PolarHBondContact O-N 3.37Å; E319-S321 PolarHBondContact O-N 2.95Å; E319-T322 WeakPolarHBondContact O-CG2 3.28Å; E319-T322 PolarHBondContact O-N 3.33Å; E319-T322 PolarHBondContact O-OG1 3.5Å; E319-P335 HydrophobicContact CG-CG 3.77Å
320	E	52.5	Low	55.8	Low	158 Å²	158	97.4 Å²	97.4	74%	0.738	55%	0.545	S	S	*	.	H	α-helix	trans	-71.6	-18.3	-179.1	-72.2	175.3	-171.9	0	0	113	K316 T322	K316-E320 WeakPolarHBondContact O-CB 3.24Å; K316-E320 WeakPolarHBondContact O-CG 3.25Å; K316-E320 PolarHBondContact O-N 3.03Å; E320-T322 PolarHBondContact O-N 3.39Å
321	S	51.9	Low	53.6	Low	59 Å²	59	96.7 Å²	96.7	41%	0.413	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	10.5	176.4	73.8	0	0	0	0	114.8	E317 L318 E319 V323	E317-S321 WeakPolarHBondContact O-CB 3.39Å; E317-S321 PolarHBondContact O-N 2.78Å; E317-S321 PolarHBondContact O-OG 3.21Å; L318-S321 PolarHBondContact O-OG 3.37Å; E319-S321 PolarHBondContact O-N 2.95Å; S321-V323 PolarHBondContact O-N 3.1Å
322	T	47.3	Very low	51.2	Low	62 Å²	62	93.2 Å²	93.2	38%	0.38	54%	0.539	S	S	.	.			trans	-60.2	130.9	175	42.2	0	0	0	0	111.4	E319 E320 S324 A333	E319-T322 WeakPolarHBondContact O-CG2 3.28Å; E319-T322 PolarHBondContact O-N 3.33Å; E319-T322 PolarHBondContact O-OG1 3.5Å; E320-T322 PolarHBondContact O-N 3.39Å; T322-S324 PolarHBondContact O-N 3.05Å; T322-A333 WeakPolarHBondContact CG2-O 3.29Å
323	V	47.9	Very low	49.3	Very low	57 Å²	57	91.2 Å²	91.2	35%	0.345	54%	0.542	S	S	.	.			trans	-70.8	122.8	-159.3	-179.8	0	0	0	0	112.6	S321 H325	S321-V323 PolarHBondContact O-N 3.1Å; V323-H325 VanDerWaalsContact CG1-CE1 3.47Å; V323-H325 WeakPolarHBondContact CG1-CE1 3.48Å
324	S	38	Very low	47.2	Very low	103 Å²	103	93.1 Å²	93.1	72%	0.72	56%	0.562	S	S	*	*	B	Isolated β-bridge	trans	-87.4	115.7	157.7	72.1	0	0	0	0	109.6	T322	T322-S324 PolarHBondContact O-N 3.05Å
325	H	44.9	Very low	45.6	Very low	76 Å²	76	93.3 Å²	93.3	35%	0.352	56%	0.562	S	S	.	*			trans	-80.4	151.6	173.3	-64.9	-71.2	0	0	0	111.4	V323 N327 G328 S329 T331	V323-H325 VanDerWaalsContact CG1-CE1 3.47Å; V323-H325 WeakPolarHBondContact CG1-CE1 3.48Å; H325-N327 PolarHBondContact O-N 2.93Å; H325-G328 PolarHBondContact O-N 3.09Å; H325-S329 PolarHBondContact CD2-O 3.16Å; H325-T331 PolarHBondContact NE2-OG1 3.4Å
326	S	42.8	Very low	44	Very low	125 Å²	125	94.1 Å²	94.1	87%	0.874	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-4.9	174.6	59.2	0	0	0	0	115
327	N	41.2	Very low	43	Very low	152 Å²	152	91.9 Å²	91.9	81%	0.813	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	12.2	173.1	-74	-15.1	0	0	0	113.4	H325 S329	H325-N327 PolarHBondContact O-N 2.93Å; N327-S329 PolarHBondContact O-N 3.16Å; N327-S329 VanDerWaalsContact O-N 3.09Å
328	G	37.8	Very low	41.6	Very low	67 Å²	67	93.2 Å²	93.2	69%	0.691	58%	0.582	S	S	*	*	S	Bend	trans	70.7	2.1	175	0	0	0	0	0	115.6	H325 I330	H325-G328 PolarHBondContact O-N 3.09Å; G328-I330 PolarHBondContact O-N 2.84Å
329	S	40.5	Very low	40.3	Very low	74 Å²	74	94.9 Å²	94.9	52%	0.517	60%	0.598	S	S	.	*			trans	-83.4	113.1	172.4	-167.2	0	0	0	0	109.1	H325 N327	H325-S329 PolarHBondContact CD2-O 3.16Å; N327-S329 PolarHBondContact O-N 3.16Å; N327-S329 VanDerWaalsContact O-N 3.09Å
330	I	37.6	Very low	39.3	Very low	127 Å²	127	94.2 Å²	94.2	65%	0.651	61%	0.61	S	S	*	*	B	Isolated β-bridge	trans	-83.9	112.5	171.5	-59.4	170.6	0	0	0	106.6	G328	G328-I330 PolarHBondContact O-N 2.84Å
331	T	38.7	Very low	38.6	Very low	83 Å²	83	90.8 Å²	90.8	51%	0.509	60%	0.6	S	S	.	*			trans	-99.7	93.4	167.2	-5.8	0	0	0	0	106.5	H325 A333	H325-T331 PolarHBondContact NE2-OG1 3.4Å; T331-A333 PolarHBondContact O-N 3.05Å; T331-A333 VanDerWaalsContact O-N 3.1Å
332	S	34.6	Very low	37.9	Very low	96 Å²	96	93 Å²	93	67%	0.671	62%	0.615	S	S	*	*			trans	-75	96.4	173.4	58	0	0	0	0	108.6
333	A	39.1	Very low	37.1	Very low	67 Å²	67	95.3 Å²	95.3	55%	0.554	63%	0.629	S	S	*	*			trans	-87.2	101.2	159.6	0	0	0	0	0	106.8	T322 T331 P335	T322-A333 WeakPolarHBondContact CG2-O 3.29Å; T331-A333 PolarHBondContact O-N 3.05Å; T331-A333 VanDerWaalsContact O-N 3.1Å; A333-P335 WeakPolarHBondContact O-CD 3.48Å
334	S	32.1	Very low	36.1	Very low	93 Å²	93	96.7 Å²	96.7	65%	0.65	64%	0.641	S	S	*	*			trans	-63.8	122.6	168.7	49.6	0	0	0	0	108.2	T336	S334-T336 PolarHBondContact O-N 3.14Å
335	P	35.2	Very low	35.9	Very low	63 Å²	63	99 Å²	99	41%	0.409	64%	0.644	S	S	.	*			trans	-72.5	89.2	168.5	30.8	-29.5	0	0	0	106.2	E319 A333 A337	E319-P335 HydrophobicContact CG-CG 3.77Å; A333-P335 WeakPolarHBondContact O-CD 3.48Å; P335-A337 PolarHBondContact O-N 3.31Å
336	T	30.1	Very low	35.4	Very low	104 Å²	104	100.8 Å²	100.8	64%	0.638	66%	0.661	S	S	*	*			trans	-63.2	110	167.2	-42.6	0	0	0	0	105.5	S334 L338	S334-T336 PolarHBondContact O-N 3.14Å; T336-L338 HydrophobicContact CG2-CD2 4.36Å; T336-L338 HydrophobicContact CG2-CG 3.89Å; T336-L338 PolarHBondContact O-N 3.46Å
337	A	34.9	Very low	34.8	Very low	99 Å²	99	99.8 Å²	99.8	82%	0.818	65%	0.654	S	S	*	*			trans	-65.1	65.4	165.1	0	0	0	0	0	108.5	P335 S339	P335-A337 PolarHBondContact O-N 3.31Å; A337-S339 VanDerWaalsContact C-N 3.33Å; A337-S339 PolarHBondContact O-N 3.4Å; A337-S339 VanDerWaalsContact O-N 3.17Å
338	L	30.8	Very low	34.3	Very low	140 Å²	140	98.5 Å²	98.5	73%	0.733	66%	0.655	S	S	*	*			trans	-70.1	106.7	154.2	-68.2	171.7	0	0	0	103.5	T336	T336-L338 HydrophobicContact CG2-CD2 4.36Å; T336-L338 HydrophobicContact CG2-CG 3.89Å; T336-L338 PolarHBondContact O-N 3.46Å
339	S	32.5	Very low	34.2	Very low	85 Å²	85	101 Å²	101	59%	0.594	66%	0.661	S	S	*	*			trans	-31.2	145.3	151.7	-74.9	0	0	0	0	109.3	A337 T341	A337-S339 VanDerWaalsContact C-N 3.33Å; A337-S339 PolarHBondContact O-N 3.4Å; A337-S339 VanDerWaalsContact O-N 3.17Å; S339-T341 VanDerWaalsContact CB-OG1 3.3Å; S339-T341 WeakPolarHBondContact CB-OG1 3.47Å; S339-T341 PolarHBondContact O-N 3.16Å; S339-T341 PolarHBondContact O-OG1 3.09Å; S339-T341 VanDerWaalsContact O-OG1 3.05Å
340	A	35.6	Very low	33.8	Very low	88 Å²	88	105.9 Å²	105.9	73%	0.727	68%	0.675	S	S	*	*	S	Bend	trans	-64.7	54.6	172.4	0	0	0	0	0	112	K106	K106-A340 PolarHBondContact NZ-O 2.92Å
341	T	36.5	Very low	33.3	Very low	87 Å²	87	109.1 Å²	109.1	53%	0.534	69%	0.688	S	S	.	*			trans	-121.8	120.9	-175.1	47.4	0	0	0	0	105.9	S339	S339-T341 VanDerWaalsContact CB-OG1 3.3Å; S339-T341 WeakPolarHBondContact CB-OG1 3.47Å; S339-T341 PolarHBondContact O-N 3.16Å; S339-T341 PolarHBondContact O-OG1 3.09Å; S339-T341 VanDerWaalsContact O-OG1 3.05Å
342	S	37.9	Very low	33	Very low	104 Å²	104	110.2 Å²	110.2	73%	0.727	71%	0.705	S	S	*	*			trans	65.6	75.8	175	75.1	0	0	0	0	117.6
343	V	29.8	Very low	32.7	Very low	112 Å²	112	114.2 Å²	114.2	68%	0.679	71%	0.714	S	S	*	*			trans	-118.4	81	130.1	-169.5	0	0	0	0	106.6	L345	V343-L345 PolarHBondContact O-N 3.36Å
344	S	28.5	Very low	32.3	Very low	85 Å²	85	122.1 Å²	122.1	59%	0.594	73%	0.729	S	S	*	*			trans	-64.6	111.2	172.8	-51	0	0	0	0	108.3	T346	S344-T346 PolarHBondContact O-N 3.36Å
345	L	33.5	Very low	32.1	Very low	152 Å²	152	129.5 Å²	129.5	80%	0.796	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	10	179.3	-75.5	167.3	0	0	0	114.1	V343	V343-L345 PolarHBondContact O-N 3.36Å
346	T	33	Very low	31.8	Very low	114 Å²	114	135.7 Å²	135.7	70%	0.699	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.6	-0.3	-171.5	32.2	0	0	0	0	115.4	S344	S344-T346 PolarHBondContact O-N 3.36Å
347	S	31.3	Very low	31.7	Very low	103 Å²	103	136.1 Å²	136.1	72%	0.72	77%	0.773	S	S	*	*	S	Bend	trans	-94.4	-2.9	-176.7	-171.6	0	0	0	0	115.7
348	C	31.3	Very low	31.5	Very low	125 Å²	125	138 Å²	138	85%	0.845	77%	0.774	S	S	*	*	S	Bend	trans	-100.1	8.2	-173	-62.7	0	0	0	0	115.3
349	C	34.8	Very low	31.8	Very low	120 Å²	120	136.8 Å²	136.8	81%	0.811	78%	0.775	S	S	*	*			trans	-124.1	32	-173.4	-62.2	0	0	0	0	114.5
350	Q	31.3	Very low	31.6	Very low	176 Å²	176	138.5 Å²	138.5	82%	0.822	79%	0.787	S	S	*	*	S	Bend	trans	-120.2	66.3	169.2	-71.6	-173.2	7.5	0	0	110.5
351	E	28.2	Very low	31.3	Very low	196 Å²	196	138.1 Å²	138.1	92%	0.916	79%	0.792	S	S	*	*			trans	-177.6	78.3	152.7	-105.1	155.9	179.4	0	0	109.4
352	A	31	Very low	31	Very low	106 Å²	106	137.5 Å²	137.5	88%	0.876	80%	0.802	S	S	*	*			trans	-141.9	52.8	163.7	0	0	0	0	0	109.9
353	E	29.8	Very low	31.1	Very low	180 Å²	180	142 Å²	142	84%	0.841	81%	0.814	S	S	*	*			trans	-101.5	125.7	155.1	-75.7	-151.6	160.5	0	0	110
354	R	30.7	Very low	31.5	Very low	233 Å²	233	147.7 Å²	147.7	88%	0.879	82%	0.823	S	S	*	*			trans	56	103	158.9	-71	-178.8	170.8	175.9	-0.9	118.3
355	R	26.7	Very low	32	Very low	248 Å²	248	149.1 Å²	149.1	94%	0.936	83%	0.833	S	S	*	*				-160.5	114.1	119.7	-115.3	175.3	-172.9	-178.2	2.8	111.8
356	E	28.9	Very low	32.3	Very low	193 Å²	193	151.7 Å²	151.7	90%	0.902	84%	0.839	S	S	*	*			trans	-63.1	130.9	162.4	-65.7	171.6	149.4	0	0	110
357	S	29.2	Very low	32.9	Very low	113 Å²	113	153.2 Å²	153.2	79%	0.79	84%	0.841	S	S	*	*			trans	-171	110.3	145.1	56.4	0	0	0	0	110.7
358	V	29.6	Very low	33.1	Very low	137 Å²	137	152.3 Å²	152.3	83%	0.83	83%	0.833	S	S	*	*			trans	-64	141.1	157.8	179.3	0	0	0	0	106.6
359	P	38.2	Very low	33.9	Very low	115 Å²	115	158.1 Å²	158.1	75%	0.747	84%	0.837	S	S	*	*				-154.4	157.1	69.5	39.7	-16.8	0	0	0	120.7
360	S	28.7	Very low	34.4	Very low	122 Å²	122	157.5 Å²	157.5	85%	0.853	83%	0.834	S	S	*	*			trans	66.2	120.3	133.5	-159.7	0	0	0	0	121.1
361	G	28.8	Very low	34.8	Very low	80 Å²	80	156.4 Å²	156.4	83%	0.825	83%	0.831	S	S	*	*			trans	122.2	97.1	133.6	0	0	0	0	0	116.2
362	G	30.3	Very low	35.5	Very low	74 Å²	74	151 Å²	151	76%	0.763	82%	0.82	S	S	*	*			trans	136.6	102.5	153.8	0	0	0	0	0	114.6	R364	G362-R364 PolarHBondContact O-N 2.99Å; G362-R364 VanDerWaalsContact O-N 3.1Å
363	M	40.4	Very low	36	Very low	198 Å²	198	154.4 Å²	154.4	98%	0.975	82%	0.817	S	S	*	*			trans	-51.7	115.5	165	-91.5	101.3	77	0	0	110.4
364	R	37	Very low	36.7	Very low	231 Å²	231	157 Å²	157	87%	0.872	82%	0.819	S	S	*	*			trans	-124.3	121.1	150.2	-72.7	-170.7	176.3	-167.7	0	107.4	G362 F366	G362-R364 PolarHBondContact O-N 2.99Å; G362-R364 VanDerWaalsContact O-N 3.1Å; R364-F366 PolarHBondContact O-N 3.4Å
365	S	39	Very low	37	Very low	115 Å²	115	153.7 Å²	153.7	80%	0.804	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-49.8	122.6	-179.4	39.9	0	0	0	0	111.6	I367	S365-I367 PolarHBondContact O-N 3.04Å
366	F	39.3	Very low	37.5	Very low	207 Å²	207	146 Å²	146	91%	0.908	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-65.6	119.7	165.9	-72.3	-88.6	0	0	0	108.7	R364	R364-F366 PolarHBondContact O-N 3.4Å
367	I	46.2	Very low	37.9	Very low	145 Å²	145	144.8 Å²	144.8	74%	0.744	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-79.8	123.6	159.2	-60.1	174.1	0	0	0	105.9	S365 R369	S365-I367 PolarHBondContact O-N 3.04Å; I367-R369 PolarHBondContact O-N 2.89Å
368	P	36	Very low	38.2	Very low	85 Å²	85	147.7 Å²	147.7	55%	0.552	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-62.9	132.1	178.2	23.1	-30.2	0	0	0	110.5	S370	P368-S370 PolarHBondContact O-N 3.41Å
369	R	48.4	Very low	38.6	Very low	247 Å²	247	145.7 Å²	145.7	93%	0.932	79%	0.79	S	S	*	*	G	3₁₀ helix	trans	-65.9	5.9	-179	-77.9	-176.9	168.3	-171.1	-3.2	114.8	I367	I367-R369 PolarHBondContact O-N 2.89Å
370	S	44.3	Very low	38.7	Very low	107 Å²	107	146.3 Å²	146.3	75%	0.748	80%	0.797	S	S	*	*	G	3₁₀ helix	trans	-85.7	-2.6	178.7	57.6	0	0	0	0	114.4	P368	P368-S370 PolarHBondContact O-N 3.41Å
371	M	40.8	Very low	39.3	Very low	153 Å²	153	143.6 Å²	143.6	75%	0.754	79%	0.788	S	S	*	*	G	3₁₀ helix	trans	-107.8	10.8	179.5	-67	-161.8	73.9	0	0	114.8	H373	M371-H373 VanDerWaalsContact C-N 3.33Å; M371-H373 PolarHBondContact O-N 3.24Å
372	A	43	Very low	39.9	Very low	83 Å²	83	143.2 Å²	143.2	69%	0.686	77%	0.772	S	S	*	*			trans	-79.7	85.6	168.2	0	0	0	0	0	109	R374	A372-R374 PolarHBondContact O-N 2.94Å; A372-R374 VanDerWaalsContact O-N 3.11Å
373	H	40.5	Very low	40.5	Very low	177 Å²	177	147.2 Å²	147.2	82%	0.819	77%	0.774	S	S	*	*			trans	-56.9	118.7	164.5	-91.6	-87.4	0	0	0	108.9	M371 N375	M371-H373 VanDerWaalsContact C-N 3.33Å; M371-H373 PolarHBondContact O-N 3.24Å; H373-N375 PolarHBondContact O-N 3.47Å
374	R	45.2	Very low	40.3	Very low	234 Å²	234	142.5 Å²	142.5	88%	0.883	76%	0.759	S	S	*	*	S	Bend	trans	-61.4	92.4	176.9	-66.8	170.7	165.7	173.7	-5.6	109.8	A372	A372-R374 PolarHBondContact O-N 2.94Å; A372-R374 VanDerWaalsContact O-N 3.11Å
375	N	36.7	Very low	40.2	Very low	163 Å²	163	141 Å²	141	87%	0.872	76%	0.758	S	S	*	*			trans	-155.6	6.3	160.5	-89.2	-21.7	0	0	0	112.8	H373	H373-N375 PolarHBondContact O-N 3.47Å
376	S	37.3	Very low	40.5	Very low	88 Å²	88	142.1 Å²	142.1	62%	0.615	75%	0.754	S	S	*	*			trans	-92.9	108.1	173	64	0	0	0	0	109.9	F378	S376-F378 PolarHBondContact O-N 2.93Å
377	I	37.9	Very low	40.4	Very low	167 Å²	167	140.2 Å²	140.2	86%	0.856	75%	0.748	S	S	*	*			trans	-74.5	72.5	163.7	-54.1	163.2	0	0	0	106.2	P379	I377-P379 WeakPolarHBondContact O-CD 3.35Å
378	F	34.9	Very low	40.2	Very low	173 Å²	173	139.2 Å²	139.2	76%	0.759	75%	0.748	S	S	*	*			trans	-89.5	112.2	155.3	-83.6	-77.9	0	0	0	105.8	S376 S380	S376-F378 PolarHBondContact O-N 2.93Å; F378-S380 VanDerWaalsContact C-N 3.27Å; F378-S380 PolarHBondContact O-N 3.32Å
379	P	36.8	Very low	40.7	Very low	96 Å²	96	141 Å²	141	62%	0.623	76%	0.758	S	S	*	*			trans	-63.9	98.7	168.2	26.6	-30.1	0	0	0	106.7	I377 G381	I377-P379 WeakPolarHBondContact O-CD 3.35Å; P379-G381 VanDerWaalsContact C-N 3.33Å; P379-G381 PolarHBondContact O-N 3.36Å
380	S	40.3	Very low	40.6	Very low	127 Å²	127	138.4 Å²	138.4	89%	0.888	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	96.6	171.1	50.3	0	0	0	0	107.6	F378	F378-S380 VanDerWaalsContact C-N 3.27Å; F378-S380 PolarHBondContact O-N 3.32Å
381	G	41.3	Very low	40.5	Very low	65 Å²	65	138.1 Å²	138.1	67%	0.67	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	146.1	-14	166.4	0	0	0	0	0	117.6	P379	P379-G381 VanDerWaalsContact C-N 3.33Å; P379-G381 PolarHBondContact O-N 3.36Å
382	C	43	Very low	41	Very low	72 Å²	72	134.7 Å²	134.7	49%	0.486	76%	0.755	S	S	.	*			trans	-133.8	78	179.5	-80.9	0	0	0	0	110.7	P384	C382-P384 WeakPolarHBondContact O-CD 3.23Å
383	I	41.6	Very low	41.5	Very low	159 Å²	159	138.5 Å²	138.5	82%	0.815	76%	0.759	S	S	*	*			trans	-78.9	114.5	160.9	-61.7	168.3	0	0	0	105.4	K385	I383-K385 PolarHBondContact O-N 2.93Å
384	P	36.3	Very low	42.4	Very low	99 Å²	99	135.8 Å²	135.8	64%	0.643	76%	0.757	S	S	*	*			trans	-57.6	130.2	174.2	23.4	-31.4	0	0	0	108.3	C382 I386	C382-P384 WeakPolarHBondContact O-CD 3.23Å; P384-I386 PolarHBondContact O-N 3.1Å
385	K	36.3	Very low	42.6	Very low	198 Å²	198	130.7 Å²	130.7	86%	0.861	75%	0.752	S	S	*	*			trans	-65.2	101	171.1	-85.6	-179.7	177.2	175.4	0	107.5	I383 E387	I383-K385 PolarHBondContact O-N 2.93Å; K385-E387 PolarHBondContact O-N 3.47Å; K385-E387 VanDerWaalsContact O-N 3.16Å
386	I	44.1	Very low	43.3	Very low	140 Å²	140	128.8 Å²	128.8	72%	0.718	75%	0.748	S	S	*	*			trans	-76.4	101.7	172.1	-57.1	172.5	0	0	0	106.6	P384 V388	P384-I386 PolarHBondContact O-N 3.1Å; I386-V388 HydrophobicContact CG2-CG2 3.92Å; I386-V388 PolarHBondContact O-N 2.89Å; I386-V388 VanDerWaalsContact O-N 3.14Å
387	E	37.1	Very low	44	Very low	167 Å²	167	134 Å²	134	78%	0.78	76%	0.76	S	S	*	*			trans	-75.5	98.2	168.8	-71.3	-170.2	172.9	0	0	108.8	K385 T389	K385-E387 PolarHBondContact O-N 3.47Å; K385-E387 VanDerWaalsContact O-N 3.16Å; E387-T389 PolarHBondContact O-N 3.4Å; E387-T389 VanDerWaalsContact O-N 3.11Å
388	V	43.3	Very low	44.3	Very low	123 Å²	123	135.8 Å²	135.8	75%	0.745	76%	0.762	S	S	*	*			trans	-78.1	93.8	173.2	-177.1	0	0	0	0	108	I386 K390	I386-V388 HydrophobicContact CG2-CG2 3.92Å; I386-V388 PolarHBondContact O-N 2.89Å; I386-V388 VanDerWaalsContact O-N 3.14Å; V388-K390 PolarHBondContact O-N 2.96Å
389	T	45	Very low	44.8	Very low	123 Å²	123	136.2 Å²	136.2	76%	0.755	77%	0.766	S	S	*	*			trans	-71.8	112.1	167	52	0	0	0	0	108.2	E387 S391	E387-T389 PolarHBondContact O-N 3.4Å; E387-T389 VanDerWaalsContact O-N 3.11Å; T389-S391 PolarHBondContact O-N 3.4Å
390	K	46.6	Very low	45.2	Very low	192 Å²	192	141.4 Å²	141.4	84%	0.835	78%	0.778	S	S	*	*			trans	-63.7	122.8	166.5	-94.6	178.3	175.9	172.8	0	107.3	V388 G392	V388-K390 PolarHBondContact O-N 2.96Å; K390-G392 PolarHBondContact O-N 3.36Å
391	S	43.3	Very low	45.2	Very low	102 Å²	102	144.1 Å²	144.1	71%	0.713	77%	0.774	S	S	*	*			trans	-47.7	124.6	167.6	54.8	0	0	0	0	109.4	T389 E393	T389-S391 PolarHBondContact O-N 3.4Å; S391-E393 PolarHBondContact O-N 3.33Å; S391-E393 VanDerWaalsContact O-N 3.08Å
392	G	51	Low	45.4	Very low	81 Å²	81	150.3 Å²	150.3	84%	0.835	78%	0.783	S	S	*	*	S	Bend	trans	-68.4	-1.7	-175.4	0	0	0	0	0	114.9	K390	K390-G392 PolarHBondContact O-N 3.36Å
393	E	53.7	Low	45.3	Very low	163 Å²	163	156.6 Å²	156.6	76%	0.762	80%	0.802	S	S	*	*	S	Bend	trans	-76.2	123.2	174.6	-64.9	-173.8	174.4	0	0	109.8	S391 T395	S391-E393 PolarHBondContact O-N 3.33Å; S391-E393 VanDerWaalsContact O-N 3.08Å; E393-T395 PolarHBondContact O-N 3.1Å; E393-T395 VanDerWaalsContact O-N 3.12Å
394	P	59	Low	45.4	Very low	119 Å²	119	159.6 Å²	159.6	77%	0.773	80%	0.803	S	S	*	*			trans	-57.7	124.7	175.1	23.4	-30.9	0	0	0	108
395	T	48.8	Very low	46	Very low	127 Å²	127	164 Å²	164	78%	0.779	82%	0.815	S	S	*	*			trans	-45.4	121.5	172.6	9.7	0	0	0	0	107.6	E393 K397	E393-T395 PolarHBondContact O-N 3.1Å; E393-T395 VanDerWaalsContact O-N 3.12Å; T395-K397 PolarHBondContact O-N 3.38Å
396	P	52.7	Low	46.6	Very low	123 Å²	123	164.2 Å²	164.2	80%	0.799	82%	0.816	S	S	*	*			trans	-55.6	114.3	-178.6	18.1	-29.1	0	0	0	107.2	K398	P396-K398 PolarHBondContact O-N 3.47Å
397	K	50.3	Low	47	Very low	199 Å²	199	161 Å²	161	87%	0.865	82%	0.817	S	S	*	*			trans	-55.2	115.5	179.7	-74.7	178.4	179.8	172.2	0	105.6	T395 E399	T395-K397 PolarHBondContact O-N 3.38Å; K397-E399 PolarHBondContact O-N 3.28Å
398	K	45.3	Very low	47.5	Very low	204 Å²	204	163.1 Å²	163.1	89%	0.887	82%	0.82	S	S	*	*			trans	-44.4	110.1	172.1	-98.1	179.1	174.6	172.4	0	107.2	P396 K400	P396-K398 PolarHBondContact O-N 3.47Å; K398-K400 PolarHBondContact O-N 3.49Å
399	E	44.7	Very low	48.1	Very low	182 Å²	182	165.6 Å²	165.6	85%	0.85	83%	0.828	S	S	*	*			trans	-53	119.1	167	-75.6	-169.1	155.4	0	0	106	K397 K401	K397-E399 PolarHBondContact O-N 3.28Å; E399-K401 PolarHBondContact O-N 2.97Å
400	K	44.7	Very low	48.4	Very low	204 Å²	204	167.4 Å²	167.4	89%	0.887	83%	0.828	S	S	*	*			trans	-63.6	91.7	172	-75.1	-179	179.5	174.9	0	106	K398 K402	K398-K400 PolarHBondContact O-N 3.49Å; K400-K402 PolarHBondContact O-N 2.75Å
401	K	42.1	Very low	48.8	Very low	184 Å²	184	163.3 Å²	163.3	80%	0.8	82%	0.821	S	S	*	*			trans	-47.7	118.1	166.6	-80.1	-175.6	174.7	177.1	0	106.2	E399 K403	E399-K401 PolarHBondContact O-N 2.97Å; K401-K403 PolarHBondContact O-N 2.95Å
402	K	43.9	Very low	49.4	Very low	195 Å²	195	163.7 Å²	163.7	85%	0.848	82%	0.821	S	S	*	*			trans	-43.2	129.8	170.6	-77.1	178.6	175.7	176.4	0	107.2	K400 R404	K400-K402 PolarHBondContact O-N 2.75Å; K402-R404 VanDerWaalsContact C-N 3.35Å; K402-R404 PolarHBondContact O-N 3.01Å
403	K	42.5	Very low	49.7	Very low	205 Å²	205	164.8 Å²	164.8	89%	0.891	81%	0.807	S	S	*	*			trans	-43.6	98.3	-179.7	-87.9	175.5	173.5	170.8	0	109.2	K401 Q405	K401-K403 PolarHBondContact O-N 2.95Å; K403-Q405 PolarHBondContact O-N 2.89Å
404	R	42.6	Very low	50.2	Low	222 Å²	222	164.7 Å²	164.7	84%	0.838	80%	0.799	S	S	*	*			trans	-61.4	135.5	159.8	-70.5	179.2	79.2	-174.6	6.3	105	K402 K406	K402-R404 VanDerWaalsContact C-N 3.35Å; K402-R404 PolarHBondContact O-N 3.01Å; R404-K406 PolarHBondContact O-N 2.79Å
405	Q	49	Very low	50.7	Low	192 Å²	192	167.5 Å²	167.5	90%	0.897	80%	0.799	S	S	*	*			trans	-40.5	132.6	-178.4	-73	165	-24.7	0	0	110.3	K403 G407	K403-Q405 PolarHBondContact O-N 2.89Å; Q405-G407 PolarHBondContact O-N 2.81Å
406	K	49.3	Very low	51.7	Low	201 Å²	201	168.2 Å²	168.2	87%	0.874	79%	0.789	S	S	*	*			trans	-61.8	82.5	174.2	-84.1	179.1	168.8	-176	0	108.9	R404	R404-K406 PolarHBondContact O-N 2.79Å
407	G	52.5	Low	52.7	Low	73 Å²	73	167.3 Å²	167.3	75%	0.753	77%	0.772	S	S	*	*			trans	-108.9	69.1	160.2	0	0	0	0	0	107.2	Q405	Q405-G407 PolarHBondContact O-N 2.81Å
408	Y	47.7	Very low	53.9	Low	212 Å²	212	162.6 Å²	162.6	83%	0.831	75%	0.753	S	S	*	*			trans	-94	127.1	162	-80	-80.4	0	0	0	107	E410	Y408-E410 PolarHBondContact O-N 3.5Å
409	L	54.8	Low	55.5	Low	175 Å²	175	155 Å²	155	92%	0.916	73%	0.729	S	S	*	*			trans	-34.1	104.3	156.5	-71.9	145.9	0	0	0	109.4
410	E	53	Low	57.1	Low	160 Å²	160	153.8 Å²	153.8	75%	0.748	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-64.3	133.6	167.2	-66.9	-177.5	165.7	0	0	107.1	Y408	Y408-E410 PolarHBondContact O-N 3.5Å
411	P	54.5	Low	58.9	Low	107 Å²	107	149.4 Å²	149.4	70%	0.695	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-54.6	134.6	174.7	22.1	-30.6	0	0	0	108.3	I413	P411-I413 PolarHBondContact O-N 3.06Å
412	P	55.3	Low	61	Low	110 Å²	110	146.7 Å²	146.7	71%	0.714	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-56.1	122.6	-174.6	21.5	-32	0	0	0	109.1	W414	P412-W414 PolarHBondContact O-N 3.35Å
413	I	56.8	Low	62.9	Low	104 Å²	104	144.7 Å²	144.7	53%	0.533	69%	0.685	S	S	.	*			trans	-64.2	112.1	176.4	-55.7	170.3	0	0	0	106.1	P411 K415 E418	P411-I413 PolarHBondContact O-N 3.06Å; I413-K415 PolarHBondContact O-N 3.19Å; I413-K415 VanDerWaalsContact O-N 3.08Å; I413-E418 HydrophobicContact CG2-CG 3.61Å; I413-E418 VanDerWaalsContact CG2-OE1 3.28Å; I413-E418 WeakPolarHBondContact CG2-OE1 3.46Å
414	W	64.3	Low	65	Low	161 Å²	161	141.6 Å²	141.6	61%	0.61	67%	0.671	S	S	*	*			trans	-62	117.3	177	-81	-67.1	0	0	0	109	P412 Y416 K417	P412-W414 PolarHBondContact O-N 3.35Å; W414-Y416 HydrophobicContact CB-CD1 3.46Å; W414-Y416 VanDerWaalsContact CB-CD1 3.46Å; W414-Y416 HydrophobicContact CB-CE1 3.32Å; W414-Y416 HydrophobicContact CB-CG 4.46Å; W414-Y416 HydrophobicContact CD2-CE1 4.04Å; W414-Y416 HydrophobicContact CG-CD1 4.02Å; W414-Y416 AromaticContact CG-CE1 3.54Å; W414-Y416 HydrophobicContact CG-CE1 3.54Å; W414-Y416 PolarHBondContact O-N 3.39Å; W414-K417 WeakPolarHBondContact O-CB 3.45Å; W414-K417 PolarHBondContact O-N 2.73Å
415	K	69.4	Low	67.2	Low	177 Å²	177	138.7 Å²	138.7	77%	0.77	66%	0.66	S	S	*	*	H	α-helix	trans	-48.6	-26.5	-179.8	-67.5	-174.4	175	-175.5	0	114.1	I413 A419	I413-K415 PolarHBondContact O-N 3.19Å; I413-K415 VanDerWaalsContact O-N 3.08Å; K415-A419 WeakPolarHBondContact O-CB 3.38Å; K415-A419 PolarHBondContact O-N 3.48Å
416	Y	70.9	Confident	69.1	Low	142 Å²	142	135.2 Å²	135.2	56%	0.557	64%	0.644	S	S	*	*	H	α-helix	trans	-70.2	-29.7	176	82.7	-97.6	0	0	0	113.5	W414 K420	W414-Y416 HydrophobicContact CB-CD1 3.46Å; W414-Y416 VanDerWaalsContact CB-CD1 3.46Å; W414-Y416 HydrophobicContact CB-CE1 3.32Å; W414-Y416 HydrophobicContact CB-CG 4.46Å; W414-Y416 HydrophobicContact CD2-CE1 4.04Å; W414-Y416 HydrophobicContact CG-CD1 4.02Å; W414-Y416 AromaticContact CG-CE1 3.54Å; W414-Y416 HydrophobicContact CG-CE1 3.54Å; W414-Y416 PolarHBondContact O-N 3.39Å; Y416-K420 VanDerWaalsContact O-CB 3.27Å; Y416-K420 WeakPolarHBondContact O-CB 3.37Å; Y416-K420 PolarHBondContact O-N 3.16Å
417	K	73.1	Confident	71	Confident	105 Å²	105	132 Å²	132	46%	0.457	63%	0.63	S	S	.	*	H	α-helix	trans	-72.1	-41.4	176.8	-72.9	-173.2	178	178.1	0	110.8	W414 K420 E421	W414-K417 WeakPolarHBondContact O-CB 3.45Å; W414-K417 PolarHBondContact O-N 2.73Å; K417-K420 PolarHBondContact O-N 3.46Å; K417-E421 PolarHBondContact O-N 2.83Å
418	E	76.5	Confident	72.7	Confident	99 Å²	99	134.6 Å²	134.6	46%	0.463	62%	0.621	S	S	.	*	H	α-helix	trans	-62.3	-49.8	173.4	-70.6	175.1	163.8	0	0	111.2	I413 K420 E421 E422	I413-E418 HydrophobicContact CG2-CG 3.61Å; I413-E418 VanDerWaalsContact CG2-OE1 3.28Å; I413-E418 WeakPolarHBondContact CG2-OE1 3.46Å; E418-K420 PolarHBondContact O-N 3.18Å; E418-E421 PolarHBondContact O-N 3.19Å; E418-E421 VanDerWaalsContact O-N 3.08Å; E418-E422 WeakPolarHBondContact O-CB 3.22Å; E418-E422 PolarHBondContact O-N 3.45Å
419	A	77.4	Confident	74.6	Confident	45 Å²	45	132.7 Å²	132.7	37%	0.372	61%	0.612	S	S	.	*	H	α-helix	trans	-60.6	-31.3	177.3	0	0	0	0	0	113	K415 K423	K415-A419 WeakPolarHBondContact O-CB 3.38Å; K415-A419 PolarHBondContact O-N 3.48Å; A419-K423 WeakPolarHBondContact O-CB 3.47Å; A419-K423 WeakPolarHBondContact O-CG 3.45Å; A419-K423 PolarHBondContact O-N 3.11Å; A419-K423 VanDerWaalsContact O-N 3.15Å
420	K	79.4	Confident	76.1	Confident	157 Å²	157	129 Å²	129	68%	0.683	59%	0.593	S	S	*	*	H	α-helix	trans	-74.4	-38.3	175.6	-170.1	176.5	-176.9	177.9	0	112	Y416 K417 E418 K424	Y416-K420 VanDerWaalsContact O-CB 3.27Å; Y416-K420 WeakPolarHBondContact O-CB 3.37Å; Y416-K420 PolarHBondContact O-N 3.16Å; K417-K420 PolarHBondContact O-N 3.46Å; E418-K420 PolarHBondContact O-N 3.18Å; K420-K424 WeakPolarHBondContact O-CB 3.32Å; K420-K424 PolarHBondContact O-N 2.85Å; K420-K424 VanDerWaalsContact O-N 3.13Å
421	E	82.3	Confident	77.7	Confident	111 Å²	111	126.3 Å²	126.3	52%	0.519	58%	0.58	S	S	.	*	H	α-helix	trans	-67.5	-41.9	173.8	-77.3	-129.4	158.3	0	0	112	K417 E418 K424 R425	K417-E421 PolarHBondContact O-N 2.83Å; E418-E421 PolarHBondContact O-N 3.19Å; E418-E421 VanDerWaalsContact O-N 3.08Å; E421-K424 CarbonylContact O-C 3.56Å; E421-K424 WeakPolarHBondContact O-CA 3.29Å; E421-K424 WeakPolarHBondContact O-CB 3.33Å; E421-K424 PolarHBondContact O-N 3.09Å; E421-K424 VanDerWaalsContact O-N 3.12Å; E421-R425 WeakPolarHBondContact O-CG 3.47Å; E421-R425 PolarHBondContact O-N 2.87Å; E421-R425 IonicContact OE2-CZ 3.27Å; E421-R425 IonicContact OE2-NE 3.94Å; E421-R425 IonicContact OE2-NH2 2.75Å; E421-R425 PolarHBondContact OE2-NH2 2.99Å
422	E	85.1	Confident	79.1	Confident	127 Å²	127	126.8 Å²	126.8	59%	0.593	57%	0.573	S	S	*	*	H	α-helix	trans	-63.2	-48	179.2	-164.8	170.6	-157.1	0	0	111	E418 K424 R425 E426	E418-E422 WeakPolarHBondContact O-CB 3.22Å; E418-E422 PolarHBondContact O-N 3.45Å; E422-K424 PolarHBondContact O-N 3.4Å; E422-R425 PolarHBondContact O-N 3.47Å; E422-E426 PolarHBondContact O-N 3.34Å
423	K	84.9	Confident	80.5	Confident	154 Å²	154	126.7 Å²	126.7	67%	0.67	56%	0.563	S	S	*	*	H	α-helix	trans	-57.6	-35.6	171.2	-77.7	-176.8	177.8	-175.7	0	113	A419 K427	A419-K423 WeakPolarHBondContact O-CB 3.47Å; A419-K423 WeakPolarHBondContact O-CG 3.45Å; A419-K423 PolarHBondContact O-N 3.11Å; A419-K423 VanDerWaalsContact O-N 3.15Å; K423-K427 WeakPolarHBondContact O-CB 3.49Å; K423-K427 PolarHBondContact O-N 3.44Å
424	K	87.1	Confident	81.7	Confident	139 Å²	139	128.1 Å²	128.1	60%	0.604	57%	0.565	S	S	*	*	H	α-helix	trans	-71.7	-35.8	177.2	-168.5	177.3	-178.8	-178.1	0	111.6	K420 E421 E422 K428	K420-K424 WeakPolarHBondContact O-CB 3.32Å; K420-K424 PolarHBondContact O-N 2.85Å; K420-K424 VanDerWaalsContact O-N 3.13Å; E421-K424 CarbonylContact O-C 3.56Å; E421-K424 WeakPolarHBondContact O-CA 3.29Å; E421-K424 WeakPolarHBondContact O-CB 3.33Å; E421-K424 PolarHBondContact O-N 3.09Å; E421-K424 VanDerWaalsContact O-N 3.12Å; E422-K424 PolarHBondContact O-N 3.4Å; K424-K428 WeakPolarHBondContact O-CG 3.32Å; K424-K428 PolarHBondContact O-N 3.06Å; K424-K428 VanDerWaalsContact O-N 3.15Å
425	R	88.6	Confident	82.6	Confident	162 Å²	162	126.2 Å²	126.2	61%	0.611	56%	0.563	S	S	*	*	H	α-helix	trans	-71.2	-43.3	175.5	-71.1	176.9	-165.3	-174.1	5.7	111.5	E421 E422 K428 R429	E421-R425 WeakPolarHBondContact O-CG 3.47Å; E421-R425 PolarHBondContact O-N 2.87Å; E421-R425 IonicContact OE2-CZ 3.27Å; E421-R425 IonicContact OE2-NE 3.94Å; E421-R425 IonicContact OE2-NH2 2.75Å; E421-R425 PolarHBondContact OE2-NH2 2.99Å; E422-R425 PolarHBondContact O-N 3.47Å; R425-K428 PolarHBondContact O-N 3.12Å; R425-R429 WeakPolarHBondContact O-CG 3.42Å; R425-R429 PolarHBondContact O-N 3.12Å
426	E	88.6	Confident	83.1	Confident	118 Å²	118	122 Å²	122	55%	0.551	55%	0.549	S	S	*	.	H	α-helix	trans	-60.1	-45.6	173.5	-76.3	-174.7	153.4	0	0	111.7	E422 K428 R429 L430	E422-E426 PolarHBondContact O-N 3.34Å; E426-K428 VanDerWaalsContact C-N 3.29Å; E426-K428 PolarHBondContact O-N 3.13Å; E426-R429 PolarHBondContact O-N 3.44Å; E426-R429 VanDerWaalsContact O-N 3.16Å; E426-L430 WeakPolarHBondContact O-CG 3.23Å; E426-L430 PolarHBondContact O-N 3.4Å
427	K	88.5	Confident	83.4	Confident	133 Å²	133	120.2 Å²	120.2	58%	0.578	55%	0.546	S	S	*	.	H	α-helix	trans	-58.8	-42	176.3	-171	177.6	177.9	-176.6	0	111.9	K423 L430 E431	K423-K427 WeakPolarHBondContact O-CB 3.49Å; K423-K427 PolarHBondContact O-N 3.44Å; K427-L430 PolarHBondContact O-N 3.4Å; K427-E431 WeakPolarHBondContact CE-OE1 3.47Å; K427-E431 WeakPolarHBondContact O-CG 3.4Å; K427-E431 PolarHBondContact O-N 3.26Å
428	K	88.8	Confident	83.5	Confident	128 Å²	128	122.6 Å²	122.6	56%	0.557	56%	0.556	S	S	*	*	H	α-helix	trans	-65.3	-40.7	175.4	-77.8	-175.9	173.3	-165.1	0	112.8	K424 R425 E426 E431 Q432	K424-K428 WeakPolarHBondContact O-CG 3.32Å; K424-K428 PolarHBondContact O-N 3.06Å; K424-K428 VanDerWaalsContact O-N 3.15Å; R425-K428 PolarHBondContact O-N 3.12Å; E426-K428 VanDerWaalsContact C-N 3.29Å; E426-K428 PolarHBondContact O-N 3.13Å; K428-E431 PolarHBondContact O-N 3.09Å; K428-Q432 WeakPolarHBondContact O-CB 3.23Å; K428-Q432 PolarHBondContact O-N 3.12Å
429	R	87.8	Confident	83.4	Confident	173 Å²	173	124.3 Å²	124.3	65%	0.653	56%	0.564	S	S	*	*	H	α-helix	trans	-63.2	-42.8	175.7	-71.5	-176.9	95	-146.1	4.7	111.4	R425 E426 E431 Q432 E433	R425-R429 WeakPolarHBondContact O-CG 3.42Å; R425-R429 PolarHBondContact O-N 3.12Å; E426-R429 PolarHBondContact O-N 3.44Å; E426-R429 VanDerWaalsContact O-N 3.16Å; R429-E431 VanDerWaalsContact C-N 3.33Å; R429-E431 PolarHBondContact O-N 3.44Å; R429-Q432 PolarHBondContact O-N 3.39Å; R429-E433 WeakPolarHBondContact O-CG 3.5Å; R429-E433 PolarHBondContact O-N 3.11Å
430	L	85.9	Confident	83	Confident	97 Å²	97	124.7 Å²	124.7	51%	0.508	56%	0.564	S	S	.	*	H	α-helix	trans	-65.6	-34.3	175.9	-71.5	170.4	0	0	0	112.9	E426 K427 K434	E426-L430 WeakPolarHBondContact O-CG 3.23Å; E426-L430 PolarHBondContact O-N 3.4Å; K427-L430 PolarHBondContact O-N 3.4Å; L430-K434 WeakPolarHBondContact O-CB 3.48Å; L430-K434 WeakPolarHBondContact O-CG 3.45Å; L430-K434 PolarHBondContact O-N 2.73Å
431	E	86	Confident	82.4	Confident	103 Å²	103	123.4 Å²	123.4	48%	0.481	56%	0.558	S	S	.	*	H	α-helix	trans	-67.6	-42	172.7	-79.2	171.2	-176.1	0	0	111.2	K427 K428 R429 K434 E435	K427-E431 WeakPolarHBondContact CE-OE1 3.47Å; K427-E431 WeakPolarHBondContact O-CG 3.4Å; K427-E431 PolarHBondContact O-N 3.26Å; K428-E431 PolarHBondContact O-N 3.09Å; R429-E431 VanDerWaalsContact C-N 3.33Å; R429-E431 PolarHBondContact O-N 3.44Å; E431-K434 PolarHBondContact O-N 2.91Å; E431-E435 PolarHBondContact O-N 2.55Å
432	Q	85.2	Confident	81.5	Confident	118 Å²	118	120 Å²	120	55%	0.551	55%	0.553	S	S	*	*	H	α-helix	trans	-68.7	-42.8	179.3	-161	165.1	5.3	0	0	112.4	K428 R429 K434 E435 D436	K428-Q432 WeakPolarHBondContact O-CB 3.23Å; K428-Q432 PolarHBondContact O-N 3.12Å; R429-Q432 PolarHBondContact O-N 3.39Å; Q432-K434 VanDerWaalsContact C-N 3.27Å; Q432-K434 PolarHBondContact O-N 3.41Å; Q432-E435 PolarHBondContact O-N 3.15Å; Q432-E435 VanDerWaalsContact O-N 3.07Å; Q432-D436 PolarHBondContact O-N 3.34Å
433	E	84.6	Confident	80.2	Confident	107 Å²	107	117 Å²	117	50%	0.5	55%	0.546	S	S	.	.	H	α-helix	trans	-60.8	-36.1	172.8	-77.5	176.1	176.5	0	0	112	R429 D436 E437	R429-E433 WeakPolarHBondContact O-CG 3.5Å; R429-E433 PolarHBondContact O-N 3.11Å; E433-D436 PolarHBondContact O-N 2.97Å; E433-E437 WeakPolarHBondContact O-CB 3.12Å; E433-E437 PolarHBondContact O-N 3.18Å
434	K	82.3	Confident	79	Confident	135 Å²	135	117.1 Å²	117.1	59%	0.587	55%	0.547	S	S	*	.	H	α-helix	trans	-69.2	-33.4	174	-76.5	174.9	-175.9	-179.1	0	112.6	L430 E431 Q432 K438	L430-K434 WeakPolarHBondContact O-CB 3.48Å; L430-K434 WeakPolarHBondContact O-CG 3.45Å; L430-K434 PolarHBondContact O-N 2.73Å; E431-K434 PolarHBondContact O-N 2.91Å; Q432-K434 VanDerWaalsContact C-N 3.27Å; Q432-K434 PolarHBondContact O-N 3.41Å; K434-K438 WeakPolarHBondContact O-CB 3.39Å; K434-K438 VanDerWaalsContact O-CG 3.26Å; K434-K438 WeakPolarHBondContact O-CG 3.47Å; K434-K438 PolarHBondContact O-N 3.05Å; K434-K438 VanDerWaalsContact O-N 3.1Å
435	E	82.2	Confident	77.6	Confident	121 Å²	121	118.4 Å²	118.4	57%	0.565	55%	0.552	S	S	*	*	H	α-helix	trans	-70	-43.5	173.2	-76.3	-173.7	163.8	0	0	111.4	E431 Q432 E437 K438 Q439	E431-E435 PolarHBondContact O-N 2.55Å; Q432-E435 PolarHBondContact O-N 3.15Å; Q432-E435 VanDerWaalsContact O-N 3.07Å; E435-E437 PolarHBondContact O-N 2.68Å; E435-K438 WeakPolarHBondContact O-CB 3.35Å; E435-K438 PolarHBondContact O-N 3.5Å; E435-K438 VanDerWaalsContact O-N 3.11Å; E435-Q439 WeakPolarHBondContact O-CG 3.39Å; E435-Q439 PolarHBondContact O-N 2.72Å
436	D	80.9	Confident	76	Confident	88 Å²	88	114.6 Å²	114.6	47%	0.471	55%	0.551	S	S	.	*	H	α-helix	trans	-65.4	-37.6	176.7	-67.4	-21.6	0	0	0	111.8	Q432 E433 Q439 S440	Q432-D436 PolarHBondContact O-N 3.34Å; E433-D436 PolarHBondContact O-N 2.97Å; D436-Q439 PolarHBondContact O-N 2.6Å; D436-S440 WeakPolarHBondContact O-CB 3.3Å; D436-S440 PolarHBondContact O-N 3.38Å; D436-S440 PolarHBondContact O-OG 2.76Å
437	E	76.5	Confident	74.5	Confident	105 Å²	105	113.3 Å²	113.3	49%	0.491	56%	0.555	S	S	.	*	H	α-helix	trans	-63.6	-38.9	170.2	-89.8	-154.8	-177.7	0	0	112.6	E433 E435 S440 K441	E433-E437 WeakPolarHBondContact O-CB 3.12Å; E433-E437 PolarHBondContact O-N 3.18Å; E435-E437 PolarHBondContact O-N 2.68Å; E437-S440 WeakPolarHBondContact CA-OG 3.37Å; E437-S440 PolarHBondContact O-OG 2.72Å; E437-S440 VanDerWaalsContact O-OG 3.06Å; E437-K441 VanDerWaalsContact O-CB 3.3Å; E437-K441 WeakPolarHBondContact O-CB 3.13Å; E437-K441 VanDerWaalsContact O-CG 3.24Å; E437-K441 WeakPolarHBondContact O-CG 3.01Å; E437-K441 PolarHBondContact O-N 3.43Å; E437-K441 IonicContact OE2-NZ 3.78Å; E437-K441 PolarHBondContact OE2-NZ 3.44Å
438	K	75.6	Confident	73	Confident	155 Å²	155	111.8 Å²	111.8	67%	0.674	56%	0.561	S	S	*	*	H	α-helix	trans	-68.6	-39.7	176.3	-78.7	174.1	-179.2	179.6	0	111.2	K434 E435 G442	K434-K438 WeakPolarHBondContact O-CB 3.39Å; K434-K438 VanDerWaalsContact O-CG 3.26Å; K434-K438 WeakPolarHBondContact O-CG 3.47Å; K434-K438 PolarHBondContact O-N 3.05Å; K434-K438 VanDerWaalsContact O-N 3.1Å; E435-K438 WeakPolarHBondContact O-CB 3.35Å; E435-K438 PolarHBondContact O-N 3.5Å; E435-K438 VanDerWaalsContact O-N 3.11Å; K438-G442 PolarHBondContact O-N 2.82Å
439	Q	73.8	Confident	71.5	Confident	135 Å²	135	114.6 Å²	114.6	63%	0.631	57%	0.573	S	S	*	*	H	α-helix	trans	-67	-41.2	176	-72.9	-173.6	7.4	0	0	112	E435 D436 G442 S443	E435-Q439 WeakPolarHBondContact O-CG 3.39Å; E435-Q439 PolarHBondContact O-N 2.72Å; D436-Q439 PolarHBondContact O-N 2.6Å; Q439-G442 PolarHBondContact O-N 2.79Å; Q439-S443 PolarHBondContact O-N 3.36Å; Q439-S443 PolarHBondContact O-OG 2.9Å
440	S	68.1	Low	69.6	Low	53 Å²	53	121 Å²	121	37%	0.371	60%	0.597	S	S	.	*	H	α-helix	trans	-70.6	-32.8	176	60.9	0	0	0	0	113.7	D436 E437 S443 K444	D436-S440 WeakPolarHBondContact O-CB 3.3Å; D436-S440 PolarHBondContact O-N 3.38Å; D436-S440 PolarHBondContact O-OG 2.76Å; E437-S440 WeakPolarHBondContact CA-OG 3.37Å; E437-S440 PolarHBondContact O-OG 2.72Å; E437-S440 VanDerWaalsContact O-OG 3.06Å; S440-S443 WeakPolarHBondContact CA-OG 3.1Å; S440-S443 PolarHBondContact O-OG 3.14Å; S440-S443 VanDerWaalsContact O-OG 3.14Å; S440-K444 WeakPolarHBondContact O-CB 3.34Å; S440-K444 WeakPolarHBondContact O-CG 3.34Å; S440-K444 PolarHBondContact O-N 2.9Å; S440-K444 VanDerWaalsContact O-N 3.17Å
441	K	68	Low	68.8	Low	129 Å²	129	122.2 Å²	122.2	56%	0.561	60%	0.602	S	S	*	*	H	α-helix	trans	-71.3	-31.7	170	-73.4	169	-176.6	157.3	0	112	E437 K445	E437-K441 VanDerWaalsContact O-CB 3.3Å; E437-K441 WeakPolarHBondContact O-CB 3.13Å; E437-K441 VanDerWaalsContact O-CG 3.24Å; E437-K441 WeakPolarHBondContact O-CG 3.01Å; E437-K441 PolarHBondContact O-N 3.43Å; E437-K441 IonicContact OE2-NZ 3.78Å; E437-K441 PolarHBondContact OE2-NZ 3.44Å; K441-K445 PolarHBondContact O-N 3.34Å
442	G	63.1	Low	67.9	Low	40 Å²	40	123.2 Å²	123.2	41%	0.412	61%	0.608	S	S	.	*	H	α-helix	trans	-68.4	-46.2	173	0	0	0	0	0	112.8	K438 Q439 K445 S446	K438-G442 PolarHBondContact O-N 2.82Å; Q439-G442 PolarHBondContact O-N 2.79Å; G442-K445 PolarHBondContact O-N 2.83Å; G442-S446 PolarHBondContact O-N 3.32Å; G442-S446 VanDerWaalsContact O-N 3.11Å; G442-S446 PolarHBondContact O-OG 2.85Å
443	S	58.5	Low	67	Low	64 Å²	64	123.5 Å²	123.5	45%	0.448	61%	0.611	S	S	.	*	H	α-helix	trans	-67.9	-37	179.7	63.9	0	0	0	0	112.9	Q439 S440 K445 S446 S447	Q439-S443 PolarHBondContact O-N 3.36Å; Q439-S443 PolarHBondContact O-OG 2.9Å; S440-S443 WeakPolarHBondContact CA-OG 3.1Å; S440-S443 PolarHBondContact O-OG 3.14Å; S440-S443 VanDerWaalsContact O-OG 3.14Å; S443-K445 VanDerWaalsContact C-N 3.31Å; S443-K445 PolarHBondContact O-N 3.34Å; S443-S446 WeakPolarHBondContact CA-OG 3.19Å; S443-S446 PolarHBondContact O-N 3.11Å; S443-S446 PolarHBondContact O-OG 2.95Å; S443-S447 PolarHBondContact O-N 3.47Å; S443-S447 PolarHBondContact O-OG 3.14Å
444	K	59.4	Low	65.9	Low	156 Å²	156	124.5 Å²	124.5	68%	0.678	62%	0.618	S	S	*	*	H	α-helix	trans	-65.4	-28.6	172	-78.5	-180	178.2	175.8	0	113.7	S440 S447	S440-K444 WeakPolarHBondContact O-CB 3.34Å; S440-K444 WeakPolarHBondContact O-CG 3.34Å; S440-K444 PolarHBondContact O-N 2.9Å; S440-K444 VanDerWaalsContact O-N 3.17Å; K444-S447 PolarHBondContact O-OG 3.46Å
445	K	58	Low	64.9	Low	166 Å²	166	123.8 Å²	123.8	72%	0.722	62%	0.62	S	S	*	*	H	α-helix	trans	-79.3	-28.3	174.4	-103	179.5	175.8	178.1	0	113	K441 G442 S443	K441-K445 PolarHBondContact O-N 3.34Å; G442-K445 PolarHBondContact O-N 2.83Å; S443-K445 VanDerWaalsContact C-N 3.31Å; S443-K445 PolarHBondContact O-N 3.34Å
446	S	55.1	Low	63.7	Low	82 Å²	82	124 Å²	124	57%	0.573	62%	0.623	S	S	*	*	H	α-helix	trans	-80.8	-24.7	174.1	53.6	0	0	0	0	113.7	G442 S443	G442-S446 PolarHBondContact O-N 3.32Å; G442-S446 VanDerWaalsContact O-N 3.11Å; G442-S446 PolarHBondContact O-OG 2.85Å; S443-S446 WeakPolarHBondContact CA-OG 3.19Å; S443-S446 PolarHBondContact O-N 3.11Å; S443-S446 PolarHBondContact O-OG 2.95Å
447	S	56.4	Low	62.5	Low	92 Å²	92	126.6 Å²	126.6	64%	0.643	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-5.6	176.8	64.7	0	0	0	0	114.4	S443 K444	S443-S447 PolarHBondContact O-N 3.47Å; S443-S447 PolarHBondContact O-OG 3.14Å; K444-S447 PolarHBondContact O-OG 3.46Å
448	S	56.1	Low	61.4	Low	100 Å²	100	128.2 Å²	128.2	70%	0.699	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.2	13.1	173.6	102.1	0	0	0	0	113.4
449	K	58.6	Low	60.3	Low	188 Å²	188	126 Å²	126	82%	0.817	64%	0.643	S	S	*	*			trans	-132.1	30.9	-177.8	-113.8	-174.1	-176	-175.4	0	113.5
450	R	48	Very low	59	Low	307 Å²	307	125.2 Å²	125.2	100%	1.158	64%	0.644	S	S	*	*			trans	-129.2	0	164.5	-99.6	-172.5	178.9	-174	0	110.2

Retrieved 450 of 450 residues in 592.1 ms (Link to these results)

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