A0A087YMJ1_POEFO Loading...

Cytochrome c1, heme protein, mitochondrial

AlphaFold DB , UniProt , Accession A0A087YMJ1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 307 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	41	Very low	30.6	Very low	248 Å²	248	142.5 Å²	142.5	100%	1.222	86%	0.856	S	S	*	*				0	86	0	-73.9	-81.9	-174.1	0	0	106.7
2	A	29.4	Very low	31.2	Very low	104 Å²	104	141.8 Å²	141.8	86%	0.86	86%	0.864	S	S	*	*			trans	-82.6	133.7	-167.9	0	0	0	0	0	110.9
3	A	30.7	Very low	31.5	Very low	100 Å²	100	136 Å²	136	83%	0.826	85%	0.849	S	S	*	*			trans	-72.6	133.5	179.2	0	0	0	0	0	111.6
4	L	27.2	Very low	32.3	Very low	162 Å²	162	144.4 Å²	144.4	85%	0.848	86%	0.857	S	S	*	*			trans	-85.1	115.6	166.9	-126.2	94	0	0	0	108.6	V6	L4-V6 HydrophobicContact CD2-CG2 4.48Å
5	R	30.7	Very low	32.1	Very low	244 Å²	244	141.2 Å²	141.2	92%	0.921	85%	0.853	S	S	*	*			trans	-104.3	122	158.5	-93.1	-172.1	173.1	-160.5	-1.2	108
6	V	30.4	Very low	32.4	Very low	127 Å²	127	143.3 Å²	143.3	77%	0.77	86%	0.857	S	S	*	*			trans	-87.8	124.1	170.5	171.8	0	0	0	0	107.9	L4	L4-V6 HydrophobicContact CD2-CG2 4.48Å
7	V	30.3	Very low	32.8	Very low	139 Å²	139	145.1 Å²	145.1	84%	0.842	86%	0.86	S	S	*	*			trans	-138.9	133.5	156.1	171.3	0	0	0	0	107.6
8	A	29.6	Very low	32.9	Very low	87 Å²	87	145.8 Å²	145.8	72%	0.719	86%	0.857	S	S	*	*			trans	-64.4	149.6	-177.6	0	0	0	0	0	113.6
9	L	27.3	Very low	33.4	Very low	173 Å²	173	145.3 Å²	145.3	91%	0.906	86%	0.856	S	S	*	*			trans	-117.4	99.7	163.5	-90.5	153.6	0	0	0	109.3
10	S	31	Very low	33.4	Very low	115 Å²	115	141.5 Å²	141.5	80%	0.804	85%	0.849	S	S	*	*			trans	-51.3	142	141.6	148.1	0	0	0	0	109.4
11	G	29.4	Very low	33.6	Very low	68 Å²	68	142.3 Å²	142.3	70%	0.701	85%	0.849	S	S	*	*			trans	147.8	86.3	163.3	0	0	0	0	0	114.1
12	S	37.4	Very low	33.3	Very low	135 Å²	135	136 Å²	136	94%	0.944	83%	0.826	S	S	*	*			trans	-58.9	143.1	162.2	-170.4	0	0	0	0	110.9
13	G	35.8	Very low	33.7	Very low	66 Å²	66	138.6 Å²	138.6	68%	0.68	83%	0.825	S	S	*	*	S	Bend	trans	112.1	122.9	161	0	0	0	0	0	115.5
14	R	41.8	Very low	34	Very low	254 Å²	254	143.9 Å²	143.9	96%	0.958	83%	0.829	S	S	*	*			trans	69.4	81.6	167.1	-77.7	177.3	160.4	-169.4	-3.8	116.9
15	A	30.3	Very low	34.5	Very low	96 Å²	96	141.6 Å²	141.6	79%	0.793	82%	0.822	S	S	*	*			trans	-159.1	85.3	149.2	0	0	0	0	0	111.5
16	L	35.6	Very low	34.9	Very low	174 Å²	174	135.4 Å²	135.4	91%	0.911	82%	0.817	S	S	*	*			trans	-149.4	55.4	155.9	-114.2	155	0	0	0	109.3
17	L	40.3	Very low	35.3	Very low	174 Å²	174	138 Å²	138	91%	0.911	82%	0.817	S	S	*	*			trans	-132.2	75.2	156.5	-76.9	176.4	0	0	0	106.6
18	I	34.1	Very low	36.1	Very low	158 Å²	158	135 Å²	135	81%	0.81	81%	0.808	S	S	*	*			trans	-116.1	116.2	156.2	-64.8	-177.9	0	0	0	106.9	G20	I18-G20 PolarHBondContact O-N 3.24Å
19	T	41.8	Very low	36.8	Very low	137 Å²	137	138.3 Å²	138.3	84%	0.84	81%	0.813	S	S	*	*			trans	-46.1	108.3	170.4	48.8	0	0	0	0	112
20	G	34.3	Very low	37.8	Very low	69 Å²	69	136.3 Å²	136.3	71%	0.711	80%	0.801	S	S	*	*			trans	-85.5	134.7	155.7	0	0	0	0	0	109.2	I18	I18-G20 PolarHBondContact O-N 3.24Å
21	N	37.1	Very low	39	Very low	158 Å²	158	135.1 Å²	135.1	85%	0.845	79%	0.792	S	S	*	*			trans	-43.5	137.6	173.8	-87.8	-26.6	0	0	0	111.5	L23	N21-L23 PolarHBondContact O-N 2.96Å
22	P	35.6	Very low	40.3	Very low	116 Å²	116	136.6 Å²	136.6	75%	0.753	78%	0.78	S	S	*	*			trans	-65.3	116.1	177.3	27.4	-31.5	0	0	0	108.5	K24	P22-K24 PolarHBondContact O-N 2.95Å
23	L	37.1	Very low	41.4	Very low	159 Å²	159	134 Å²	134	83%	0.832	77%	0.766	S	S	*	*			trans	-50	111.6	158.2	-90.2	141.9	0	0	0	107	N21 T25	N21-L23 PolarHBondContact O-N 2.96Å; L23-T25 PolarHBondContact O-N 2.69Å
24	K	37.8	Very low	42.6	Very low	210 Å²	210	136.3 Å²	136.3	91%	0.913	77%	0.772	S	S	*	*			trans	-63.7	87.9	168.1	-85.8	-178.8	175.3	176.9	0	107.7	P22 S26	P22-K24 PolarHBondContact O-N 2.95Å; K24-S26 PolarHBondContact O-N 3.06Å
25	T	36.6	Very low	43.6	Very low	114 Å²	114	126.7 Å²	126.7	70%	0.699	74%	0.739	S	S	*	*			trans	-70.4	108.7	163.5	54.4	0	0	0	0	106.8	L23 K27	L23-T25 PolarHBondContact O-N 2.69Å; T25-K27 PolarHBondContact O-N 2.92Å
26	S	38.6	Very low	45.5	Very low	115 Å²	115	125.5 Å²	125.5	80%	0.804	73%	0.725	S	S	*	*			trans	-57	110.1	164.4	-175.6	0	0	0	0	107.5	K24 A28	K24-S26 PolarHBondContact O-N 3.06Å; S26-A28 VanDerWaalsContact C-N 3.27Å; S26-A28 PolarHBondContact O-N 2.87Å
27	K	40.7	Very low	47.1	Very low	180 Å²	180	119.8 Å²	119.8	78%	0.783	71%	0.708	S	S	*	*			trans	-70.7	89.8	171	-80.7	-173.5	177.2	-179.6	0	107.5	T25 N29	T25-K27 PolarHBondContact O-N 2.92Å; K27-N29 PolarHBondContact O-N 3.07Å; K27-N29 VanDerWaalsContact O-N 3.1Å
28	A	45.7	Very low	48.5	Very low	78 Å²	78	120.6 Å²	120.6	65%	0.645	71%	0.705	S	S	*	*			trans	-68.1	102.9	162	0	0	0	0	0	107.7	S26 M30	S26-A28 VanDerWaalsContact C-N 3.27Å; S26-A28 PolarHBondContact O-N 2.87Å; A28-M30 HydrophobicContact CB-CG 4.37Å; A28-M30 PolarHBondContact O-N 2.93Å
29	N	43.6	Very low	50.1	Low	156 Å²	156	119.3 Å²	119.3	83%	0.834	69%	0.693	S	S	*	*			trans	-70.8	82.5	168.9	-81.6	-18.8	0	0	0	108.6	K27 S31	K27-N29 PolarHBondContact O-N 3.07Å; K27-N29 VanDerWaalsContact O-N 3.1Å; N29-S31 PolarHBondContact O-N 3.26Å
30	M	49.1	Very low	51.3	Low	130 Å²	130	116.8 Å²	116.8	64%	0.64	67%	0.67	S	S	*	*			trans	-79.9	101.3	170.4	-61.7	-138.5	-46	0	0	109.2	A28 F32	A28-M30 HydrophobicContact CB-CG 4.37Å; A28-M30 PolarHBondContact O-N 2.93Å; M30-F32 HydrophobicContact CB-CE2 4.37Å; M30-F32 HydrophobicContact CB-CZ 4.22Å; M30-F32 HydrophobicContact CE-CE1 3.89Å; M30-F32 HydrophobicContact CE-CZ 3.62Å
31	S	56	Low	53	Low	90 Å²	90	117.9 Å²	117.9	63%	0.629	66%	0.663	S	S	*	*			trans	-81	116.7	170.6	178.2	0	0	0	0	109.8	N29 A33	N29-S31 PolarHBondContact O-N 3.26Å; S31-A33 PolarHBondContact O-N 2.81Å; S31-A33 WeakPolarHBondContact OG-CB 3.42Å; S31-A33 PolarHBondContact OG-N 2.81Å
32	F	57.8	Low	54.6	Low	99 Å²	99	112.6 Å²	112.6	43%	0.434	64%	0.642	S	S	.	*			trans	-84.3	6.3	175.4	-61	-77.7	0	0	0	113.1	M30 S34 L35 K40 L43	M30-F32 HydrophobicContact CB-CE2 4.37Å; M30-F32 HydrophobicContact CB-CZ 4.22Å; M30-F32 HydrophobicContact CE-CE1 3.89Å; M30-F32 HydrophobicContact CE-CZ 3.62Å; F32-S34 VanDerWaalsContact C-N 3.27Å; F32-S34 PolarHBondContact O-N 2.71Å; F32-L35 HydrophobicContact CB-CD1 4.34Å; F32-L35 HydrophobicContact CD1-CD1 4.01Å; F32-L35 PolarHBondContact O-N 3.27Å; F32-K40 WeakPolarHBondContact O-CE 3.38Å; F32-K40 PolarHBondContact O-NZ 2.92Å; F32-L43 HydrophobicContact CD1-CD2 4.19Å; F32-L43 HydrophobicContact CE1-CD2 3.46Å; F32-L43 VanDerWaalsContact CE1-CD2 3.46Å; F32-L43 HydrophobicContact CZ-CD2 4.29Å
33	A	59.8	Low	56.1	Low	80 Å²	80	111.3 Å²	111.3	66%	0.661	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-33.4	-173.2	0	0	0	0	0	113	S31	S31-A33 PolarHBondContact O-N 2.81Å; S31-A33 WeakPolarHBondContact OG-CB 3.42Å; S31-A33 PolarHBondContact OG-N 2.81Å
34	S	60.9	Low	57.5	Low	115 Å²	115	108 Å²	108	80%	0.804	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-1.7	-174.2	65	0	0	0	0	116	F32	F32-S34 VanDerWaalsContact C-N 3.27Å; F32-S34 PolarHBondContact O-N 2.71Å
35	L	62.6	Low	58.9	Low	52 Å²	52	101.5 Å²	101.5	27%	0.272	59%	0.593	S	S	.	*	S	Bend	trans	-83	138.2	-178.9	-75.4	103.2	0	0	0	112.9	F32 K39 K40	F32-L35 HydrophobicContact CB-CD1 4.34Å; F32-L35 HydrophobicContact CD1-CD1 4.01Å; F32-L35 PolarHBondContact O-N 3.27Å; L35-K39 HydrophobicContact CB-CB 4.36Å; L35-K39 HydrophobicContact CD2-CB 3.76Å; L35-K39 HydrophobicContact CD2-CD 4.3Å; L35-K40 HydrophobicContact CB-CG 3.93Å; L35-K40 WeakPolarHBondContact O-CE 3.29Å; L35-K40 PolarHBondContact O-NZ 2.86Å
36	S	70.1	Confident	60.4	Low	71 Å²	71	102.2 Å²	102.2	50%	0.497	59%	0.591	S	S	.	*			trans	-64.9	151.1	174.1	81.6	0	0	0	0	111.6	K38 K39 K40	S36-K38 PolarHBondContact O-N 3.17Å; S36-K38 VanDerWaalsContact O-N 3.09Å; S36-K39 PolarHBondContact O-N 2.85Å; S36-K40 PolarHBondContact O-N 2.71Å; S36-K40 VanDerWaalsContact O-N 3.15Å
37	G	69.1	Low	61.9	Low	54 Å²	54	98.9 Å²	98.9	56%	0.557	58%	0.576	S	S	*	*	H	α-helix	trans	-52	-37.8	-172.1	0	0	0	0	0	114.4	K39 K40 V41	G37-K39 PolarHBondContact O-N 3.32Å; G37-K40 PolarHBondContact O-N 2.84Å; G37-V41 WeakPolarHBondContact O-CG2 3.36Å; G37-V41 PolarHBondContact O-N 3.25Å; G37-V41 VanDerWaalsContact O-N 3.14Å
38	K	70.6	Confident	63.4	Low	191 Å²	191	95.5 Å²	95.5	83%	0.83	57%	0.57	S	S	*	*	H	α-helix	trans	-65.8	-35.9	177.3	-63.5	-173.7	179.4	-176.8	0	113	S36 A42	S36-K38 PolarHBondContact O-N 3.17Å; S36-K38 VanDerWaalsContact O-N 3.09Å; K38-A42 PolarHBondContact O-N 3.27Å; K38-A42 VanDerWaalsContact O-N 3.16Å
39	K	67.4	Low	64.7	Low	131 Å²	131	96.9 Å²	96.9	57%	0.57	57%	0.57	S	S	*	*	H	α-helix	trans	-75.8	-32	178.5	-68.2	-175.9	176.4	-178.1	0	112.3	L35 S36 G37 L43	L35-K39 HydrophobicContact CB-CB 4.36Å; L35-K39 HydrophobicContact CD2-CB 3.76Å; L35-K39 HydrophobicContact CD2-CD 4.3Å; S36-K39 PolarHBondContact O-N 2.85Å; G37-K39 PolarHBondContact O-N 3.32Å; K39-L43 PolarHBondContact O-N 3.38Å; K39-L43 VanDerWaalsContact O-N 3.08Å
40	K	66.1	Low	66	Low	84 Å²	84	92.5 Å²	92.5	37%	0.365	56%	0.555	S	S	.	*	H	α-helix	trans	-64.6	-47.2	172.9	-73.4	177.4	174	166.6	0	111.2	F32 L35 S36 G37 A42 L43 T44	F32-K40 WeakPolarHBondContact O-CE 3.38Å; F32-K40 PolarHBondContact O-NZ 2.92Å; L35-K40 HydrophobicContact CB-CG 3.93Å; L35-K40 WeakPolarHBondContact O-CE 3.29Å; L35-K40 PolarHBondContact O-NZ 2.86Å; S36-K40 PolarHBondContact O-N 2.71Å; S36-K40 VanDerWaalsContact O-N 3.15Å; G37-K40 PolarHBondContact O-N 2.84Å; K40-A42 PolarHBondContact O-N 3.27Å; K40-L43 PolarHBondContact O-N 3Å; K40-T44 PolarHBondContact O-N 2.9Å; K40-T44 PolarHBondContact O-OG1 2.84Å; K40-T44 VanDerWaalsContact O-OG1 3.07Å
41	V	69.9	Low	66.9	Low	92 Å²	92	88.6 Å²	88.6	56%	0.558	55%	0.548	S	S	*	.	H	α-helix	trans	-60	-45.3	177	173.8	0	0	0	0	111.2	G37 L43 T44 T45	G37-V41 WeakPolarHBondContact O-CG2 3.36Å; G37-V41 PolarHBondContact O-N 3.25Å; G37-V41 VanDerWaalsContact O-N 3.14Å; V41-L43 PolarHBondContact O-N 3.45Å; V41-T44 WeakPolarHBondContact CA-OG1 3.45Å; V41-T44 PolarHBondContact O-N 2.96Å; V41-T44 PolarHBondContact O-OG1 3.14Å; V41-T45 WeakPolarHBondContact O-CG2 3.48Å; V41-T45 PolarHBondContact O-N 3.33Å; V41-T45 PolarHBondContact O-OG1 3.2Å
42	A	70.9	Confident	67.6	Low	48 Å²	48	86.6 Å²	86.6	40%	0.397	54%	0.542	S	S	.	.	H	α-helix	trans	-62.7	-38.3	178.4	0	0	0	0	0	113.5	K38 K40 T45 L46	K38-A42 PolarHBondContact O-N 3.27Å; K38-A42 VanDerWaalsContact O-N 3.16Å; K40-A42 PolarHBondContact O-N 3.27Å; A42-T45 WeakPolarHBondContact CA-OG1 3.11Å; A42-T45 PolarHBondContact O-OG1 3.31Å; A42-L46 WeakPolarHBondContact O-CB 3.33Å; A42-L46 PolarHBondContact O-N 3.44Å
43	L	67.4	Low	68.3	Low	89 Å²	89	83.8 Å²	83.8	47%	0.466	54%	0.54	S	S	.	.	H	α-helix	trans	-71.6	-37.9	177.2	-115.6	89.7	0	0	0	112.3	F32 K39 K40 V41 L46 G47	F32-L43 HydrophobicContact CD1-CD2 4.19Å; F32-L43 HydrophobicContact CE1-CD2 3.46Å; F32-L43 VanDerWaalsContact CE1-CD2 3.46Å; F32-L43 HydrophobicContact CZ-CD2 4.29Å; K39-L43 PolarHBondContact O-N 3.38Å; K39-L43 VanDerWaalsContact O-N 3.08Å; K40-L43 PolarHBondContact O-N 3Å; V41-L43 PolarHBondContact O-N 3.45Å; L43-L46 PolarHBondContact O-N 2.83Å; L43-G47 PolarHBondContact O-N 3.35Å
44	T	67.1	Low	68.9	Low	88 Å²	88	82.5 Å²	82.5	54%	0.54	53%	0.53	S	S	.	.	H	α-helix	trans	-67.7	-39.7	176.8	48.1	0	0	0	0	111.9	K40 V41 G47 V48	K40-T44 PolarHBondContact O-N 2.9Å; K40-T44 PolarHBondContact O-OG1 2.84Å; K40-T44 VanDerWaalsContact O-OG1 3.07Å; V41-T44 WeakPolarHBondContact CA-OG1 3.45Å; V41-T44 PolarHBondContact O-N 2.96Å; V41-T44 PolarHBondContact O-OG1 3.14Å; T44-G47 PolarHBondContact O-N 3.36Å; T44-V48 VanDerWaalsContact O-CG2 3.29Å; T44-V48 WeakPolarHBondContact O-CG2 3.37Å; T44-V48 PolarHBondContact O-N 3.45Å
45	T	67.2	Low	69.4	Low	75 Å²	75	78.7 Å²	78.7	46%	0.46	51%	0.509	S	S	.	.	H	α-helix	trans	-67.8	-40	175.5	49.3	0	0	0	0	111.4	V41 A42 G47 V48 V49	V41-T45 WeakPolarHBondContact O-CG2 3.48Å; V41-T45 PolarHBondContact O-N 3.33Å; V41-T45 PolarHBondContact O-OG1 3.2Å; A42-T45 WeakPolarHBondContact CA-OG1 3.11Å; A42-T45 PolarHBondContact O-OG1 3.31Å; T45-G47 PolarHBondContact O-N 3.4Å; T45-V48 PolarHBondContact O-N 3.44Å; T45-V49 WeakPolarHBondContact O-CB 3.44Å; T45-V49 WeakPolarHBondContact O-CG2 3.4Å; T45-V49 PolarHBondContact O-N 3.03Å
46	L	67.8	Low	69.8	Low	128 Å²	128	81.4 Å²	81.4	67%	0.67	52%	0.523	S	S	*	.	H	α-helix	trans	-62.2	-42.2	173.5	-121.1	89.7	0	0	0	112.4	A42 L43 V49 A50	A42-L46 WeakPolarHBondContact O-CB 3.33Å; A42-L46 PolarHBondContact O-N 3.44Å; L43-L46 PolarHBondContact O-N 2.83Å; L46-V49 PolarHBondContact O-N 3.47Å; L46-A50 WeakPolarHBondContact O-CB 3.17Å; L46-A50 PolarHBondContact O-N 2.88Å
47	G	70.3	Confident	69.8	Low	46 Å²	46	80.7 Å²	80.7	47%	0.474	52%	0.522	S	S	.	.	H	α-helix	trans	-65.4	-40.3	179	0	0	0	0	0	113	L43 T44 T45 G51	L43-G47 PolarHBondContact O-N 3.35Å; T44-G47 PolarHBondContact O-N 3.36Å; T45-G47 PolarHBondContact O-N 3.4Å; G47-G51 PolarHBondContact O-N 3.42Å
48	V	71.4	Confident	69.9	Low	109 Å²	109	83.9 Å²	83.9	66%	0.661	53%	0.525	S	S	*	.	H	α-helix	trans	-69.9	-39.8	176	173.3	0	0	0	0	111.3	T44 T45 G52	T44-V48 VanDerWaalsContact O-CG2 3.29Å; T44-V48 WeakPolarHBondContact O-CG2 3.37Å; T44-V48 PolarHBondContact O-N 3.45Å; T45-V48 PolarHBondContact O-N 3.44Å; V48-G52 WeakPolarHBondContact O-CA 3.09Å; V48-G52 PolarHBondContact O-N 3.32Å
49	V	72.8	Confident	69.7	Low	107 Å²	107	80.6 Å²	80.6	65%	0.648	51%	0.514	S	S	*	.	H	α-helix	trans	-69.9	-41.9	177.1	172	0	0	0	0	111.4	T45 L46 G53	T45-V49 WeakPolarHBondContact O-CB 3.44Å; T45-V49 WeakPolarHBondContact O-CG2 3.4Å; T45-V49 PolarHBondContact O-N 3.03Å; L46-V49 PolarHBondContact O-N 3.47Å; V49-G53 VanDerWaalsContact O-CA 3.31Å; V49-G53 WeakPolarHBondContact O-CA 3.33Å; V49-G53 PolarHBondContact O-N 3.37Å
50	A	71.1	Confident	69.8	Low	64 Å²	64	80.9 Å²	80.9	53%	0.529	52%	0.521	S	S	.	.	H	α-helix	trans	-70	-44.3	178	0	0	0	0	0	111.9	L46 A54	L46-A50 WeakPolarHBondContact O-CB 3.17Å; L46-A50 PolarHBondContact O-N 2.88Å; A50-A54 WeakPolarHBondContact O-CB 3.46Å; A50-A54 PolarHBondContact O-N 3.09Å
51	G	69.5	Low	69.5	Low	48 Å²	48	84.6 Å²	84.6	50%	0.495	54%	0.54	S	S	.	.	H	α-helix	trans	-69.5	-44.8	177.7	0	0	0	0	0	112.9	G47 G55	G47-G51 PolarHBondContact O-N 3.42Å; G51-G55 PolarHBondContact O-N 2.84Å
52	G	69.3	Low	68.9	Low	47 Å²	47	86.7 Å²	86.7	49%	0.485	54%	0.543	S	S	.	.	H	α-helix	trans	-69.3	-40.5	177	0	0	0	0	0	112.7	V48 L56	V48-G52 WeakPolarHBondContact O-CA 3.09Å; V48-G52 PolarHBondContact O-N 3.32Å; G52-L56 VanDerWaalsContact O-CB 3.24Å; G52-L56 WeakPolarHBondContact O-CB 3.41Å; G52-L56 PolarHBondContact O-N 2.79Å
53	G	72.9	Confident	68.1	Low	40 Å²	40	88.9 Å²	88.9	41%	0.412	56%	0.556	S	S	.	*	H	α-helix	trans	-67.2	-43.3	176.4	0	0	0	0	0	112.7	V49 A57	V49-G53 VanDerWaalsContact O-CA 3.31Å; V49-G53 WeakPolarHBondContact O-CA 3.33Å; V49-G53 PolarHBondContact O-N 3.37Å; G53-A57 WeakPolarHBondContact O-CB 3.36Å; G53-A57 PolarHBondContact O-N 3.49Å
54	A	72.4	Confident	67.3	Low	54 Å²	54	90.6 Å²	90.6	45%	0.446	57%	0.569	S	S	.	*	H	α-helix	trans	-68.2	-39.9	176	0	0	0	0	0	112.2	A50 A57 L58	A50-A54 WeakPolarHBondContact O-CB 3.46Å; A50-A54 PolarHBondContact O-N 3.09Å; A54-A57 PolarHBondContact O-N 2.95Å; A54-L58 WeakPolarHBondContact O-CB 3.29Å; A54-L58 VanDerWaalsContact O-CG 3.32Å; A54-L58 WeakPolarHBondContact O-CG 3.47Å; A54-L58 PolarHBondContact O-N 2.95Å
55	G	70.7	Confident	66.5	Low	34 Å²	34	92.3 Å²	92.3	35%	0.351	57%	0.57	S	S	.	*	H	α-helix	trans	-62.9	-44.6	174.6	0	0	0	0	0	112.3	G51 L58 M59	G51-G55 PolarHBondContact O-N 2.84Å; G55-L58 PolarHBondContact O-N 2.65Å; G55-M59 VanDerWaalsContact O-CG 3.3Å; G55-M59 WeakPolarHBondContact O-CG 3.27Å; G55-M59 PolarHBondContact O-N 2.99Å
56	L	70.9	Confident	65.6	Low	109 Å²	109	92.6 Å²	92.6	57%	0.571	58%	0.58	S	S	*	*	H	α-helix	trans	-67.2	-39.7	176.7	-175.7	63.6	0	0	0	111.9	G52 M59 L60	G52-L56 VanDerWaalsContact O-CB 3.24Å; G52-L56 WeakPolarHBondContact O-CB 3.41Å; G52-L56 PolarHBondContact O-N 2.79Å; L56-M59 PolarHBondContact O-N 3.02Å; L56-L60 HydrophobicContact CD1-CD1 4.21Å; L56-L60 HydrophobicContact CD1-CG 4.41Å; L56-L60 HydrophobicContact CD2-CD1 4.39Å; L56-L60 HydrophobicContact CG-CD1 3.78Å; L56-L60 HydrophobicContact CG-CG 4.42Å; L56-L60 WeakPolarHBondContact O-CB 3.3Å; L56-L60 VanDerWaalsContact O-CG 3.3Å; L56-L60 WeakPolarHBondContact O-CG 3.47Å; L56-L60 PolarHBondContact O-N 2.91Å
57	A	71.1	Confident	64.9	Low	57 Å²	57	90 Å²	90	47%	0.471	57%	0.572	S	S	.	*	H	α-helix	trans	-64.8	-38.1	176	0	0	0	0	0	112.1	G53 A54 L60 H61	G53-A57 WeakPolarHBondContact O-CB 3.36Å; G53-A57 PolarHBondContact O-N 3.49Å; A54-A57 PolarHBondContact O-N 2.95Å; A57-L60 PolarHBondContact O-N 2.64Å; A57-H61 VanDerWaalsContact O-CB 3.24Å; A57-H61 WeakPolarHBondContact O-CB 3.21Å; A57-H61 PolarHBondContact O-N 3.22Å
58	L	71.9	Confident	64.4	Low	121 Å²	121	94.9 Å²	94.9	63%	0.634	58%	0.582	S	S	*	*	H	α-helix	trans	-66.7	-38.2	174	-75.6	170	0	0	0	112.3	A54 G55 H61 Q62	A54-L58 WeakPolarHBondContact O-CB 3.29Å; A54-L58 VanDerWaalsContact O-CG 3.32Å; A54-L58 WeakPolarHBondContact O-CG 3.47Å; A54-L58 PolarHBondContact O-N 2.95Å; G55-L58 PolarHBondContact O-N 2.65Å; L58-H61 PolarHBondContact O-N 2.98Å; L58-Q62 PolarHBondContact O-N 3.46Å
59	M	65.8	Low	64.5	Low	122 Å²	122	94.6 Å²	94.6	60%	0.601	58%	0.577	S	S	*	*	H	α-helix	trans	-69.4	-37.3	174.2	-67	-68.5	107.7	0	0	112.1	G55 L56 H61 Q62	G55-M59 VanDerWaalsContact O-CG 3.3Å; G55-M59 WeakPolarHBondContact O-CG 3.27Å; G55-M59 PolarHBondContact O-N 2.99Å; L56-M59 PolarHBondContact O-N 3.02Å; M59-H61 VanDerWaalsContact C-N 3.34Å; M59-Q62 PolarHBondContact O-N 3.13Å
60	L	68.9	Low	64.8	Low	137 Å²	137	95 Å²	95	72%	0.717	57%	0.572	S	S	*	*	H	α-helix	trans	-74	-22.6	175.7	-75.2	164.2	0	0	0	113.1	L56 A57 Q62	L56-L60 HydrophobicContact CD1-CD1 4.21Å; L56-L60 HydrophobicContact CD1-CG 4.41Å; L56-L60 HydrophobicContact CD2-CD1 4.39Å; L56-L60 HydrophobicContact CG-CD1 3.78Å; L56-L60 HydrophobicContact CG-CG 4.42Å; L56-L60 WeakPolarHBondContact O-CB 3.3Å; L56-L60 VanDerWaalsContact O-CG 3.3Å; L56-L60 WeakPolarHBondContact O-CG 3.47Å; L56-L60 PolarHBondContact O-N 2.91Å; A57-L60 PolarHBondContact O-N 2.64Å; L60-Q62 VanDerWaalsContact C-N 3.34Å
61	H	61.3	Low	65.8	Low	161 Å²	161	96 Å²	96	75%	0.745	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-6.9	176.9	-162	68.4	0	0	0	113.2	A57 L58 M59 S63	A57-H61 VanDerWaalsContact O-CB 3.24Å; A57-H61 WeakPolarHBondContact O-CB 3.21Å; A57-H61 PolarHBondContact O-N 3.22Å; L58-H61 PolarHBondContact O-N 2.98Å; M59-H61 VanDerWaalsContact C-N 3.34Å; H61-S63 VanDerWaalsContact C-N 3.33Å; H61-S63 PolarHBondContact O-N 2.85Å
62	Q	56.5	Low	66.9	Low	137 Å²	137	100.5 Å²	100.5	64%	0.64	58%	0.576	S	S	*	*	S	Bend	trans	-69.6	96	164.1	-79.6	-169.4	-62.6	0	0	108.9	L58 M59 L60 V64	L58-Q62 PolarHBondContact O-N 3.46Å; M59-Q62 PolarHBondContact O-N 3.13Å; L60-Q62 VanDerWaalsContact C-N 3.34Å; Q62-V64 PolarHBondContact O-N 3.07Å
63	S	53	Low	68.2	Low	94 Å²	94	99.6 Å²	99.6	66%	0.657	56%	0.561	S	S	*	*			trans	-60.1	108.3	167.3	60.6	0	0	0	0	108.6	H61 K65	H61-S63 VanDerWaalsContact C-N 3.33Å; H61-S63 PolarHBondContact O-N 2.85Å; S63-K65 PolarHBondContact O-N 3.33Å; S63-K65 VanDerWaalsContact O-N 3.08Å
64	V	51.8	Low	69.3	Low	124 Å²	124	100.7 Å²	100.7	75%	0.752	56%	0.561	S	S	*	*			trans	-68.4	104.8	168.6	178.3	0	0	0	0	107	Q62 A66 L69	Q62-V64 PolarHBondContact O-N 3.07Å; V64-A66 PolarHBondContact O-N 3.21Å; V64-L69 HydrophobicContact CG1-CD1 3.79Å
65	K	50.8	Low	70.5	Confident	125 Å²	125	103.4 Å²	103.4	54%	0.543	58%	0.577	S	S	.	*			trans	-75.7	116.2	170.8	-70.1	-173.4	-179.5	175.5	0	108.1	S63 S67 E68	S63-K65 PolarHBondContact O-N 3.33Å; S63-K65 VanDerWaalsContact O-N 3.08Å; K65-S67 PolarHBondContact O-N 3.47Å; K65-S67 VanDerWaalsContact O-N 3.08Å; K65-E68 PolarHBondContact O-N 3.32Å; K65-E68 VanDerWaalsContact O-N 3.13Å
66	A	48.3	Very low	71.8	Confident	81 Å²	81	105 Å²	105	67%	0.669	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-65.8	-8.7	179.5	0	0	0	0	0	114.2	V64 E68	V64-A66 PolarHBondContact O-N 3.21Å; A66-E68 VanDerWaalsContact C-N 3.31Å
67	S	53.2	Low	73.1	Confident	74 Å²	74	105.9 Å²	105.9	52%	0.517	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	-78.6	-10.4	173.3	59.4	0	0	0	0	114.1	K65 Q222	K65-S67 PolarHBondContact O-N 3.47Å; K65-S67 VanDerWaalsContact O-N 3.08Å; S67-Q222 PolarHBondContact O-OE1 2.93Å
68	E	58.7	Low	74.4	Confident	147 Å²	147	104.3 Å²	104.3	69%	0.687	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-104.2	1.6	179.8	-65.2	178.3	-168.6	0	0	112.3	K65 A66 E70	K65-E68 PolarHBondContact O-N 3.32Å; K65-E68 VanDerWaalsContact O-N 3.13Å; A66-E68 VanDerWaalsContact C-N 3.31Å; E68-E70 PolarHBondContact O-N 2.95Å
69	L	74.1	Confident	75.6	Confident	104 Å²	104	101.3 Å²	101.3	55%	0.545	56%	0.556	S	S	.	*			trans	-81.4	112.7	174.4	-85.3	88.8	0	0	0	109.5	V64 Q222	V64-L69 HydrophobicContact CG1-CD1 3.79Å; L69-Q222 PolarHBondContact O-NE2 3.19Å
70	E	79.1	Confident	77.2	Confident	116 Å²	116	95.7 Å²	95.7	54%	0.542	53%	0.528	S	S	.	.			trans	-89.4	127	173.4	-66	-176	167.1	0	0	110.3	E68 H72	E68-E70 PolarHBondContact O-N 2.95Å; E70-H72 PolarHBondContact O-N 3.18Å
71	L	91	Very high	78.4	Confident	85 Å²	85	92.5 Å²	92.5	45%	0.445	52%	0.522	S	S	.	.			trans	-81.6	110.5	169.6	-178.1	63.9	0	0	0	108.7	P217 Y218	L71-P217 WeakPolarHBondContact CB-O 3.4Å; L71-P217 HydrophobicContact CD2-CB 3.96Å; L71-P217 HydrophobicContact CD2-CG 4.31Å; L71-Y218 HydrophobicContact CB-CD1 4.35Å; L71-Y218 HydrophobicContact CD2-CD1 3.95Å; L71-Y218 HydrophobicContact CD2-CE1 3.57Å; L71-Y218 HydrophobicContact CD2-CE2 4.24Å; L71-Y218 HydrophobicContact CD2-CG 4.44Å; L71-Y218 HydrophobicContact CG-CD1 3.96Å; L71-Y218 HydrophobicContact CG-CE1 3.73Å; L71-Y218 WeakPolarHBondContact O-CD1 3.3Å
72	H	93.5	Very high	80	Confident	142 Å²	142	85.9 Å²	85.9	66%	0.657	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-70.4	140	174.6	-71.3	-70.5	0	0	0	111.1	E70	E70-H72 PolarHBondContact O-N 3.18Å
73	P	96.3	Very high	81.7	Confident	28 Å²	28	84.9 Å²	84.9	18%	0.182	50%	0.502	C	S	.	.	P	Polyproline II helix	trans	-65.7	143.6	175.6	30.2	-36.3	0	0	0	110.5	D191	P73-D191 HydrophobicContact CB-CB 4.1Å; P73-D191 HydrophobicContact CG-CB 4.28Å
74	P	96.9	Very high	83.7	Confident	62 Å²	62	85.5 Å²	85.5	40%	0.403	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-69.3	158.9	169	32.2	-35	0	0	0	110.5	Y76 D191 S195	P74-Y76 HydrophobicContact CG-CE1 4.2Å; P74-Y76 HydrophobicContact CG-CE2 3.73Å; P74-Y76 WeakPolarHBondContact CG-OH 3.17Å; P74-Y76 WeakPolarHBondContact O-CD2 3.42Å; P74-Y76 PolarHBondContact O-N 3.39Å; P74-D191 WeakPolarHBondContact O-CB 3.31Å; P74-S195 WeakPolarHBondContact CD-OG 3.46Å
75	S	97.7	Very high	85.9	Confident	112 Å²	112	81.8 Å²	81.8	78%	0.783	48%	0.477	S	S	*	.			trans	-82.5	108.8	175.7	-57.7	0	0	0	0	111
76	Y	97.7	Very high	88.1	Confident	67 Å²	67	79.1 Å²	79.1	26%	0.263	47%	0.474	S	S	.	.			trans	-83.5	146.2	177.2	-62.1	-84.4	0	0	0	111.2	P74 W78 D191 F194 S195	P74-Y76 HydrophobicContact CG-CE1 4.2Å; P74-Y76 HydrophobicContact CG-CE2 3.73Å; P74-Y76 WeakPolarHBondContact CG-OH 3.17Å; P74-Y76 WeakPolarHBondContact O-CD2 3.42Å; P74-Y76 PolarHBondContact O-N 3.39Å; Y76-W78 VanDerWaalsContact C-N 3.3Å; Y76-W78 PolarHBondContact O-N 3.29Å; Y76-D191 HydrophobicContact CD2-CB 4.2Å; Y76-D191 WeakPolarHBondContact CD2-OD1 3.36Å; Y76-D191 PolarHBondContact N-OD1 3.37Å; Y76-F194 HydrophobicContact CD1-CD1 4.32Å; Y76-F194 HydrophobicContact CD1-CE1 4.23Å; Y76-F194 HydrophobicContact CD2-CD1 4.03Å; Y76-F194 AromaticContact CE1-CD1 3.88Å; Y76-F194 HydrophobicContact CE1-CD1 3.88Å; Y76-F194 AromaticContact CE1-CE1 3.71Å; Y76-F194 HydrophobicContact CE1-CE1 3.71Å; Y76-F194 HydrophobicContact CE2-CB 4.48Å; Y76-F194 AromaticContact CE2-CD1 3.56Å; Y76-F194 HydrophobicContact CE2-CD1 3.56Å; Y76-F194 HydrophobicContact CE2-CE1 4.25Å; Y76-F194 HydrophobicContact CE2-CG 4.39Å; Y76-F194 HydrophobicContact CG-CD1 4.39Å; Y76-F194 AromaticContact CZ-CD1 3.46Å; Y76-F194 VanDerWaalsContact CZ-CD1 3.46Å; Y76-F194 AromaticContact CZ-CE1 3.71Å; Y76-S195 VanDerWaalsContact CE2-OG 3.31Å; Y76-S195 WeakPolarHBondContact CE2-OG 3.13Å; Y76-S195 PolarHBondContact OH-OG 3.44Å; Y76-S195 VanDerWaalsContact OH-OG 3.14Å
77	P	97.6	Very high	90.5	Very high	128 Å²	128	75.5 Å²	75.5	83%	0.831	44%	0.444	S	S	*	.			trans	-80.6	74	-179.3	33.3	-35.5	0	0	0	111.3
78	W	98.3	Very high	92.6	Very high	23 Å²	23	74.6 Å²	74.6	9%	0.087	43%	0.433	C	S	.	.			trans	-61.9	143.9	177.2	-59	96.3	0	0	0	112.2	Y76 H80 A81 E190 D191 F194 K250 C253	Y76-W78 VanDerWaalsContact C-N 3.3Å; Y76-W78 PolarHBondContact O-N 3.29Å; W78-H80 AromaticContact CE3-CE1 3.97Å; W78-H80 PolarHBondContact O-N 3.41Å; W78-H80 VanDerWaalsContact O-N 3.1Å; W78-A81 HydrophobicContact CB-CB 4.25Å; W78-A81 VanDerWaalsContact O-CB 3.29Å; W78-A81 WeakPolarHBondContact O-CB 3.39Å; W78-A81 PolarHBondContact O-N 3.02Å; W78-E190 VanDerWaalsContact CD1-OE1 3.26Å; W78-E190 HydrophobicContact CD2-CG 4.17Å; W78-E190 HydrophobicContact CG-CG 4.37Å; W78-E190 VanDerWaalsContact CG-OE1 3.24Å; W78-E190 HydrophobicContact CH2-CB 4.45Å; W78-E190 HydrophobicContact CZ2-CB 3.98Å; W78-E190 HydrophobicContact CZ2-CG 4.1Å; W78-E190 WeakPolarHBondContact CZ2-O 3.22Å; W78-D191 PolarHBondContact NE1-OD1 3.22Å; W78-F194 HydrophobicContact CH2-CB 3.88Å; W78-F194 AromaticContact CH2-CD2 3.87Å; W78-F194 HydrophobicContact CH2-CD2 3.87Å; W78-F194 HydrophobicContact CH2-CG 4.1Å; W78-F194 HydrophobicContact CZ2-CB 3.85Å; W78-F194 HydrophobicContact CZ2-CD2 4.49Å; W78-F194 HydrophobicContact CZ2-CG 4.28Å; W78-K250 HydrophobicContact CZ3-CG 4.02Å; W78-C253 HydrophobicContact CH2-CB 3.49Å; W78-C253 VanDerWaalsContact CH2-CB 3.49Å; W78-C253 HydrophobicContact CZ2-CB 4.39Å; W78-C253 HydrophobicContact CZ3-CB 3.85Å
79	S	97.9	Very high	94.5	Very high	59 Å²	59	71.1 Å²	71.1	41%	0.413	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-32	178.6	66.8	0	0	0	0	112.7	S85	S79-S85 WeakPolarHBondContact O-CB 3.26Å
80	H	97.9	Very high	95.7	Very high	4 Å²	4	68.5 Å²	68.5	2%	0.019	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	12	-178.1	49.8	-86	0	0	0	114.2	W78 G82 S86 L87 E190 K268	W78-H80 AromaticContact CE3-CE1 3.97Å; W78-H80 PolarHBondContact O-N 3.41Å; W78-H80 VanDerWaalsContact O-N 3.1Å; H80-G82 VanDerWaalsContact C-N 3.35Å; H80-G82 PolarHBondContact O-N 2.93Å; H80-S86 VanDerWaalsContact CB-O 3.31Å; H80-S86 WeakPolarHBondContact CB-O 3.48Å; H80-L87 HydrophobicContact CB-CD2 4.01Å; H80-L87 HydrophobicContact CB-CG 4.33Å; H80-E190 IonicContact CD2-OE1 3.12Å; H80-E190 PolarHBondContact CD2-OE1 2.79Å; H80-E190 IonicContact CD2-OE2 3.83Å; H80-E190 IonicContact CE1-OE1 2.82Å; H80-E190 IonicContact CE1-OE2 3.4Å; H80-E190 IonicContact NE2-OE1 3.38Å; H80-E190 PolarHBondContact NE2-OE1 3.19Å; H80-E190 IonicContact NE2-OE2 3.9Å; H80-E190 PolarHBondContact NE2-OE2 2.66Å; H80-K268 PolarHBondContact O-NZ 3.43Å
81	A	95.3	Very high	96.6	Very high	70 Å²	70	63 Å²	63	58%	0.579	38%	0.384	S	S	*	.			trans	-68.7	-31.9	-179.7	0	0	0	0	0	113.1	W78	W78-A81 HydrophobicContact CB-CB 4.25Å; W78-A81 VanDerWaalsContact O-CB 3.29Å; W78-A81 WeakPolarHBondContact O-CB 3.39Å; W78-A81 PolarHBondContact O-N 3.02Å
82	G	94.6	Very high	97	Very high	22 Å²	22	59 Å²	59	23%	0.227	36%	0.363	C	S	.	.	S	Bend	trans	-68	156.8	-176.7	0	0	0	0	0	113.8	H80 L84 S85 K268	H80-G82 VanDerWaalsContact C-N 3.35Å; H80-G82 PolarHBondContact O-N 2.93Å; G82-L84 PolarHBondContact O-N 2.8Å; G82-S85 WeakPolarHBondContact CA-OG 3.5Å; G82-S85 PolarHBondContact O-N 2.96Å; G82-K268 PolarHBondContact O-NZ 3.4Å
83	P	92.6	Very high	97.2	Very high	115 Å²	115	55.1 Å²	55.1	75%	0.747	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-23.7	-176.8	25.7	-34.9	0	0	0	113.8	K268	P83-K268 WeakPolarHBondContact O-CD 3.26Å
84	L	94.8	Very high	97.3	Very high	108 Å²	108	54.9 Å²	54.9	57%	0.565	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.9	1.7	179.1	-58.3	-179.4	0	0	0	112.9	G82 L272	G82-L84 PolarHBondContact O-N 2.8Å; L84-L272 HydrophobicContact CD1-CD1 4.25Å; L84-L272 HydrophobicContact CD2-CB 3.85Å; L84-L272 HydrophobicContact CD2-CD1 3.91Å; L84-L272 HydrophobicContact CD2-CD2 4.21Å; L84-L272 HydrophobicContact CD2-CG 4.19Å
85	S	97.3	Very high	97.4	Very high	45 Å²	45	52 Å²	52	32%	0.315	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-80.7	125.3	-179.7	-53.6	0	0	0	0	110.5	S79 G82 K268	S79-S85 WeakPolarHBondContact O-CB 3.26Å; G82-S85 WeakPolarHBondContact CA-OG 3.5Å; G82-S85 PolarHBondContact O-N 2.96Å; S85-K268 VanDerWaalsContact O-CD 3.24Å; S85-K268 WeakPolarHBondContact O-CD 3.26Å; S85-K268 PolarHBondContact O-NZ 2.82Å
86	S	97.6	Very high	97.4	Very high	69 Å²	69	47 Å²	47	48%	0.483	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-79.1	168.6	171.2	59.7	0	0	0	0	111.3	H80 D265	H80-S86 VanDerWaalsContact CB-O 3.31Å; H80-S86 WeakPolarHBondContact CB-O 3.48Å; S86-D265 WeakPolarHBondContact CA-OD1 3.37Å
87	L	98.3	Very high	97.4	Very high	5 Å²	5	44.7 Å²	44.7	3%	0.026	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-66.4	149.4	167.8	-70.1	156.2	0	0	0	111.1	H80 H89 I92 T254 R257 W258 H264 D265	H80-L87 HydrophobicContact CB-CD2 4.01Å; H80-L87 HydrophobicContact CB-CG 4.33Å; L87-H89 PolarHBondContact O-CD2 3.31Å; L87-H89 PolarHBondContact O-N 3.15Å; L87-I92 HydrophobicContact CB-CD1 3.78Å; L87-I92 HydrophobicContact CD1-CD1 4.23Å; L87-I92 HydrophobicContact CG-CD1 4.49Å; L87-T254 HydrophobicContact CD2-CG2 4.11Å; L87-R257 HydrophobicContact CD2-CB 4.29Å; L87-R257 HydrophobicContact CD2-CG 3.9Å; L87-W258 HydrophobicContact CD1-CB 4.01Å; L87-H264 HydrophobicContact CD1-CB 3.88Å; L87-D265 PolarHBondContact N-OD1 3.33Å
88	D	98.4	Very high	97.5	Very high	56 Å²	56	38.6 Å²	38.6	30%	0.299	24%	0.236	S	C	.	.			trans	-81.9	102.7	169.5	175.8	3.8	0	0	0	109.2	A90 S91 I92	D88-A90 VanDerWaalsContact C-N 3.27Å; D88-A90 PolarHBondContact O-N 3.37Å; D88-A90 WeakPolarHBondContact OD1-CB 3.35Å; D88-A90 PolarHBondContact OD1-N 3.25Å; D88-S91 WeakPolarHBondContact O-CA 3.13Å; D88-S91 VanDerWaalsContact O-CB 3.29Å; D88-S91 WeakPolarHBondContact O-CB 3.42Å; D88-S91 PolarHBondContact O-N 3.12Å; D88-S91 VanDerWaalsContact O-N 3.09Å; D88-S91 PolarHBondContact OD1-N 3.1Å; D88-S91 WeakPolarHBondContact OD2-CB 3.46Å; D88-I92 WeakPolarHBondContact O-CG1 3.2Å; D88-I92 PolarHBondContact O-N 2.85Å
89	H	98.3	Very high	97.5	Very high	74 Å²	74	37.8 Å²	37.8	34%	0.343	23%	0.233	S	C	.	.	H	α-helix	trans	-65.5	-25.8	-177.3	-76.3	-101.3	0	0	0	113.9	L87 I92 R93 V120 D265	L87-H89 PolarHBondContact O-CD2 3.31Å; L87-H89 PolarHBondContact O-N 3.15Å; H89-I92 PolarHBondContact O-N 3.08Å; H89-R93 PolarHBondContact O-N 3.07Å; H89-V120 PolarHBondContact ND1-O 3.39Å; H89-D265 IonicContact NE2-OD2 2.65Å; H89-D265 PolarHBondContact NE2-OD2 2.94Å
90	A	98.3	Very high	97.4	Very high	49 Å²	49	38.3 Å²	38.3	41%	0.405	23%	0.227	S	C	.	.	H	α-helix	trans	-70.4	-39.9	172.2	0	0	0	0	0	110.7	D88 R93 R94	D88-A90 VanDerWaalsContact C-N 3.27Å; D88-A90 PolarHBondContact O-N 3.37Å; D88-A90 WeakPolarHBondContact OD1-CB 3.35Å; D88-A90 PolarHBondContact OD1-N 3.25Å; A90-R93 PolarHBondContact O-N 3.24Å; A90-R94 PolarHBondContact O-N 3.42Å
91	S	98.5	Very high	97.4	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-62.9	-38.9	171.4	-173	0	0	0	0	112.2	D88 R94 G95 D251 T254	D88-S91 WeakPolarHBondContact O-CA 3.13Å; D88-S91 VanDerWaalsContact O-CB 3.29Å; D88-S91 WeakPolarHBondContact O-CB 3.42Å; D88-S91 PolarHBondContact O-N 3.12Å; D88-S91 VanDerWaalsContact O-N 3.09Å; D88-S91 PolarHBondContact OD1-N 3.1Å; D88-S91 WeakPolarHBondContact OD2-CB 3.46Å; S91-R94 VanDerWaalsContact CA-NH2 3.35Å; S91-R94 PolarHBondContact O-N 3.33Å; S91-G95 PolarHBondContact O-N 2.81Å; S91-D251 PolarHBondContact OG-OD1 3.35Å; S91-D251 VanDerWaalsContact OG-OD1 3.04Å; S91-T254 VanDerWaalsContact OG-CB 3.23Å; S91-T254 WeakPolarHBondContact OG-CB 3.44Å; S91-T254 PolarHBondContact OG-OG1 2.88Å
92	I	98.6	Very high	97.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.8	-45.3	172.3	-64.6	172.5	0	0	0	110.8	L87 D88 H89 G95 Y96 V120 T254 F255 W258	L87-I92 HydrophobicContact CB-CD1 3.78Å; L87-I92 HydrophobicContact CD1-CD1 4.23Å; L87-I92 HydrophobicContact CG-CD1 4.49Å; D88-I92 WeakPolarHBondContact O-CG1 3.2Å; D88-I92 PolarHBondContact O-N 2.85Å; H89-I92 PolarHBondContact O-N 3.08Å; I92-G95 PolarHBondContact O-N 3.27Å; I92-Y96 PolarHBondContact O-N 3.47Å; I92-V120 HydrophobicContact CD1-CG1 4.34Å; I92-V120 HydrophobicContact CG2-CG1 4.33Å; I92-T254 HydrophobicContact CG1-CG2 4.05Å; I92-F255 HydrophobicContact CG2-CD2 3.95Å; I92-W258 HydrophobicContact CD1-CB 3.69Å; I92-W258 HydrophobicContact CD1-CG 3.82Å; I92-W258 HydrophobicContact CG1-CB 4.05Å; I92-W258 HydrophobicContact CG1-CG 4.49Å; I92-W258 HydrophobicContact CG2-CB 4.37Å; I92-W258 HydrophobicContact CG2-CD2 4.16Å; I92-W258 HydrophobicContact CG2-CE3 4.14Å; I92-W258 HydrophobicContact CG2-CG 4.24Å
93	R	98.5	Very high	97.6	Very high	62 Å²	62	41.3 Å²	41.3	23%	0.234	23%	0.227	C	C	.	.	H	α-helix	trans	-60	-51.1	178.6	-172.7	-175.1	177.1	102.7	-6	111.5	H89 A90 G95 Y96 Q97 S121 H122 E126 E238	H89-R93 PolarHBondContact O-N 3.07Å; A90-R93 PolarHBondContact O-N 3.24Å; R93-G95 VanDerWaalsContact C-N 3.32Å; R93-G95 PolarHBondContact O-N 2.78Å; R93-Y96 WeakPolarHBondContact O-CB 3.31Å; R93-Y96 PolarHBondContact O-N 3.4Å; R93-Q97 PolarHBondContact O-N 3.44Å; R93-S121 PolarHBondContact NH1-O 2.9Å; R93-S121 VanDerWaalsContact NH1-O 3.08Å; R93-H122 PolarHBondContact NH1-CD2 2.94Å; R93-E126 IonicContact CZ-OE1 3.07Å; R93-E126 IonicContact CZ-OE2 3.17Å; R93-E126 VanDerWaalsContact NH1-CD 3.35Å; R93-E126 IonicContact NH1-OE1 2.9Å; R93-E126 PolarHBondContact NH1-OE1 2.85Å; R93-E126 VanDerWaalsContact NH1-OE1 3.12Å; R93-E126 IonicContact NH1-OE2 3.44Å; R93-E126 PolarHBondContact NH1-OE2 3.03Å; R93-E126 IonicContact NH2-OE1 3.88Å; R93-E126 PolarHBondContact NH2-OE1 3.29Å; R93-E126 IonicContact NH2-OE2 3.02Å; R93-E238 IonicContact CZ-OE2 2.71Å; R93-E238 IonicContact NE-OE2 3.82Å; R93-E238 PolarHBondContact NE-OE2 2.94Å; R93-E238 IonicContact NH2-OE2 3.86Å; R93-E238 PolarHBondContact NH2-OE2 3.44Å
94	R	98.6	Very high	97.8	Very high	23 Å²	23	37.6 Å²	37.6	9%	0.087	21%	0.205	C	C	.	.	H	α-helix	trans	-58.3	-44.7	175.1	-76.8	-166	-57.9	-80.7	-9.5	111.7	A90 S91 Y96 Q97 V98 Y237 D239 D251	A90-R94 PolarHBondContact O-N 3.42Å; S91-R94 VanDerWaalsContact CA-NH2 3.35Å; S91-R94 PolarHBondContact O-N 3.33Å; R94-Y96 VanDerWaalsContact C-N 3.32Å; R94-Y96 PolarHBondContact O-N 2.98Å; R94-Q97 WeakPolarHBondContact O-CA 3.22Å; R94-Q97 VanDerWaalsContact O-CB 3.24Å; R94-Q97 WeakPolarHBondContact O-CB 3.46Å; R94-Q97 PolarHBondContact O-N 2.58Å; R94-V98 WeakPolarHBondContact O-CG2 3.38Å; R94-V98 PolarHBondContact O-N 2.92Å; R94-Y237 HydrophobicContact CB-CD1 3.84Å; R94-Y237 HydrophobicContact CB-CE1 3.48Å; R94-Y237 VanDerWaalsContact CB-CE1 3.48Å; R94-Y237 HydrophobicContact CG-CD1 3.62Å; R94-Y237 HydrophobicContact CG-CE1 3.79Å; R94-Y237 HydrophobicContact CG-CG 4.12Å; R94-D239 WeakPolarHBondContact CD-OD2 3.29Å; R94-D239 IonicContact CZ-OD2 2.79Å; R94-D239 IonicContact NE-OD2 3.73Å; R94-D239 IonicContact NH1-OD2 3.74Å; R94-D239 PolarHBondContact NH1-OD2 3.2Å; R94-D251 HydrophobicContact CB-CB 3.86Å; R94-D251 IonicContact CZ-OD1 2.85Å; R94-D251 VanDerWaalsContact NE-CG 3.28Å; R94-D251 IonicContact NE-OD1 3.91Å; R94-D251 PolarHBondContact NE-OD1 3.46Å; R94-D251 VanDerWaalsContact NE-OD1 3.07Å; R94-D251 IonicContact NE-OD2 3.85Å; R94-D251 PolarHBondContact NE-OD2 3.5Å; R94-D251 IonicContact NH2-OD1 3.95Å; R94-D251 PolarHBondContact NH2-OD1 3.21Å
95	G	98.4	Very high	97.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.6	-33	179.6	0	0	0	0	0	113.9	S91 I92 R93 Q97 V98 Y99 D251	S91-G95 PolarHBondContact O-N 2.81Å; I92-G95 PolarHBondContact O-N 3.27Å; R93-G95 VanDerWaalsContact C-N 3.32Å; R93-G95 PolarHBondContact O-N 2.78Å; G95-Q97 VanDerWaalsContact C-N 3.34Å; G95-V98 PolarHBondContact O-N 3.23Å; G95-Y99 PolarHBondContact O-N 2.8Å; G95-D251 VanDerWaalsContact CA-C 3.43Å; G95-D251 WeakPolarHBondContact CA-O 3.33Å
96	Y	98.4	Very high	97.8	Very high	9 Å²	9	35.7 Å²	35.7	4%	0.035	20%	0.204	C	C	.	.	H	α-helix	trans	-62.4	-42.5	169.9	173.6	-105.3	0	0	0	111.3	I92 R93 R94 V98 Y99 K100 L117 H122 I130 F157 F255	I92-Y96 PolarHBondContact O-N 3.47Å; R93-Y96 WeakPolarHBondContact O-CB 3.31Å; R93-Y96 PolarHBondContact O-N 3.4Å; R94-Y96 VanDerWaalsContact C-N 3.32Å; R94-Y96 PolarHBondContact O-N 2.98Å; Y96-V98 VanDerWaalsContact C-N 3.33Å; Y96-V98 PolarHBondContact O-N 2.89Å; Y96-Y99 HydrophobicContact CE2-CD1 4.48Å; Y96-Y99 PolarHBondContact O-N 3.28Å; Y96-K100 HydrophobicContact CE1-CB 4.49Å; Y96-K100 HydrophobicContact CE1-CD 4.16Å; Y96-K100 WeakPolarHBondContact O-CB 3.4Å; Y96-K100 PolarHBondContact O-N 3.17Å; Y96-L117 HydrophobicContact CD1-CD1 4.44Å; Y96-L117 HydrophobicContact CD2-CD1 4.08Å; Y96-L117 HydrophobicContact CD2-CD2 4.05Å; Y96-L117 HydrophobicContact CE1-CD1 4.09Å; Y96-L117 HydrophobicContact CE2-CD1 3.7Å; Y96-L117 HydrophobicContact CE2-CD2 4.43Å; Y96-L117 HydrophobicContact CG-CD1 4.43Å; Y96-L117 HydrophobicContact CG-CD2 4.34Å; Y96-H122 AromaticContact CD1-CE1 3.45Å; Y96-H122 VanDerWaalsContact CD1-CE1 3.45Å; Y96-H122 WeakPolarHBondContact CD1-CE1 3.42Å; Y96-H122 AromaticContact CD1-NE2 3.82Å; Y96-I130 HydrophobicContact CE1-CD1 4.24Å; Y96-I130 HydrophobicContact CE1-CG2 4.31Å; Y96-I130 WeakPolarHBondContact OH-CG2 3.42Å; Y96-F157 HydrophobicContact CD2-CZ 4.38Å; Y96-F157 HydrophobicContact CE2-CE1 4.03Å; Y96-F157 HydrophobicContact CE2-CE2 4.33Å; Y96-F157 AromaticContact CE2-CZ 3.71Å; Y96-F157 HydrophobicContact CE2-CZ 3.71Å; Y96-F255 AromaticContact CD2-CE2 3.76Å; Y96-F255 HydrophobicContact CD2-CE2 3.76Å; Y96-F255 AromaticContact CD2-CZ 3.73Å; Y96-F255 HydrophobicContact CD2-CZ 3.73Å; Y96-F255 HydrophobicContact CG-CE2 4.19Å
97	Q	98	Very high	97.9	Very high	18 Å²	18	33.6 Å²	33.6	8%	0.084	19%	0.186	C	C	.	.	H	α-helix	trans	-59.6	-44.2	175.3	-167.2	-175.3	-8.1	0	0	111.1	R93 R94 G95 K100 Q101 L235 E236	R93-Q97 PolarHBondContact O-N 3.44Å; R94-Q97 WeakPolarHBondContact O-CA 3.22Å; R94-Q97 VanDerWaalsContact O-CB 3.24Å; R94-Q97 WeakPolarHBondContact O-CB 3.46Å; R94-Q97 PolarHBondContact O-N 2.58Å; G95-Q97 VanDerWaalsContact C-N 3.34Å; Q97-K100 PolarHBondContact O-N 3.43Å; Q97-Q101 HydrophobicContact CG-CG 4.42Å; Q97-Q101 WeakPolarHBondContact O-CB 3.45Å; Q97-Q101 WeakPolarHBondContact O-CG 3.27Å; Q97-Q101 PolarHBondContact O-N 3.02Å; Q97-L235 HydrophobicContact CG-CD1 4.34Å; Q97-E236 PolarHBondContact NE2-O 3.24Å
98	V	98.3	Very high	97.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-59.1	-48.1	173.8	-175.2	0	0	0	0	111.2	R94 G95 Y96 K100 Q101 V102 L235 Y237 V248 V252	R94-V98 WeakPolarHBondContact O-CG2 3.38Å; R94-V98 PolarHBondContact O-N 2.92Å; G95-V98 PolarHBondContact O-N 3.23Å; Y96-V98 VanDerWaalsContact C-N 3.33Å; Y96-V98 PolarHBondContact O-N 2.89Å; V98-K100 PolarHBondContact O-N 2.81Å; V98-Q101 PolarHBondContact O-N 2.63Å; V98-V102 HydrophobicContact CG1-CG2 4.33Å; V98-V102 VanDerWaalsContact O-CB 3.32Å; V98-V102 WeakPolarHBondContact O-CB 3.41Å; V98-V102 PolarHBondContact O-N 3.48Å; V98-L235 HydrophobicContact CB-CD2 4.31Å; V98-L235 HydrophobicContact CG1-CD2 4.35Å; V98-L235 HydrophobicContact CG2-CD2 3.96Å; V98-Y237 HydrophobicContact CG2-CE1 3.97Å; V98-V248 HydrophobicContact CB-CG1 4.36Å; V98-V248 HydrophobicContact CG1-CG1 3.53Å; V98-V248 HydrophobicContact CG2-CG1 3.83Å; V98-V252 HydrophobicContact CB-CB 4.03Å; V98-V252 HydrophobicContact CB-CG2 4.24Å; V98-V252 HydrophobicContact CG1-CB 3.87Å; V98-V252 HydrophobicContact CG1-CG1 4.48Å; V98-V252 HydrophobicContact CG1-CG2 4.06Å
99	Y	98.3	Very high	97.8	Very high	6 Å²	6	32 Å²	32	2%	0.024	18%	0.179	C	C	.	.	I	π-helix	trans	-58.4	-49.6	177	168.8	-96.2	0	0	0	111.3	G95 Y96 Q101 C103 S104 H107 M109 F157 L179 F255	G95-Y99 PolarHBondContact O-N 2.8Å; Y96-Y99 HydrophobicContact CE2-CD1 4.48Å; Y96-Y99 PolarHBondContact O-N 3.28Å; Y99-Q101 VanDerWaalsContact C-N 3.34Å; Y99-Q101 PolarHBondContact O-N 2.83Å; Y99-C103 HydrophobicContact CD2-CB 3.68Å; Y99-C103 HydrophobicContact CE2-CB 4.19Å; Y99-C103 HydrophobicContact CG-CB 4.43Å; Y99-C103 CarbonylContact O-C 3.55Å; Y99-C103 WeakPolarHBondContact O-CA 3.35Å; Y99-C103 PolarHBondContact O-N 2.91Å; Y99-S104 WeakPolarHBondContact O-CB 3.43Å; Y99-S104 PolarHBondContact O-N 2.96Å; Y99-H107 PolarHBondContact OH-O 3.13Å; Y99-H107 VanDerWaalsContact OH-O 3.13Å; Y99-M109 HydrophobicContact CD1-CE 3.46Å; Y99-M109 VanDerWaalsContact CD1-CE 3.46Å; Y99-M109 HydrophobicContact CD2-CE 3.85Å; Y99-M109 HydrophobicContact CE1-CE 3.23Å; Y99-M109 HydrophobicContact CE2-CB 4.16Å; Y99-M109 HydrophobicContact CE2-CE 3.66Å; Y99-M109 HydrophobicContact CE2-SD 4.47Å; Y99-M109 HydrophobicContact CG-CE 3.77Å; Y99-M109 WeakPolarHBondContact OH-CB 3.32Å; Y99-F157 HydrophobicContact CE1-CD2 4.3Å; Y99-L179 HydrophobicContact CD2-CD1 4.31Å; Y99-L179 HydrophobicContact CE2-CD1 4.29Å; Y99-F255 HydrophobicContact CD1-CE1 4.29Å; Y99-F255 HydrophobicContact CD2-CE1 4.44Å; Y99-F255 AromaticContact CG-CE1 3.88Å; Y99-F255 HydrophobicContact CG-CE1 3.88Å
100	K	97.3	Very high	97.7	Very high	69 Å²	69	31.4 Å²	31.4	30%	0.3	18%	0.177	S	C	.	.	I	π-helix	trans	-60.5	-43.1	-177.7	-176.3	-178.4	176.9	-169.2	0	111.4	Y96 Q97 V98 S104 E133	Y96-K100 HydrophobicContact CE1-CB 4.49Å; Y96-K100 HydrophobicContact CE1-CD 4.16Å; Y96-K100 WeakPolarHBondContact O-CB 3.4Å; Y96-K100 PolarHBondContact O-N 3.17Å; Q97-K100 PolarHBondContact O-N 3.43Å; V98-K100 PolarHBondContact O-N 2.81Å; K100-S104 PolarHBondContact O-OG 3.43Å; K100-E133 IonicContact NZ-OE2 3.97Å; K100-E133 PolarHBondContact NZ-OE2 2.69Å
101	Q	96.8	Very high	97.7	Very high	107 Å²	107	35.2 Å²	35.2	50%	0.5	18%	0.182	S	C	.	.	I	π-helix	trans	-88.1	-29.2	-173.1	-64.7	-175.1	0.1	0	0	114.3	Q97 V98 Y99	Q97-Q101 HydrophobicContact CG-CG 4.42Å; Q97-Q101 WeakPolarHBondContact O-CB 3.45Å; Q97-Q101 WeakPolarHBondContact O-CG 3.27Å; Q97-Q101 PolarHBondContact O-N 3.02Å; V98-Q101 PolarHBondContact O-N 2.63Å; Y99-Q101 VanDerWaalsContact C-N 3.34Å; Y99-Q101 PolarHBondContact O-N 2.83Å
102	V	96.7	Very high	97.6	Very high	31 Å²	31	35.5 Å²	35.5	19%	0.188	18%	0.183	C	C	.	.	I	π-helix	trans	-112	-49	-173.7	-176.3	0	0	0	0	111.9	V98 P229 I230 I234 L235	V98-V102 HydrophobicContact CG1-CG2 4.33Å; V98-V102 VanDerWaalsContact O-CB 3.32Å; V98-V102 WeakPolarHBondContact O-CB 3.41Å; V98-V102 PolarHBondContact O-N 3.48Å; V102-P229 HydrophobicContact CG1-CB 4.39Å; V102-P229 WeakPolarHBondContact CG1-O 3.25Å; V102-I230 HydrophobicContact CG1-CG2 4.37Å; V102-I234 HydrophobicContact CG2-CG1 3.77Å; V102-L235 HydrophobicContact CG2-CD2 4.15Å
103	C	97.2	Very high	97.6	Very high	21 Å²	21	35.5 Å²	35.5	14%	0.142	18%	0.183	C	C	.	.	I	π-helix	trans	-90.3	-32.5	-166.5	-51.9	0	0	0	0	113.5	Y99 A105 C106 H107 L179	Y99-C103 HydrophobicContact CD2-CB 3.68Å; Y99-C103 HydrophobicContact CE2-CB 4.19Å; Y99-C103 HydrophobicContact CG-CB 4.43Å; Y99-C103 CarbonylContact O-C 3.55Å; Y99-C103 WeakPolarHBondContact O-CA 3.35Å; Y99-C103 PolarHBondContact O-N 2.91Å; C103-A105 PolarHBondContact O-N 3.19Å; C103-A105 VanDerWaalsContact O-N 3.13Å; C103-C106 PolarHBondContact O-N 3.11Å; C103-H107 WeakPolarHBondContact O-CB 3.5Å; C103-H107 PolarHBondContact O-N 3.07Å; C103-L179 HydrophobicContact CB-CD1 4.19Å
104	S	96.9	Very high	97.6	Very high	38 Å²	38	32.7 Å²	32.7	27%	0.266	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-22.6	-172.2	71.9	0	0	0	0	113.8	Y99 K100 C106 P160	Y99-S104 WeakPolarHBondContact O-CB 3.43Å; Y99-S104 PolarHBondContact O-N 2.96Å; K100-S104 PolarHBondContact O-OG 3.43Å; S104-C106 VanDerWaalsContact C-N 3.29Å; S104-C106 PolarHBondContact O-N 2.96Å; S104-P160 WeakPolarHBondContact O-CB 3.4Å
105	A	96.1	Very high	97.6	Very high	67 Å²	67	37.6 Å²	37.6	55%	0.554	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-25.4	175.6	0	0	0	0	0	113.3	C103 P160	C103-A105 PolarHBondContact O-N 3.19Å; C103-A105 VanDerWaalsContact O-N 3.13Å; A105-P160 WeakPolarHBondContact O-CB 3.16Å
106	C	97.5	Very high	97.5	Very high	46 Å²	46	39.6 Å²	39.6	31%	0.311	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.9	-29.6	-177.3	-67	0	0	0	0	113.6	C103 S104 P176	C103-C106 PolarHBondContact O-N 3.11Å; S104-C106 VanDerWaalsContact C-N 3.29Å; S104-C106 PolarHBondContact O-N 2.96Å; C106-P176 HydrophobicContact CB-CG 4.46Å; C106-P176 VanDerWaalsContact O-CB 3.24Å; C106-P176 WeakPolarHBondContact O-CB 3.39Å
107	H	98.4	Very high	97.5	Very high	25 Å²	25	39.2 Å²	39.2	12%	0.116	20%	0.2	C	C	.	.			trans	-110.6	124.4	-174.2	-71.5	-84	0	0	0	112.1	Y99 C103 P177 L179	Y99-H107 PolarHBondContact OH-O 3.13Å; Y99-H107 VanDerWaalsContact OH-O 3.13Å; C103-H107 WeakPolarHBondContact O-CB 3.5Å; C103-H107 PolarHBondContact O-N 3.07Å; H107-P177 PolarHBondContact ND1-O 2.82Å; H107-L179 HydrophobicContact CB-CD1 3.39Å; H107-L179 HydrophobicContact CB-CG 3.64Å
108	S	97.9	Very high	97.5	Very high	25 Å²	25	40.6 Å²	40.6	18%	0.175	21%	0.21	C	C	.	.			trans	-72.1	159.8	167.4	64.2	0	0	0	0	111.3	D178 L179	S108-D178 WeakPolarHBondContact CB-OD2 3.38Å; S108-D178 VanDerWaalsContact O-OD2 3.12Å; S108-D178 WeakPolarHBondContact OG-CB 3.43Å; S108-D178 PolarHBondContact OG-OD2 2.95Å; S108-L179 PolarHBondContact O-N 2.74Å
109	M	97.5	Very high	97.5	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	25%	0.246	C	C	.	.			trans	-143.5	71.7	167.8	-175.6	156.7	51.1	0	0	108.4	Y99 Y111 L112 F157 D178 S180 F255 A259	Y99-M109 HydrophobicContact CD1-CE 3.46Å; Y99-M109 VanDerWaalsContact CD1-CE 3.46Å; Y99-M109 HydrophobicContact CD2-CE 3.85Å; Y99-M109 HydrophobicContact CE1-CE 3.23Å; Y99-M109 HydrophobicContact CE2-CB 4.16Å; Y99-M109 HydrophobicContact CE2-CE 3.66Å; Y99-M109 HydrophobicContact CE2-SD 4.47Å; Y99-M109 HydrophobicContact CG-CE 3.77Å; Y99-M109 WeakPolarHBondContact OH-CB 3.32Å; M109-Y111 VanDerWaalsContact C-N 3.26Å; M109-Y111 PolarHBondContact O-N 3.26Å; M109-L112 HydrophobicContact CE-CD1 4.34Å; M109-L112 HydrophobicContact CG-CB 4.18Å; M109-L112 HydrophobicContact CG-CD1 4.35Å; M109-L112 HydrophobicContact CG-CG 4.19Å; M109-L112 PolarHBondContact O-N 3.42Å; M109-L112 HydrophobicContact SD-CD1 3.89Å; M109-L112 HydrophobicContact SD-CG 4.37Å; M109-F157 HydrophobicContact CB-CD2 4.16Å; M109-F157 HydrophobicContact CE-CD2 3.38Å; M109-F157 HydrophobicContact CE-CE2 3.39Å; M109-F157 HydrophobicContact CG-CD2 4.16Å; M109-F157 HydrophobicContact SD-CD2 4.49Å; M109-D178 VanDerWaalsContact CA-OD2 3.29Å; M109-D178 WeakPolarHBondContact CA-OD2 3.48Å; M109-D178 PolarHBondContact N-OD2 3Å; M109-S180 VanDerWaalsContact CA-OG 3.32Å; M109-S180 WeakPolarHBondContact CA-OG 3.12Å; M109-S180 WeakPolarHBondContact CG-OG 3.31Å; M109-F255 HydrophobicContact CE-CE1 3.5Å; M109-F255 VanDerWaalsContact CE-CE1 3.5Å; M109-F255 HydrophobicContact CE-CZ 3.48Å; M109-F255 VanDerWaalsContact CE-CZ 3.48Å; M109-F255 HydrophobicContact SD-CE1 3.94Å; M109-F255 HydrophobicContact SD-CZ 4.14Å; M109-A259 HydrophobicContact SD-CB 3.97Å
110	E	95.7	Very high	97.4	Very high	63 Å²	63	45.5 Å²	45.5	29%	0.294	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-17.7	-164.5	70	-177.4	174.5	0	0	115.1	Y156 K159 D178 S180	E110-Y156 WeakPolarHBondContact O-CD1 3.37Å; E110-K159 IonicContact OE2-NZ 2.85Å; E110-K159 PolarHBondContact OE2-NZ 3.29Å; E110-D178 PolarHBondContact N-OD2 3.49Å; E110-S180 PolarHBondContact N-OG 3.41Å; E110-S180 VanDerWaalsContact N-OG 3.17Å
111	Y	97.6	Very high	97.4	Very high	128 Å²	128	42.9 Å²	42.9	50%	0.502	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	-3.1	-176.7	-60.8	-74.4	0	0	0	113.9	M109 S180 Y181	M109-Y111 VanDerWaalsContact C-N 3.26Å; M109-Y111 PolarHBondContact O-N 3.26Å; Y111-S180 PolarHBondContact N-OG 3.02Å; Y111-Y181 AromaticContact CD2-CD2 3.88Å; Y111-Y181 HydrophobicContact CD2-CD2 3.88Å; Y111-Y181 AromaticContact CD2-CE2 3.68Å; Y111-Y181 HydrophobicContact CD2-CE2 3.68Å; Y111-Y181 HydrophobicContact CE2-CD2 4.23Å; Y111-Y181 HydrophobicContact CE2-CE2 4.2Å; Y111-Y181 AromaticContact CG-CE2 3.9Å; Y111-Y181 HydrophobicContact CG-CE2 3.9Å
112	L	97.7	Very high	97.5	Very high	6 Å²	6	38.3 Å²	38.3	3%	0.031	22%	0.224	C	C	.	.			trans	-105.5	133	174.1	-70.5	-164	0	0	0	112.3	M109 N116 Y156 F157 F255 W258 A259	M109-L112 HydrophobicContact CE-CD1 4.34Å; M109-L112 HydrophobicContact CG-CB 4.18Å; M109-L112 HydrophobicContact CG-CD1 4.35Å; M109-L112 HydrophobicContact CG-CG 4.19Å; M109-L112 PolarHBondContact O-N 3.42Å; M109-L112 HydrophobicContact SD-CD1 3.89Å; M109-L112 HydrophobicContact SD-CG 4.37Å; L112-N116 HydrophobicContact CD2-CB 4.29Å; L112-Y156 WeakPolarHBondContact O-CA 3.4Å; L112-Y156 WeakPolarHBondContact O-CD1 3.29Å; L112-F157 HydrophobicContact CB-CD2 3.71Å; L112-F157 HydrophobicContact CB-CE2 3.44Å; L112-F157 VanDerWaalsContact CB-CE2 3.44Å; L112-F157 HydrophobicContact CB-CZ 4.25Å; L112-F157 HydrophobicContact CD1-CE2 3.92Å; L112-F157 HydrophobicContact CG-CE2 4.35Å; L112-F157 PolarHBondContact O-N 2.86Å; L112-F255 HydrophobicContact CD1-CZ 4.47Å; L112-W258 HydrophobicContact CD1-CE3 4.17Å; L112-W258 HydrophobicContact CD1-CH2 3.83Å; L112-W258 HydrophobicContact CD1-CZ3 3.38Å; L112-W258 HydrophobicContact CD2-CH2 4.49Å; L112-A259 HydrophobicContact CD1-CB 3.68Å; L112-A259 HydrophobicContact CG-CB 4.42Å
113	A	98	Very high	97.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-106.2	158.4	170.3	0	0	0	0	0	111.2	R115 N116 D155 Y156	A113-R115 HydrophobicContact CB-CG 3.88Å; A113-R115 PolarHBondContact O-N 2.9Å; A113-N116 PolarHBondContact N-OD1 3.21Å; A113-N116 VanDerWaalsContact O-CB 3.25Å; A113-N116 WeakPolarHBondContact O-CB 3.44Å; A113-N116 PolarHBondContact O-N 3.37Å; A113-N116 PolarHBondContact O-OD1 3.32Å; A113-D155 VanDerWaalsContact CA-O 3.26Å; A113-D155 WeakPolarHBondContact CA-O 3.47Å; A113-D155 VanDerWaalsContact CB-O 3.26Å; A113-D155 WeakPolarHBondContact CB-O 3.46Å; A113-Y156 HydrophobicContact CB-CD1 4.05Å; A113-Y156 HydrophobicContact CB-CE1 4.21Å; A113-Y156 HydrophobicContact CB-CG 4.29Å
114	F	98.1	Very high	97.6	Very high	3 Å²	3	45.1 Å²	45.1	1%	0.013	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-54	-43.1	180	-70.9	-71.9	0	0	0	111.5	N116 L117 V127 I130 A131 V134 D155 F157	F114-N116 PolarHBondContact O-N 3.25Å; F114-L117 WeakPolarHBondContact O-CB 3.34Å; F114-L117 PolarHBondContact O-N 3Å; F114-V127 HydrophobicContact CB-CG1 3.7Å; F114-V127 WeakPolarHBondContact O-CG1 3.24Å; F114-I130 HydrophobicContact CD1-CG2 4.24Å; F114-I130 HydrophobicContact CE1-CG2 3.97Å; F114-A131 HydrophobicContact CB-CB 4.17Å; F114-A131 HydrophobicContact CD1-CB 4.1Å; F114-A131 HydrophobicContact CD2-CB 3.8Å; F114-A131 HydrophobicContact CE1-CB 4.47Å; F114-A131 HydrophobicContact CE2-CB 4.19Å; F114-A131 HydrophobicContact CG-CB 3.76Å; F114-V134 HydrophobicContact CZ-CG2 4.15Å; F114-D155 HydrophobicContact CD2-CB 4.26Å; F114-D155 VanDerWaalsContact CD2-O 3.26Å; F114-D155 WeakPolarHBondContact CD2-O 3.39Å; F114-D155 HydrophobicContact CE2-CB 4.45Å; F114-D155 PolarHBondContact N-O 3.33Å; F114-F157 AromaticContact CD1-CD1 3.9Å; F114-F157 HydrophobicContact CD1-CD1 3.9Å; F114-F157 AromaticContact CD1-CE1 3.56Å; F114-F157 HydrophobicContact CD1-CE1 3.56Å; F114-F157 AromaticContact CE1-CD1 3.67Å; F114-F157 HydrophobicContact CE1-CD1 3.67Å; F114-F157 AromaticContact CE1-CE1 3.71Å; F114-F157 HydrophobicContact CE1-CE1 3.71Å; F114-F157 HydrophobicContact CE2-CD1 4.36Å; F114-F157 HydrophobicContact CG-CD1 4.33Å; F114-F157 HydrophobicContact CG-CE1 4.14Å; F114-F157 AromaticContact CZ-CD1 3.92Å; F114-F157 HydrophobicContact CZ-CD1 3.92Å; F114-F157 HydrophobicContact CZ-CE1 4.41Å
115	R	98.1	Very high	97.7	Very high	126 Å²	126	49.1 Å²	49.1	48%	0.475	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-53.1	-24.2	175.1	62.1	177.3	-179.5	80.9	2.8	114.7	A113 L117 V118 L153	A113-R115 HydrophobicContact CB-CG 3.88Å; A113-R115 PolarHBondContact O-N 2.9Å; R115-L117 PolarHBondContact O-N 2.82Å; R115-V118 PolarHBondContact O-N 2.92Å; R115-L153 HydrophobicContact CB-CB 4.38Å; R115-L153 WeakPolarHBondContact CB-O 3.47Å; R115-L153 WeakPolarHBondContact CG-O 3.47Å; R115-L153 PolarHBondContact N-O 3.38Å
116	N	98.1	Very high	97.7	Very high	43 Å²	43	49 Å²	49	23%	0.23	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-70.3	-23.7	178.8	-66.6	111.2	0	0	0	112.3	L112 A113 F114 V118 V120 W258	L112-N116 HydrophobicContact CD2-CB 4.29Å; A113-N116 PolarHBondContact N-OD1 3.21Å; A113-N116 VanDerWaalsContact O-CB 3.25Å; A113-N116 WeakPolarHBondContact O-CB 3.44Å; A113-N116 PolarHBondContact O-N 3.37Å; A113-N116 PolarHBondContact O-OD1 3.32Å; F114-N116 PolarHBondContact O-N 3.25Å; N116-V118 VanDerWaalsContact C-N 3.33Å; N116-V120 WeakPolarHBondContact O-CG2 3.24Å; N116-W258 HydrophobicContact CB-CH2 4.09Å; N116-W258 HydrophobicContact CB-CZ2 4.31Å; N116-W258 VanDerWaalsContact O-CZ2 3.27Å; N116-W258 WeakPolarHBondContact O-CZ2 3.38Å
117	L	97.9	Very high	97.7	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-24.3	177.6	-60.8	173.1	0	0	0	112.7	Y96 F114 R115 G119 V120 S121 H122 V127 F157 F255 W258	Y96-L117 HydrophobicContact CD1-CD1 4.44Å; Y96-L117 HydrophobicContact CD2-CD1 4.08Å; Y96-L117 HydrophobicContact CD2-CD2 4.05Å; Y96-L117 HydrophobicContact CE1-CD1 4.09Å; Y96-L117 HydrophobicContact CE2-CD1 3.7Å; Y96-L117 HydrophobicContact CE2-CD2 4.43Å; Y96-L117 HydrophobicContact CG-CD1 4.43Å; Y96-L117 HydrophobicContact CG-CD2 4.34Å; F114-L117 WeakPolarHBondContact O-CB 3.34Å; F114-L117 PolarHBondContact O-N 3Å; R115-L117 PolarHBondContact O-N 2.82Å; L117-G119 PolarHBondContact O-N 3.43Å; L117-V120 PolarHBondContact O-N 3.34Å; L117-V120 VanDerWaalsContact O-N 3.1Å; L117-S121 PolarHBondContact O-N 3.03Å; L117-H122 PolarHBondContact O-N 3.03Å; L117-V127 HydrophobicContact CB-CG2 3.72Å; L117-F157 HydrophobicContact CD1-CE1 4.1Å; L117-F157 HydrophobicContact CD1-CZ 3.88Å; L117-F157 HydrophobicContact CD2-CZ 4.34Å; L117-F157 HydrophobicContact CG-CZ 4.13Å; L117-F255 HydrophobicContact CD2-CE2 4.27Å; L117-W258 HydrophobicContact CD2-CH2 3.73Å; L117-W258 HydrophobicContact CD2-CZ3 3.81Å
118	V	98.4	Very high	97.7	Very high	48 Å²	48	50.5 Å²	50.5	29%	0.291	27%	0.265	S	S	.	.	B	Isolated β-bridge	trans	-65.3	124.4	-175.5	-178.8	0	0	0	0	110.5	R115 N116 V120 H122 E124 V127 L153	R115-V118 PolarHBondContact O-N 2.92Å; N116-V118 VanDerWaalsContact C-N 3.33Å; V118-V120 PolarHBondContact O-N 3.26Å; V118-H122 WeakPolarHBondContact CA-O 3.44Å; V118-E124 HydrophobicContact CG1-CB 3.98Å; V118-V127 HydrophobicContact CG2-CB 3.88Å; V118-V127 HydrophobicContact CG2-CG1 4.01Å; V118-V127 HydrophobicContact CG2-CG2 3.81Å; V118-L153 HydrophobicContact CG2-CD2 3.62Å
119	G	96.9	Very high	97.7	Very high	73 Å²	73	53.1 Å²	53.1	75%	0.753	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	4.1	-178.8	0	0	0	0	0	114.1	L117 H122	L117-G119 PolarHBondContact O-N 3.43Å; G119-H122 PolarHBondContact N-O 2.84Å
120	V	97.5	Very high	97.6	Very high	36 Å²	36	54 Å²	54	22%	0.218	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-67.4	170.4	179.6	0	0	0	0	109.4	H89 I92 N116 L117 V118 W258	H89-V120 PolarHBondContact ND1-O 3.39Å; I92-V120 HydrophobicContact CD1-CG1 4.34Å; I92-V120 HydrophobicContact CG2-CG1 4.33Å; N116-V120 WeakPolarHBondContact O-CG2 3.24Å; L117-V120 PolarHBondContact O-N 3.34Å; L117-V120 VanDerWaalsContact O-N 3.1Å; V118-V120 PolarHBondContact O-N 3.26Å; V120-W258 HydrophobicContact CB-CZ2 4.23Å; V120-W258 HydrophobicContact CG1-CD2 4.25Å; V120-W258 HydrophobicContact CG1-CG 4.43Å; V120-W258 HydrophobicContact CG1-CZ2 3.98Å; V120-W258 HydrophobicContact CG2-CZ2 4.06Å
121	S	96.9	Very high	97.7	Very high	14 Å²	14	51 Å²	51	10%	0.098	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	-19.6	-175.2	52.3	0	0	0	0	113.2	R93 L117	R93-S121 PolarHBondContact NH1-O 2.9Å; R93-S121 VanDerWaalsContact NH1-O 3.08Å; L117-S121 PolarHBondContact O-N 3.03Å
122	H	98.1	Very high	97.7	Very high	10 Å²	10	49.4 Å²	49.4	5%	0.046	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-136.8	158.4	-176.2	-60.5	78.6	0	0	0	110.6	R93 Y96 L117 V118 G119 E126 V127	R93-H122 PolarHBondContact NH1-CD2 2.94Å; Y96-H122 AromaticContact CD1-CE1 3.45Å; Y96-H122 VanDerWaalsContact CD1-CE1 3.45Å; Y96-H122 WeakPolarHBondContact CD1-CE1 3.42Å; Y96-H122 AromaticContact CD1-NE2 3.82Å; L117-H122 PolarHBondContact O-N 3.03Å; V118-H122 WeakPolarHBondContact CA-O 3.44Å; G119-H122 PolarHBondContact N-O 2.84Å; H122-E126 WeakPolarHBondContact CA-OE2 2.94Å; H122-E126 HydrophobicContact CB-CB 4.19Å; H122-V127 HydrophobicContact CB-CG2 3.41Å; H122-V127 VanDerWaalsContact CB-CG2 3.41Å
123	T	98.3	Very high	97.6	Very high	78 Å²	78	54.9 Å²	54.9	48%	0.479	29%	0.293	S	S	.	.			trans	-78.4	166	168.9	66	0	0	0	0	111	D125 E126 V127	T123-D125 VanDerWaalsContact C-N 3.35Å; T123-D125 PolarHBondContact O-N 3.36Å; T123-E126 PolarHBondContact N-OE2 3.46Å; T123-E126 PolarHBondContact O-N 3.31Å; T123-E126 VanDerWaalsContact OG1-CG 3.22Å; T123-E126 WeakPolarHBondContact OG1-CG 3.46Å; T123-E126 PolarHBondContact OG1-N 3.17Å; T123-E126 PolarHBondContact OG1-OE2 3.4Å; T123-V127 VanDerWaalsContact O-CG2 3.29Å; T123-V127 WeakPolarHBondContact O-CG2 3.46Å; T123-V127 PolarHBondContact O-N 3.27Å; T123-V127 VanDerWaalsContact O-N 3.09Å
124	E	97.9	Very high	97.4	Very high	118 Å²	118	56.4 Å²	56.4	55%	0.551	30%	0.302	S	S	*	.	H	α-helix	trans	-61.4	-42.6	179.3	-171.8	172.9	174	0	0	112.3	V118 V127 K128 L153	V118-E124 HydrophobicContact CG1-CB 3.98Å; E124-V127 PolarHBondContact O-N 2.66Å; E124-K128 WeakPolarHBondContact O-CB 3.45Å; E124-K128 PolarHBondContact O-N 3.47Å; E124-L153 HydrophobicContact CG-CD1 4.07Å
125	D	98.1	Very high	97.3	Very high	122 Å²	122	62.1 Å²	62.1	65%	0.652	33%	0.329	S	S	*	.	H	α-helix	trans	-66.6	-39.9	-179.6	-65	-30.3	0	0	0	112.2	T123 K128 T129	T123-D125 VanDerWaalsContact C-N 3.35Å; T123-D125 PolarHBondContact O-N 3.36Å; D125-K128 PolarHBondContact O-N 3.22Å; D125-T129 PolarHBondContact O-N 2.9Å; D125-T129 PolarHBondContact O-OG1 3.09Å
126	E	97.5	Very high	97.1	Very high	64 Å²	64	57.7 Å²	57.7	30%	0.299	32%	0.316	S	S	.	.	H	α-helix	trans	-62	-48.6	174.4	-73.6	174.6	138.7	0	0	111.2	R93 H122 T123 K128 T129 I130	R93-E126 IonicContact CZ-OE1 3.07Å; R93-E126 IonicContact CZ-OE2 3.17Å; R93-E126 VanDerWaalsContact NH1-CD 3.35Å; R93-E126 IonicContact NH1-OE1 2.9Å; R93-E126 PolarHBondContact NH1-OE1 2.85Å; R93-E126 VanDerWaalsContact NH1-OE1 3.12Å; R93-E126 IonicContact NH1-OE2 3.44Å; R93-E126 PolarHBondContact NH1-OE2 3.03Å; R93-E126 IonicContact NH2-OE1 3.88Å; R93-E126 PolarHBondContact NH2-OE1 3.29Å; R93-E126 IonicContact NH2-OE2 3.02Å; H122-E126 WeakPolarHBondContact CA-OE2 2.94Å; H122-E126 HydrophobicContact CB-CB 4.19Å; T123-E126 PolarHBondContact N-OE2 3.46Å; T123-E126 PolarHBondContact O-N 3.31Å; T123-E126 VanDerWaalsContact OG1-CG 3.22Å; T123-E126 WeakPolarHBondContact OG1-CG 3.46Å; T123-E126 PolarHBondContact OG1-N 3.17Å; T123-E126 PolarHBondContact OG1-OE2 3.4Å; E126-K128 VanDerWaalsContact C-N 3.3Å; E126-K128 PolarHBondContact O-N 3.15Å; E126-T129 WeakPolarHBondContact O-CB 3.32Å; E126-T129 PolarHBondContact O-N 3.04Å; E126-I130 WeakPolarHBondContact O-CD1 3.32Å; E126-I130 VanDerWaalsContact O-CG1 3.27Å; E126-I130 WeakPolarHBondContact O-CG1 3.41Å; E126-I130 PolarHBondContact O-N 3.32Å
127	V	97.8	Very high	96.9	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-65.2	-37.1	-179.8	175.8	0	0	0	0	111.3	F114 L117 V118 H122 T123 E124 T129 I130 A131 L153	F114-V127 HydrophobicContact CB-CG1 3.7Å; F114-V127 WeakPolarHBondContact O-CG1 3.24Å; L117-V127 HydrophobicContact CB-CG2 3.72Å; V118-V127 HydrophobicContact CG2-CB 3.88Å; V118-V127 HydrophobicContact CG2-CG1 4.01Å; V118-V127 HydrophobicContact CG2-CG2 3.81Å; H122-V127 HydrophobicContact CB-CG2 3.41Å; H122-V127 VanDerWaalsContact CB-CG2 3.41Å; T123-V127 VanDerWaalsContact O-CG2 3.29Å; T123-V127 WeakPolarHBondContact O-CG2 3.46Å; T123-V127 PolarHBondContact O-N 3.27Å; T123-V127 VanDerWaalsContact O-N 3.09Å; E124-V127 PolarHBondContact O-N 2.66Å; V127-T129 VanDerWaalsContact C-N 3.35Å; V127-I130 PolarHBondContact O-N 2.83Å; V127-A131 WeakPolarHBondContact O-CB 3.44Å; V127-A131 PolarHBondContact O-N 2.95Å; V127-L153 HydrophobicContact CB-CD2 4.03Å; V127-L153 HydrophobicContact CG1-CD2 3.53Å
128	K	97.9	Very high	96.8	Very high	102 Å²	102	63.1 Å²	63.1	44%	0.443	35%	0.348	S	S	.	.	H	α-helix	trans	-61	-46.5	175.5	-174.3	-178.9	177.5	-171.7	0	110.9	E124 D125 E126 I130 A131 E132	E124-K128 WeakPolarHBondContact O-CB 3.45Å; E124-K128 PolarHBondContact O-N 3.47Å; D125-K128 PolarHBondContact O-N 3.22Å; E126-K128 VanDerWaalsContact C-N 3.3Å; E126-K128 PolarHBondContact O-N 3.15Å; K128-I130 VanDerWaalsContact C-N 3.34Å; K128-I130 PolarHBondContact O-N 3.17Å; K128-A131 PolarHBondContact O-N 3.44Å; K128-E132 WeakPolarHBondContact CE-OE1 3.25Å; K128-E132 WeakPolarHBondContact O-CG 3.21Å; K128-E132 PolarHBondContact O-N 3.32Å
129	T	97.7	Very high	96.5	Very high	81 Å²	81	62.1 Å²	62.1	50%	0.497	35%	0.348	S	S	.	.	H	α-helix	trans	-58.9	-46.4	175.3	-52.1	0	0	0	0	110.9	D125 E126 V127 A131 E132 E133	D125-T129 PolarHBondContact O-N 2.9Å; D125-T129 PolarHBondContact O-OG1 3.09Å; E126-T129 WeakPolarHBondContact O-CB 3.32Å; E126-T129 PolarHBondContact O-N 3.04Å; V127-T129 VanDerWaalsContact C-N 3.35Å; T129-A131 VanDerWaalsContact C-N 3.31Å; T129-A131 PolarHBondContact O-N 3.43Å; T129-E132 PolarHBondContact O-N 3.38Å; T129-E133 PolarHBondContact O-N 2.93Å
130	I	96.2	Very high	96.3	Very high	20 Å²	20	63 Å²	63	10%	0.103	34%	0.34	C	S	.	.	H	α-helix	trans	-62.2	-37.5	177.9	-68.1	161.8	0	0	0	112.2	Y96 F114 E126 V127 K128	Y96-I130 HydrophobicContact CE1-CD1 4.24Å; Y96-I130 HydrophobicContact CE1-CG2 4.31Å; Y96-I130 WeakPolarHBondContact OH-CG2 3.42Å; F114-I130 HydrophobicContact CD1-CG2 4.24Å; F114-I130 HydrophobicContact CE1-CG2 3.97Å; E126-I130 WeakPolarHBondContact O-CD1 3.32Å; E126-I130 VanDerWaalsContact O-CG1 3.27Å; E126-I130 WeakPolarHBondContact O-CG1 3.41Å; E126-I130 PolarHBondContact O-N 3.32Å; V127-I130 PolarHBondContact O-N 2.83Å; K128-I130 VanDerWaalsContact C-N 3.34Å; K128-I130 PolarHBondContact O-N 3.17Å
131	A	97.1	Very high	96.1	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-70.6	-38.9	178.4	0	0	0	0	0	111.5	F114 V127 K128 T129 E133 V134 G151	F114-A131 HydrophobicContact CB-CB 4.17Å; F114-A131 HydrophobicContact CD1-CB 4.1Å; F114-A131 HydrophobicContact CD2-CB 3.8Å; F114-A131 HydrophobicContact CE1-CB 4.47Å; F114-A131 HydrophobicContact CE2-CB 4.19Å; F114-A131 HydrophobicContact CG-CB 3.76Å; V127-A131 WeakPolarHBondContact O-CB 3.44Å; V127-A131 PolarHBondContact O-N 2.95Å; K128-A131 PolarHBondContact O-N 3.44Å; T129-A131 VanDerWaalsContact C-N 3.31Å; T129-A131 PolarHBondContact O-N 3.43Å; A131-E133 PolarHBondContact O-N 2.79Å; A131-V134 PolarHBondContact O-N 3.07Å; A131-V134 VanDerWaalsContact O-N 3.14Å; A131-G151 CarbonylContact C-O 3.59Å; A131-G151 CarbonylContact O-C 3.33Å; A131-G151 WeakPolarHBondContact O-CA 3.18Å; A131-G151 PolarHBondContact O-N 3.2Å
132	E	97.3	Very high	96	Very high	93 Å²	93	73.6 Å²	73.6	44%	0.435	39%	0.388	S	S	.	.	H	α-helix	trans	-66.4	-22.5	178.8	-73.7	172.4	-178.3	0	0	112.9	K128 T129 V134 P150	K128-E132 WeakPolarHBondContact CE-OE1 3.25Å; K128-E132 WeakPolarHBondContact O-CG 3.21Å; K128-E132 PolarHBondContact O-N 3.32Å; T129-E132 PolarHBondContact O-N 3.38Å; E132-V134 PolarHBondContact O-N 3.02Å; E132-P150 HydrophobicContact CB-CB 4.47Å; E132-P150 HydrophobicContact CG-CB 4.48Å
133	E	95.4	Very high	95.8	Very high	122 Å²	122	77.4 Å²	77.4	57%	0.57	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-16.6	173.1	-70.1	172.3	-171.2	0	0	113.8	K100 T129 A131	K100-E133 IonicContact NZ-OE2 3.97Å; K100-E133 PolarHBondContact NZ-OE2 2.69Å; T129-E133 PolarHBondContact O-N 2.93Å; A131-E133 PolarHBondContact O-N 2.79Å
134	V	94.4	Very high	95.6	Very high	32 Å²	32	76.4 Å²	76.4	19%	0.194	42%	0.421	C	S	.	.	S	Bend	trans	-106.7	127.5	-176.5	-178.5	0	0	0	0	110	F114 A131 E132 V136 G151 P158	F114-V134 HydrophobicContact CZ-CG2 4.15Å; A131-V134 PolarHBondContact O-N 3.07Å; A131-V134 VanDerWaalsContact O-N 3.14Å; E132-V134 PolarHBondContact O-N 3.02Å; V134-V136 HydrophobicContact CG1-CG2 4.37Å; V134-G151 PolarHBondContact O-N 3.1Å; V134-P158 HydrophobicContact CG1-CB 3.92Å; V134-P158 HydrophobicContact CG1-CG 3.79Å; V134-P158 HydrophobicContact CG2-CG 4.41Å
135	E	94.9	Very high	95.5	Very high	123 Å²	123	77.2 Å²	77.2	58%	0.575	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	128.9	170.8	-68.3	-64.8	151.3	0	0	110.7
136	V	94.8	Very high	95.4	Very high	33 Å²	33	77 Å²	77	20%	0.2	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	129.9	-179.8	-178.1	0	0	0	0	109.2	V134 T148 R149 D155	V134-V136 HydrophobicContact CG1-CG2 4.37Å; V136-T148 WeakPolarHBondContact O-CA 3.47Å; V136-R149 PolarHBondContact N-O 2.76Å; V136-R149 PolarHBondContact O-N 3.03Å; V136-D155 HydrophobicContact CG2-CB 4.46Å
137	V	94.3	Very high	95.3	Very high	100 Å²	100	78.1 Å²	78.1	61%	0.606	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.1	128.5	173.5	-178.5	0	0	0	0	109.4	M146 F147 T148	V137-M146 HydrophobicContact CG1-CB 4.15Å; V137-M146 HydrophobicContact CG1-CE 4.01Å; V137-F147 CarbonylContact C-O 3.53Å; V137-F147 WeakPolarHBondContact CA-O 3.21Å; V137-T148 HydrophobicContact CG2-CG2 4.07Å
138	D	94.4	Very high	95.2	Very high	56 Å²	56	82.5 Å²	82.5	30%	0.299	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	173.4	179	-153	-16.9	0	0	0	110.2	M146 F147 R149	D138-M146 WeakPolarHBondContact O-CE 3.16Å; D138-F147 HydrophobicContact CB-CE2 4.19Å; D138-F147 HydrophobicContact CB-CZ 4.08Å; D138-F147 PolarHBondContact N-O 3.19Å; D138-F147 PolarHBondContact O-N 3.47Å; D138-F147 VanDerWaalsContact O-O 3.04Å; D138-R149 HydrophobicContact CB-CG 4.14Å; D138-R149 IonicContact OD2-CZ 3.31Å; D138-R149 IonicContact OD2-NE 2.83Å; D138-R149 PolarHBondContact OD2-NE 2.94Å; D138-R149 IonicContact OD2-NH2 3.8Å; D138-R149 PolarHBondContact OD2-NH2 3.17Å
139	G	92.2	Very high	95.1	Very high	28 Å²	28	79.4 Å²	79.4	29%	0.289	44%	0.437	S	S	.	.			trans	120.8	-164.3	178.2	0	0	0	0	0	113.9
140	P	93.8	Very high	95.1	Very high	91 Å²	91	78.9 Å²	78.9	59%	0.591	44%	0.435	S	S	*	.			cis	-72.9	159.4	5.4	28	-34	0	0	0	114.4	E145 M146	P140-E145 CarbonylContact C-O 3.56Å; P140-E145 VanDerWaalsContact CA-O 3.29Å; P140-E145 WeakPolarHBondContact CA-O 3.12Å; P140-M146 HydrophobicContact CB-SD 4.28Å
141	D	93.9	Very high	95.2	Very high	63 Å²	63	78.1 Å²	78.1	34%	0.337	43%	0.433	S	S	.	.			trans	-82.9	-173.4	171.5	71.4	7.1	0	0	0	113.2	S143 G144 E145 F147	D141-S143 PolarHBondContact O-N 3Å; D141-S143 WeakPolarHBondContact OD1-CA 3.33Å; D141-S143 WeakPolarHBondContact OD1-CB 3.12Å; D141-S143 PolarHBondContact OD1-N 2.9Å; D141-S143 PolarHBondContact OD1-OG 2.81Å; D141-S143 PolarHBondContact OD2-OG 3.41Å; D141-S143 VanDerWaalsContact OD2-OG 3.06Å; D141-G144 PolarHBondContact O-N 3.04Å; D141-G144 PolarHBondContact OD1-N 3.41Å; D141-G144 VanDerWaalsContact OD1-N 3.07Å; D141-E145 PolarHBondContact N-O 3.41Å; D141-E145 PolarHBondContact OD1-N 3.44Å; D141-F147 HydrophobicContact CB-CD1 4.1Å; D141-F147 HydrophobicContact CB-CE1 4.36Å
142	E	94.3	Very high	95.2	Very high	210 Å²	210	82.8 Å²	82.8	98%	0.981	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-23.2	-179.7	-62.6	-172.3	168.9	0	0	113.6
143	S	93.7	Very high	95.2	Very high	90 Å²	90	80.3 Å²	80.3	63%	0.629	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-8.3	172.6	23.1	0	0	0	0	113.7	D141	D141-S143 PolarHBondContact O-N 3Å; D141-S143 WeakPolarHBondContact OD1-CA 3.33Å; D141-S143 WeakPolarHBondContact OD1-CB 3.12Å; D141-S143 PolarHBondContact OD1-N 2.9Å; D141-S143 PolarHBondContact OD1-OG 2.81Å; D141-S143 PolarHBondContact OD2-OG 3.41Å; D141-S143 VanDerWaalsContact OD2-OG 3.06Å
144	G	94.8	Very high	95.3	Very high	57 Å²	57	77.4 Å²	77.4	59%	0.588	44%	0.436	S	S	*	.	S	Bend	trans	84.6	12.6	-175.4	0	0	0	0	0	114	D141	D141-G144 PolarHBondContact O-N 3.04Å; D141-G144 PolarHBondContact OD1-N 3.41Å; D141-G144 VanDerWaalsContact OD1-N 3.07Å
145	E	95.1	Very high	95.5	Very high	134 Å²	134	76.9 Å²	76.9	63%	0.626	43%	0.432	S	S	*	.			trans	-97.9	145.9	-179.1	-61.9	-168.7	161.1	0	0	111.5	P140 D141	P140-E145 CarbonylContact C-O 3.56Å; P140-E145 VanDerWaalsContact CA-O 3.29Å; P140-E145 WeakPolarHBondContact CA-O 3.12Å; D141-E145 PolarHBondContact N-O 3.41Å; D141-E145 PolarHBondContact OD1-N 3.44Å
146	M	96.1	Very high	95.6	Very high	117 Å²	117	76.9 Å²	76.9	58%	0.576	43%	0.428	S	S	*	.			trans	-81.5	138.1	172	-60.6	-62.2	-67	0	0	109.1	V137 D138 P140	V137-M146 HydrophobicContact CG1-CB 4.15Å; V137-M146 HydrophobicContact CG1-CE 4.01Å; D138-M146 WeakPolarHBondContact O-CE 3.16Å; P140-M146 HydrophobicContact CB-SD 4.28Å
147	F	94.9	Very high	95.8	Very high	89 Å²	89	75.7 Å²	75.7	39%	0.39	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	164.3	179.7	66.1	-87.5	0	0	0	111.3	V137 D138 D141 R149	V137-F147 CarbonylContact C-O 3.53Å; V137-F147 WeakPolarHBondContact CA-O 3.21Å; D138-F147 HydrophobicContact CB-CE2 4.19Å; D138-F147 HydrophobicContact CB-CZ 4.08Å; D138-F147 PolarHBondContact N-O 3.19Å; D138-F147 PolarHBondContact O-N 3.47Å; D138-F147 VanDerWaalsContact O-O 3.04Å; D141-F147 HydrophobicContact CB-CD1 4.1Å; D141-F147 HydrophobicContact CB-CE1 4.36Å; F147-R149 HydrophobicContact CD2-CB 4.5Å; F147-R149 HydrophobicContact CE2-CB 4.19Å; F147-R149 HydrophobicContact CE2-CG 4.44Å
148	T	95.8	Very high	95.8	Very high	92 Å²	92	74 Å²	74	56%	0.564	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.1	143.8	173.1	53.6	0	0	0	0	110.3	V136 V137	V136-T148 WeakPolarHBondContact O-CA 3.47Å; V137-T148 HydrophobicContact CG2-CG2 4.07Å
149	R	97	Very high	95.9	Very high	36 Å²	36	77 Å²	77	14%	0.136	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	158	173.4	60.8	162.6	-179.6	74.7	9.2	110.7	V136 D138 F147 K152 D155	V136-R149 PolarHBondContact N-O 2.76Å; V136-R149 PolarHBondContact O-N 3.03Å; D138-R149 HydrophobicContact CB-CG 4.14Å; D138-R149 IonicContact OD2-CZ 3.31Å; D138-R149 IonicContact OD2-NE 2.83Å; D138-R149 PolarHBondContact OD2-NE 2.94Å; D138-R149 IonicContact OD2-NH2 3.8Å; D138-R149 PolarHBondContact OD2-NH2 3.17Å; F147-R149 HydrophobicContact CD2-CB 4.5Å; F147-R149 HydrophobicContact CE2-CB 4.19Å; F147-R149 HydrophobicContact CE2-CG 4.44Å; R149-K152 VanDerWaalsContact NH2-CE 3.28Å; R149-D155 IonicContact CZ-OD1 3.26Å; R149-D155 IonicContact CZ-OD2 3.43Å; R149-D155 IonicContact NH1-OD1 3.17Å; R149-D155 IonicContact NH1-OD2 3.8Å; R149-D155 PolarHBondContact NH1-OD2 3.11Å; R149-D155 IonicContact NH2-OD1 3.37Å; R149-D155 PolarHBondContact NH2-OD1 3.28Å; R149-D155 IonicContact NH2-OD2 2.71Å; R149-D155 PolarHBondContact NH2-OD2 3.36Å; R149-D155 VanDerWaalsContact NH2-OD2 3.17Å
150	P	97.5	Very high	96.1	Very high	70 Å²	70	77.7 Å²	77.7	46%	0.455	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	143.3	165.9	24.5	-34.5	0	0	0	110.5	E132	E132-P150 HydrophobicContact CB-CB 4.47Å; E132-P150 HydrophobicContact CG-CB 4.48Å
151	G	97.3	Very high	96.3	Very high	4 Å²	4	75.8 Å²	75.8	4%	0.041	40%	0.402	C	S	.	.			trans	-62.9	153.2	177.4	0	0	0	0	0	111.8	A131 V134 D155	A131-G151 CarbonylContact C-O 3.59Å; A131-G151 CarbonylContact O-C 3.33Å; A131-G151 WeakPolarHBondContact O-CA 3.18Å; A131-G151 PolarHBondContact O-N 3.2Å; V134-G151 PolarHBondContact O-N 3.1Å; G151-D155 WeakPolarHBondContact CA-OD2 3.34Å
152	K	97.3	Very high	96.4	Very high	98 Å²	98	78.3 Å²	78.3	43%	0.426	42%	0.421	S	S	.	.			trans	-126.1	165.3	175.2	69.2	-165.6	173.6	-160	0	110	R149 S154 D155	R149-K152 VanDerWaalsContact NH2-CE 3.28Å; K152-S154 WeakPolarHBondContact CE-OG 3.29Å; K152-S154 WeakPolarHBondContact CG-OG 3.37Å; K152-S154 PolarHBondContact O-N 2.86Å; K152-D155 WeakPolarHBondContact CG-OD2 3.48Å; K152-D155 PolarHBondContact N-OD2 3.49Å; K152-D155 WeakPolarHBondContact O-CB 3.42Å; K152-D155 PolarHBondContact O-N 3.04Å
153	L	97.6	Very high	96.5	Very high	41 Å²	41	71.7 Å²	71.7	22%	0.215	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.7	-34.9	-179.3	-78.2	150.9	0	0	0	114.4	R115 V118 E124 V127 D155	R115-L153 HydrophobicContact CB-CB 4.38Å; R115-L153 WeakPolarHBondContact CB-O 3.47Å; R115-L153 WeakPolarHBondContact CG-O 3.47Å; R115-L153 PolarHBondContact N-O 3.38Å; V118-L153 HydrophobicContact CG2-CD2 3.62Å; E124-L153 HydrophobicContact CG-CD1 4.07Å; V127-L153 HydrophobicContact CB-CD2 4.03Å; V127-L153 HydrophobicContact CG1-CD2 3.53Å; L153-D155 VanDerWaalsContact C-N 3.31Å; L153-D155 PolarHBondContact O-N 3.37Å
154	S	97.6	Very high	96.6	Very high	62 Å²	62	70.6 Å²	70.6	43%	0.434	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-15.8	-178.9	63.7	0	0	0	0	114.4	K152	K152-S154 WeakPolarHBondContact CE-OG 3.29Å; K152-S154 WeakPolarHBondContact CG-OG 3.37Å; K152-S154 PolarHBondContact O-N 2.86Å
155	D	98	Very high	96.8	Very high	21 Å²	21	73.9 Å²	73.9	11%	0.112	38%	0.384	C	S	.	.	S	Bend	trans	-72.4	147.4	-178	-63.8	-35.1	0	0	0	111	A113 F114 V136 R149 G151 K152 L153	A113-D155 VanDerWaalsContact CA-O 3.26Å; A113-D155 WeakPolarHBondContact CA-O 3.47Å; A113-D155 VanDerWaalsContact CB-O 3.26Å; A113-D155 WeakPolarHBondContact CB-O 3.46Å; F114-D155 HydrophobicContact CD2-CB 4.26Å; F114-D155 VanDerWaalsContact CD2-O 3.26Å; F114-D155 WeakPolarHBondContact CD2-O 3.39Å; F114-D155 HydrophobicContact CE2-CB 4.45Å; F114-D155 PolarHBondContact N-O 3.33Å; V136-D155 HydrophobicContact CG2-CB 4.46Å; R149-D155 IonicContact CZ-OD1 3.26Å; R149-D155 IonicContact CZ-OD2 3.43Å; R149-D155 IonicContact NH1-OD1 3.17Å; R149-D155 IonicContact NH1-OD2 3.8Å; R149-D155 PolarHBondContact NH1-OD2 3.11Å; R149-D155 IonicContact NH2-OD1 3.37Å; R149-D155 PolarHBondContact NH2-OD1 3.28Å; R149-D155 IonicContact NH2-OD2 2.71Å; R149-D155 PolarHBondContact NH2-OD2 3.36Å; R149-D155 VanDerWaalsContact NH2-OD2 3.17Å; G151-D155 WeakPolarHBondContact CA-OD2 3.34Å; K152-D155 WeakPolarHBondContact CG-OD2 3.48Å; K152-D155 PolarHBondContact N-OD2 3.49Å; K152-D155 WeakPolarHBondContact O-CB 3.42Å; K152-D155 PolarHBondContact O-N 3.04Å; L153-D155 VanDerWaalsContact C-N 3.31Å; L153-D155 PolarHBondContact O-N 3.37Å
156	Y	98.1	Very high	96.9	Very high	123 Å²	123	69 Å²	69	48%	0.482	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-77.6	160.8	174	-71.3	-91.6	0	0	0	110.9	E110 L112 A113	E110-Y156 WeakPolarHBondContact O-CD1 3.37Å; L112-Y156 WeakPolarHBondContact O-CA 3.4Å; L112-Y156 WeakPolarHBondContact O-CD1 3.29Å; A113-Y156 HydrophobicContact CB-CD1 4.05Å; A113-Y156 HydrophobicContact CB-CE1 4.21Å; A113-Y156 HydrophobicContact CB-CG 4.29Å
157	F	97.6	Very high	96.9	Very high	8 Å²	8	63.7 Å²	63.7	4%	0.035	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-59.5	138.2	173.3	-64.9	-31.2	0	0	0	111.2	Y96 Y99 M109 L112 F114 L117	Y96-F157 HydrophobicContact CD2-CZ 4.38Å; Y96-F157 HydrophobicContact CE2-CE1 4.03Å; Y96-F157 HydrophobicContact CE2-CE2 4.33Å; Y96-F157 AromaticContact CE2-CZ 3.71Å; Y96-F157 HydrophobicContact CE2-CZ 3.71Å; Y99-F157 HydrophobicContact CE1-CD2 4.3Å; M109-F157 HydrophobicContact CB-CD2 4.16Å; M109-F157 HydrophobicContact CE-CD2 3.38Å; M109-F157 HydrophobicContact CE-CE2 3.39Å; M109-F157 HydrophobicContact CG-CD2 4.16Å; M109-F157 HydrophobicContact SD-CD2 4.49Å; L112-F157 HydrophobicContact CB-CD2 3.71Å; L112-F157 HydrophobicContact CB-CE2 3.44Å; L112-F157 VanDerWaalsContact CB-CE2 3.44Å; L112-F157 HydrophobicContact CB-CZ 4.25Å; L112-F157 HydrophobicContact CD1-CE2 3.92Å; L112-F157 HydrophobicContact CG-CE2 4.35Å; L112-F157 PolarHBondContact O-N 2.86Å; F114-F157 AromaticContact CD1-CD1 3.9Å; F114-F157 HydrophobicContact CD1-CD1 3.9Å; F114-F157 AromaticContact CD1-CE1 3.56Å; F114-F157 HydrophobicContact CD1-CE1 3.56Å; F114-F157 AromaticContact CE1-CD1 3.67Å; F114-F157 HydrophobicContact CE1-CD1 3.67Å; F114-F157 AromaticContact CE1-CE1 3.71Å; F114-F157 HydrophobicContact CE1-CE1 3.71Å; F114-F157 HydrophobicContact CE2-CD1 4.36Å; F114-F157 HydrophobicContact CG-CD1 4.33Å; F114-F157 HydrophobicContact CG-CE1 4.14Å; F114-F157 AromaticContact CZ-CD1 3.92Å; F114-F157 HydrophobicContact CZ-CD1 3.92Å; F114-F157 HydrophobicContact CZ-CE1 4.41Å; L117-F157 HydrophobicContact CD1-CE1 4.1Å; L117-F157 HydrophobicContact CD1-CZ 3.88Å; L117-F157 HydrophobicContact CD2-CZ 4.34Å; L117-F157 HydrophobicContact CG-CZ 4.13Å
158	P	95.8	Very high	97	Very high	63 Å²	63	64.9 Å²	64.9	41%	0.409	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-62.9	140.6	-175.9	26.9	-35.8	0	0	0	110.6	V134	V134-P158 HydrophobicContact CG1-CB 3.92Å; V134-P158 HydrophobicContact CG1-CG 3.79Å; V134-P158 HydrophobicContact CG2-CG 4.41Å
159	K	96.6	Very high	97	Very high	121 Å²	121	64.5 Å²	64.5	53%	0.526	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-81	131.1	174.3	-65.9	-172.9	172.7	-164.7	0	109	E110 Y161	E110-K159 IonicContact OE2-NZ 2.85Å; E110-K159 PolarHBondContact OE2-NZ 3.29Å; K159-Y161 PolarHBondContact O-N 3.5Å
160	P	96.4	Very high	97	Very high	42 Å²	42	65.8 Å²	65.8	27%	0.273	37%	0.367	S	S	.	.	S	Bend	trans	-66.4	-25.9	178.6	21.2	-29.8	0	0	0	113.2	S104 A105	S104-P160 WeakPolarHBondContact O-CB 3.4Å; A105-P160 WeakPolarHBondContact O-CB 3.16Å
161	Y	97.1	Very high	96.9	Very high	50 Å²	50	64.1 Å²	64.1	20%	0.196	35%	0.354	C	S	.	.	S	Bend	trans	-130.4	146.3	-179.4	-54.6	-74.3	0	0	0	110.1	K159 N163 A167 A170 N171	K159-Y161 PolarHBondContact O-N 3.5Å; Y161-N163 VanDerWaalsContact C-N 3.31Å; Y161-N163 PolarHBondContact O-N 3.46Å; Y161-A167 HydrophobicContact CD1-CB 4.39Å; Y161-A167 HydrophobicContact CD2-CB 3.39Å; Y161-A167 HydrophobicContact CE2-CB 3.99Å; Y161-A167 HydrophobicContact CG-CB 3.64Å; Y161-A170 HydrophobicContact CD1-CB 4.4Å; Y161-A170 HydrophobicContact CE1-CB 3.52Å; Y161-N171 PolarHBondContact OH-ND2 3.01Å
162	P	95.6	Very high	96.6	Very high	116 Å²	116	70.9 Å²	70.9	75%	0.753	39%	0.389	S	S	*	.	S	Bend	trans	-69.5	-28.7	179.5	27.3	-35	0	0	0	112.9	A166	P162-A166 HydrophobicContact CG-CB 4.01Å
163	N	96	Very high	96.4	Very high	72 Å²	72	68.2 Å²	68.2	39%	0.385	39%	0.39	S	S	.	.	S	Bend	trans	-155.1	164.7	-179.3	55.9	54	0	0	0	111.7	Y161 E165 A166 A167	Y161-N163 VanDerWaalsContact C-N 3.31Å; Y161-N163 PolarHBondContact O-N 3.46Å; N163-E165 VanDerWaalsContact C-N 3.27Å; N163-E165 PolarHBondContact O-N 2.95Å; N163-E165 PolarHBondContact OD1-N 3Å; N163-A166 PolarHBondContact O-N 2.84Å; N163-A166 VanDerWaalsContact OD1-CB 3.3Å; N163-A166 WeakPolarHBondContact OD1-CB 3.33Å; N163-A166 PolarHBondContact OD1-N 3.33Å; N163-A167 PolarHBondContact O-N 3.27Å
164	P	97.3	Very high	96.3	Very high	66 Å²	66	68.1 Å²	68.1	43%	0.429	40%	0.395	S	S	.	.	H	α-helix	trans	-60.6	-31.2	179.4	-25.5	36.2	0	0	0	114.2	A167 R168 L175	P164-A167 PolarHBondContact O-N 3.13Å; P164-R168 WeakPolarHBondContact O-CG 3.22Å; P164-R168 PolarHBondContact O-N 2.79Å; P164-L175 HydrophobicContact CB-CD1 4.07Å; P164-L175 HydrophobicContact CB-CD2 4.18Å
165	E	97.7	Very high	96.3	Very high	127 Å²	127	68.4 Å²	68.4	59%	0.593	39%	0.391	S	S	*	.	H	α-helix	trans	-66.9	-43.3	179.8	-65.4	68.7	-151.1	0	0	111.1	N163 A167 R168 A169	N163-E165 VanDerWaalsContact C-N 3.27Å; N163-E165 PolarHBondContact O-N 2.95Å; N163-E165 PolarHBondContact OD1-N 3Å; E165-A167 VanDerWaalsContact C-N 3.34Å; E165-R168 PolarHBondContact O-N 2.85Å; E165-A169 WeakPolarHBondContact O-CB 3.45Å; E165-A169 PolarHBondContact O-N 2.83Å
166	A	97.3	Very high	96.3	Very high	31 Å²	31	68.4 Å²	68.4	26%	0.256	39%	0.393	S	S	.	.	H	α-helix	trans	-62.6	-42	173.6	0	0	0	0	0	111.4	P162 N163 R168 A169 A170	P162-A166 HydrophobicContact CG-CB 4.01Å; N163-A166 PolarHBondContact O-N 2.84Å; N163-A166 VanDerWaalsContact OD1-CB 3.3Å; N163-A166 WeakPolarHBondContact OD1-CB 3.33Å; N163-A166 PolarHBondContact OD1-N 3.33Å; A166-R168 PolarHBondContact O-N 2.9Å; A166-A169 PolarHBondContact O-N 2.95Å; A166-A170 PolarHBondContact O-N 3.49Å
167	A	97.2	Very high	96.2	Very high	5 Å²	5	65.1 Å²	65.1	4%	0.041	39%	0.386	C	S	.	.	H	α-helix	trans	-61.3	-43.2	175.9	0	0	0	0	0	112	Y161 N163 P164 E165 A170 N171 L175	Y161-A167 HydrophobicContact CD1-CB 4.39Å; Y161-A167 HydrophobicContact CD2-CB 3.39Å; Y161-A167 HydrophobicContact CE2-CB 3.99Å; Y161-A167 HydrophobicContact CG-CB 3.64Å; N163-A167 PolarHBondContact O-N 3.27Å; P164-A167 PolarHBondContact O-N 3.13Å; E165-A167 VanDerWaalsContact C-N 3.34Å; A167-A170 PolarHBondContact O-N 3.3Å; A167-N171 WeakPolarHBondContact O-CB 3.34Å; A167-N171 PolarHBondContact O-N 3Å; A167-N171 PolarHBondContact O-ND2 3.2Å; A167-L175 HydrophobicContact CB-CD1 3.59Å
168	R	96.1	Very high	96.3	Very high	114 Å²	114	66.6 Å²	66.6	43%	0.43	39%	0.394	S	S	.	.	H	α-helix	trans	-63.9	-42.9	175.2	-72.6	-179.3	-174.3	-75	-1.3	112.3	P164 E165 A166 A170 N171 N172 G173 A174 L175	P164-R168 WeakPolarHBondContact O-CG 3.22Å; P164-R168 PolarHBondContact O-N 2.79Å; E165-R168 PolarHBondContact O-N 2.85Å; A166-R168 PolarHBondContact O-N 2.9Å; R168-A170 VanDerWaalsContact C-N 3.28Å; R168-A170 PolarHBondContact O-N 3.45Å; R168-N171 CarbonylContact O-C 3.19Å; R168-N171 PolarHBondContact O-N 3.47Å; R168-N172 PolarHBondContact O-N 2.96Å; R168-G173 WeakPolarHBondContact CG-O 3.26Å; R168-G173 PolarHBondContact NH1-O 2.85Å; R168-G173 VanDerWaalsContact O-CA 3.31Å; R168-G173 WeakPolarHBondContact O-CA 3.45Å; R168-G173 PolarHBondContact O-N 3.02Å; R168-A174 WeakPolarHBondContact CA-O 3.46Å; R168-L175 HydrophobicContact CG-CB 3.97Å
169	A	96.6	Very high	96.4	Very high	85 Å²	85	64.2 Å²	64.2	70%	0.702	38%	0.378	S	S	*	.	H	α-helix	trans	-60.8	-39.6	178.5	0	0	0	0	0	111.7	E165 A166 N171	E165-A169 WeakPolarHBondContact O-CB 3.45Å; E165-A169 PolarHBondContact O-N 2.83Å; A166-A169 PolarHBondContact O-N 2.95Å; A169-N171 VanDerWaalsContact C-N 3.34Å
170	A	95.7	Very high	96.5	Very high	62 Å²	62	58.5 Å²	58.5	51%	0.512	35%	0.353	S	S	.	.	H	α-helix	trans	-73.7	-20.6	178.1	0	0	0	0	0	114.3	Y161 A166 A167 R168	Y161-A170 HydrophobicContact CD1-CB 4.4Å; Y161-A170 HydrophobicContact CE1-CB 3.52Å; A166-A170 PolarHBondContact O-N 3.49Å; A167-A170 PolarHBondContact O-N 3.3Å; R168-A170 VanDerWaalsContact C-N 3.28Å; R168-A170 PolarHBondContact O-N 3.45Å
171	N	95.7	Very high	96.6	Very high	35 Å²	35	62 Å²	62	19%	0.187	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.6	42.9	-171.3	-65	-85.7	0	0	0	112.8	Y161 A167 R168 A169 G173 A174 P176	Y161-N171 PolarHBondContact OH-ND2 3.01Å; A167-N171 WeakPolarHBondContact O-CB 3.34Å; A167-N171 PolarHBondContact O-N 3Å; A167-N171 PolarHBondContact O-ND2 3.2Å; R168-N171 CarbonylContact O-C 3.19Å; R168-N171 PolarHBondContact O-N 3.47Å; A169-N171 VanDerWaalsContact C-N 3.34Å; N171-G173 PolarHBondContact O-N 3.39Å; N171-G173 VanDerWaalsContact O-N 3.11Å; N171-A174 WeakPolarHBondContact CB-O 3.36Å; N171-A174 WeakPolarHBondContact O-CB 3.43Å; N171-A174 PolarHBondContact O-N 2.99Å; N171-P176 HydrophobicContact CB-CG 4.46Å
172	N	92.6	Very high	96.6	Very high	146 Å²	146	60.3 Å²	60.3	78%	0.781	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	35.6	175.6	-60.9	-48	0	0	0	114.3	R168 A174	R168-N172 PolarHBondContact O-N 2.96Å; N172-A174 VanDerWaalsContact C-N 3.3Å; N172-A174 PolarHBondContact O-N 2.98Å
173	G	93	Very high	96.7	Very high	42 Å²	42	55 Å²	55	43%	0.433	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.6	-13	-179.1	0	0	0	0	0	115.1	R168 N171	R168-G173 WeakPolarHBondContact CG-O 3.26Å; R168-G173 PolarHBondContact NH1-O 2.85Å; R168-G173 VanDerWaalsContact O-CA 3.31Å; R168-G173 WeakPolarHBondContact O-CA 3.45Å; R168-G173 PolarHBondContact O-N 3.02Å; N171-G173 PolarHBondContact O-N 3.39Å; N171-G173 VanDerWaalsContact O-N 3.11Å
174	A	94.8	Very high	96.8	Very high	39 Å²	39	55.2 Å²	55.2	32%	0.322	32%	0.323	S	S	.	.			trans	-77.6	141.6	174.1	0	0	0	0	0	110.7	R168 N171 N172	R168-A174 WeakPolarHBondContact CA-O 3.46Å; N171-A174 WeakPolarHBondContact CB-O 3.36Å; N171-A174 WeakPolarHBondContact O-CB 3.43Å; N171-A174 PolarHBondContact O-N 2.99Å; N172-A174 VanDerWaalsContact C-N 3.3Å; N172-A174 PolarHBondContact O-N 2.98Å
175	L	97.1	Very high	96.8	Very high	68 Å²	68	54.8 Å²	54.8	36%	0.356	33%	0.325	S	S	.	.			trans	-102.5	113.9	174.8	175.4	62.5	0	0	0	108.3	P164 A167 R168 P177	P164-L175 HydrophobicContact CB-CD1 4.07Å; P164-L175 HydrophobicContact CB-CD2 4.18Å; A167-L175 HydrophobicContact CB-CD1 3.59Å; R168-L175 HydrophobicContact CG-CB 3.97Å; L175-P177 WeakPolarHBondContact O-CD 3.41Å
176	P	97.5	Very high	96.8	Very high	22 Å²	22	53.7 Å²	53.7	14%	0.143	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-57.8	123.4	169.7	-23.6	34.2	0	0	0	109.7	C106 N171	C106-P176 HydrophobicContact CB-CG 4.46Å; C106-P176 VanDerWaalsContact O-CB 3.24Å; C106-P176 WeakPolarHBondContact O-CB 3.39Å; N171-P176 HydrophobicContact CB-CG 4.46Å
177	P	97.8	Very high	96.8	Very high	53 Å²	53	61 Å²	61	34%	0.344	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-68.8	149.8	178	28.5	-35.8	0	0	0	111.1	H107 L175 I182	H107-P177 PolarHBondContact ND1-O 2.82Å; L175-P177 WeakPolarHBondContact O-CD 3.41Å; P177-I182 HydrophobicContact CB-CD1 4.43Å; P177-I182 HydrophobicContact CG-CD1 4.29Å
178	D	98.4	Very high	96.7	Very high	39 Å²	39	62.9 Å²	62.9	21%	0.209	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-61.8	135.3	168	-174.9	-88.9	0	0	0	110.4	S108 M109 E110 S180	S108-D178 WeakPolarHBondContact CB-OD2 3.38Å; S108-D178 VanDerWaalsContact O-OD2 3.12Å; S108-D178 WeakPolarHBondContact OG-CB 3.43Å; S108-D178 PolarHBondContact OG-OD2 2.95Å; M109-D178 VanDerWaalsContact CA-OD2 3.29Å; M109-D178 WeakPolarHBondContact CA-OD2 3.48Å; M109-D178 PolarHBondContact N-OD2 3Å; E110-D178 PolarHBondContact N-OD2 3.49Å; D178-S180 WeakPolarHBondContact OD1-CB 3.43Å; D178-S180 PolarHBondContact OD1-N 3.22Å; D178-S180 PolarHBondContact OD1-OG 3.46Å
179	L	98.6	Very high	96.7	Very high	14 Å²	14	58 Å²	58	7%	0.073	35%	0.348	C	S	.	.	S	Bend	trans	-92.2	-5.6	-173.5	-65.3	179.3	0	0	0	114.3	Y99 C103 H107 S108 Y181 I182 L256	Y99-L179 HydrophobicContact CD2-CD1 4.31Å; Y99-L179 HydrophobicContact CE2-CD1 4.29Å; C103-L179 HydrophobicContact CB-CD1 4.19Å; H107-L179 HydrophobicContact CB-CD1 3.39Å; H107-L179 HydrophobicContact CB-CG 3.64Å; S108-L179 PolarHBondContact O-N 2.74Å; L179-Y181 VanDerWaalsContact C-N 3.25Å; L179-Y181 PolarHBondContact O-N 3.44Å; L179-Y181 VanDerWaalsContact O-N 3.17Å; L179-I182 HydrophobicContact CB-CG2 4.25Å; L179-I182 HydrophobicContact CD2-CB 4.01Å; L179-I182 HydrophobicContact CD2-CG1 4.05Å; L179-I182 HydrophobicContact CD2-CG2 3.84Å; L179-I182 WeakPolarHBondContact O-CG2 3.25Å; L179-I182 PolarHBondContact O-N 3Å; L179-L256 HydrophobicContact CB-CD2 3.82Å; L179-L256 HydrophobicContact CD1-CD2 4.37Å
180	S	98.1	Very high	96.8	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-39.3	-174.5	-46.2	0	0	0	0	112.7	M109 E110 Y111 D178 A259 A260	M109-S180 VanDerWaalsContact CA-OG 3.32Å; M109-S180 WeakPolarHBondContact CA-OG 3.12Å; M109-S180 WeakPolarHBondContact CG-OG 3.31Å; E110-S180 PolarHBondContact N-OG 3.41Å; E110-S180 VanDerWaalsContact N-OG 3.17Å; Y111-S180 PolarHBondContact N-OG 3.02Å; D178-S180 WeakPolarHBondContact OD1-CB 3.43Å; D178-S180 PolarHBondContact OD1-N 3.22Å; D178-S180 PolarHBondContact OD1-OG 3.46Å; S180-A259 CarbonylContact O-C 3.6Å; S180-A260 WeakPolarHBondContact O-CA 3.28Å; S180-A260 PolarHBondContact O-N 3.48Å
181	Y	98.3	Very high	96.9	Very high	116 Å²	116	53.3 Å²	53.3	46%	0.455	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.6	15.5	-179.1	-70.8	-68.3	0	0	0	113.4	Y111 L179 V183 N184 A185 A260	Y111-Y181 AromaticContact CD2-CD2 3.88Å; Y111-Y181 HydrophobicContact CD2-CD2 3.88Å; Y111-Y181 AromaticContact CD2-CE2 3.68Å; Y111-Y181 HydrophobicContact CD2-CE2 3.68Å; Y111-Y181 HydrophobicContact CE2-CD2 4.23Å; Y111-Y181 HydrophobicContact CE2-CE2 4.2Å; Y111-Y181 AromaticContact CG-CE2 3.9Å; Y111-Y181 HydrophobicContact CG-CE2 3.9Å; L179-Y181 VanDerWaalsContact C-N 3.25Å; L179-Y181 PolarHBondContact O-N 3.44Å; L179-Y181 VanDerWaalsContact O-N 3.17Å; Y181-V183 PolarHBondContact O-N 2.91Å; Y181-V183 VanDerWaalsContact O-N 3.13Å; Y181-N184 CarbonylContact O-C 3.58Å; Y181-N184 PolarHBondContact O-N 2.84Å; Y181-A185 VanDerWaalsContact O-CB 3.28Å; Y181-A185 WeakPolarHBondContact O-CB 3.44Å; Y181-A185 PolarHBondContact O-N 3.04Å; Y181-A260 HydrophobicContact CD1-CB 4.26Å; Y181-A260 WeakPolarHBondContact CE1-O 3.35Å
182	I	98.3	Very high	97	Very high	15 Å²	15	52.7 Å²	52.7	8%	0.077	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-34.2	-171.1	-167.6	61.5	0	0	0	113	P177 L179 N184 A185 R186 I193 L256	P177-I182 HydrophobicContact CB-CD1 4.43Å; P177-I182 HydrophobicContact CG-CD1 4.29Å; L179-I182 HydrophobicContact CB-CG2 4.25Å; L179-I182 HydrophobicContact CD2-CB 4.01Å; L179-I182 HydrophobicContact CD2-CG1 4.05Å; L179-I182 HydrophobicContact CD2-CG2 3.84Å; L179-I182 WeakPolarHBondContact O-CG2 3.25Å; L179-I182 PolarHBondContact O-N 3Å; I182-N184 VanDerWaalsContact C-N 3.35Å; I182-N184 PolarHBondContact O-N 2.83Å; I182-A185 PolarHBondContact O-N 3.44Å; I182-R186 HydrophobicContact CD1-CG 4.02Å; I182-R186 PolarHBondContact O-N 3.21Å; I182-I193 HydrophobicContact CG1-CD1 4.46Å; I182-I193 HydrophobicContact CG2-CD1 3.84Å; I182-L256 HydrophobicContact CG2-CD1 4.07Å; I182-L256 HydrophobicContact CG2-CD2 4.33Å
183	V	98.1	Very high	97.3	Very high	5 Å²	5	46.3 Å²	46.3	3%	0.03	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-41	175.8	-177.7	0	0	0	0	111.5	Y181 G189 E190 I193 L256 A260	Y181-V183 PolarHBondContact O-N 2.91Å; Y181-V183 VanDerWaalsContact O-N 3.13Å; V183-G189 WeakPolarHBondContact O-CA 3.42Å; V183-E190 HydrophobicContact CG1-CB 4.37Å; V183-I193 HydrophobicContact CB-CD1 4.29Å; V183-I193 HydrophobicContact CG2-CD1 3.63Å; V183-L256 VanDerWaalsContact CG2-C 3.45Å; V183-L256 HydrophobicContact CG2-CB 3.64Å; V183-L256 WeakPolarHBondContact CG2-O 3.46Å; V183-A260 HydrophobicContact CB-CB 4.01Å; V183-A260 HydrophobicContact CG2-CB 4.49Å
184	N	97.3	Very high	97.6	Very high	75 Å²	75	45.5 Å²	45.5	40%	0.401	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-21.1	179.9	-67.1	-10.3	0	0	0	112.1	Y181 I182 R186 R257 A260 E261	Y181-N184 CarbonylContact O-C 3.58Å; Y181-N184 PolarHBondContact O-N 2.84Å; I182-N184 VanDerWaalsContact C-N 3.35Å; I182-N184 PolarHBondContact O-N 2.83Å; N184-R186 VanDerWaalsContact C-N 3.35Å; N184-R257 PolarHBondContact OD1-NH1 3.21Å; N184-A260 PolarHBondContact ND2-O 3.36Å; N184-E261 WeakPolarHBondContact ND2-CG 3.44Å; N184-E261 PolarHBondContact OD1-OE1 2.86Å
185	A	97.7	Very high	97.7	Very high	57 Å²	57	43.7 Å²	43.7	47%	0.471	23%	0.233	S	C	.	.	S	Bend	trans	-86.6	-0.6	-178.4	0	0	0	0	0	113.9	Y181 I182	Y181-A185 VanDerWaalsContact O-CB 3.28Å; Y181-A185 WeakPolarHBondContact O-CB 3.44Å; Y181-A185 PolarHBondContact O-N 3.04Å; I182-A185 PolarHBondContact O-N 3.44Å
186	R	96.8	Very high	97.8	Very high	105 Å²	105	41.3 Å²	41.3	40%	0.396	22%	0.22	S	C	.	.	S	Bend	trans	-130	139.3	178.2	-65.7	-64.3	-178.7	-78.3	-4	110.9	I182 N184 G189 Y192	I182-R186 HydrophobicContact CD1-CG 4.02Å; I182-R186 PolarHBondContact O-N 3.21Å; N184-R186 VanDerWaalsContact C-N 3.35Å; R186-G189 PolarHBondContact O-N 3.06Å; R186-G189 VanDerWaalsContact O-N 3.12Å; R186-Y192 HydrophobicContact CB-CD1 3.75Å; R186-Y192 HydrophobicContact CB-CE1 4.05Å; R186-Y192 HydrophobicContact CG-CD1 4.1Å; R186-Y192 HydrophobicContact CG-CE1 3.9Å
187	H	96.6	Very high	97.8	Very high	184 Å²	184	41.2 Å²	41.2	85%	0.852	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	139.1	172.1	-65.1	-64.5	0	0	0	110.1	G189 Y192	H187-G189 PolarHBondContact O-N 3.17Å; H187-Y192 WeakPolarHBondContact O-CB 3.31Å
188	G	95.7	Very high	97.8	Very high	45 Å²	45	40.5 Å²	40.5	46%	0.464	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.9	-15.9	-173.1	0	0	0	0	0	114.5	E190 D191 Y192	G188-E190 PolarHBondContact O-N 3.05Å; G188-D191 WeakPolarHBondContact O-CB 3.31Å; G188-D191 PolarHBondContact O-N 2.79Å; G188-D191 VanDerWaalsContact O-N 3.13Å; G188-Y192 PolarHBondContact O-N 2.93Å
189	G	97.1	Very high	97.7	Very high	10 Å²	10	39.2 Å²	39.2	10%	0.103	21%	0.209	C	C	.	.	H	α-helix	trans	51.9	-120.5	174.9	0	0	0	0	0	114.3	V183 R186 H187 D191 Y192 I193	V183-G189 WeakPolarHBondContact O-CA 3.42Å; R186-G189 PolarHBondContact O-N 3.06Å; R186-G189 VanDerWaalsContact O-N 3.12Å; H187-G189 PolarHBondContact O-N 3.17Å; G189-D191 VanDerWaalsContact C-N 3.34Å; G189-D191 PolarHBondContact O-N 2.79Å; G189-Y192 WeakPolarHBondContact O-CB 3.38Å; G189-Y192 PolarHBondContact O-N 2.85Å; G189-I193 WeakPolarHBondContact O-CG1 3.21Å; G189-I193 PolarHBondContact O-N 3.4Å
190	E	97.6	Very high	97.6	Very high	21 Å²	21	40.6 Å²	40.6	10%	0.098	21%	0.214	C	C	.	.	H	α-helix	trans	-67.1	-31.3	-178.2	54.6	-170.5	-160.8	0	0	113.2	W78 H80 V183 G188 Y192 I193 F194 C253 R257	W78-E190 VanDerWaalsContact CD1-OE1 3.26Å; W78-E190 HydrophobicContact CD2-CG 4.17Å; W78-E190 HydrophobicContact CG-CG 4.37Å; W78-E190 VanDerWaalsContact CG-OE1 3.24Å; W78-E190 HydrophobicContact CH2-CB 4.45Å; W78-E190 HydrophobicContact CZ2-CB 3.98Å; W78-E190 HydrophobicContact CZ2-CG 4.1Å; W78-E190 WeakPolarHBondContact CZ2-O 3.22Å; H80-E190 IonicContact CD2-OE1 3.12Å; H80-E190 PolarHBondContact CD2-OE1 2.79Å; H80-E190 IonicContact CD2-OE2 3.83Å; H80-E190 IonicContact CE1-OE1 2.82Å; H80-E190 IonicContact CE1-OE2 3.4Å; H80-E190 IonicContact NE2-OE1 3.38Å; H80-E190 PolarHBondContact NE2-OE1 3.19Å; H80-E190 IonicContact NE2-OE2 3.9Å; H80-E190 PolarHBondContact NE2-OE2 2.66Å; V183-E190 HydrophobicContact CG1-CB 4.37Å; G188-E190 PolarHBondContact O-N 3.05Å; E190-Y192 VanDerWaalsContact C-N 3.32Å; E190-Y192 PolarHBondContact O-N 3.46Å; E190-I193 PolarHBondContact O-N 3.31Å; E190-F194 VanDerWaalsContact O-CB 3.3Å; E190-F194 WeakPolarHBondContact O-CB 3.36Å; E190-F194 PolarHBondContact O-N 3.22Å; E190-C253 HydrophobicContact CB-CB 4.39Å; E190-R257 WeakPolarHBondContact OE2-CB 3.27Å; E190-R257 WeakPolarHBondContact OE2-CD 3.41Å; E190-R257 WeakPolarHBondContact OE2-CG 3.25Å; E190-R257 IonicContact OE2-NE 2.66Å
191	D	98.4	Very high	97.5	Very high	28 Å²	28	43.8 Å²	43.8	15%	0.15	24%	0.235	C	C	.	.	H	α-helix	trans	-61.4	-44.4	171.6	-70.2	-33.9	0	0	0	110.5	P73 P74 Y76 W78 G188 G189 S195	P73-D191 HydrophobicContact CB-CB 4.1Å; P73-D191 HydrophobicContact CG-CB 4.28Å; P74-D191 WeakPolarHBondContact O-CB 3.31Å; Y76-D191 HydrophobicContact CD2-CB 4.2Å; Y76-D191 WeakPolarHBondContact CD2-OD1 3.36Å; Y76-D191 PolarHBondContact N-OD1 3.37Å; W78-D191 PolarHBondContact NE1-OD1 3.22Å; G188-D191 WeakPolarHBondContact O-CB 3.31Å; G188-D191 PolarHBondContact O-N 2.79Å; G188-D191 VanDerWaalsContact O-N 3.13Å; G189-D191 VanDerWaalsContact C-N 3.34Å; G189-D191 PolarHBondContact O-N 2.79Å; D191-S195 WeakPolarHBondContact O-CB 3.32Å; D191-S195 PolarHBondContact O-N 3.22Å; D191-S195 PolarHBondContact O-OG 2.92Å
192	Y	98.2	Very high	97.3	Very high	23 Å²	23	46.2 Å²	46.2	9%	0.09	25%	0.251	C	S	.	.	H	α-helix	trans	-62.6	-47.7	177.7	169.5	-105.8	0	0	0	111.7	R186 H187 G188 G189 E190 S195 L196 Y218	R186-Y192 HydrophobicContact CB-CD1 3.75Å; R186-Y192 HydrophobicContact CB-CE1 4.05Å; R186-Y192 HydrophobicContact CG-CD1 4.1Å; R186-Y192 HydrophobicContact CG-CE1 3.9Å; H187-Y192 WeakPolarHBondContact O-CB 3.31Å; G188-Y192 PolarHBondContact O-N 2.93Å; G189-Y192 WeakPolarHBondContact O-CB 3.38Å; G189-Y192 PolarHBondContact O-N 2.85Å; E190-Y192 VanDerWaalsContact C-N 3.32Å; E190-Y192 PolarHBondContact O-N 3.46Å; Y192-S195 PolarHBondContact O-N 3.05Å; Y192-L196 HydrophobicContact CE1-CD2 4.23Å; Y192-L196 WeakPolarHBondContact O-CB 3.23Å; Y192-L196 PolarHBondContact O-N 2.9Å; Y192-Y218 WeakPolarHBondContact CE2-O 3.49Å
193	I	98.2	Very high	97	Very high	11 Å²	11	47.9 Å²	47.9	6%	0.056	26%	0.262	C	S	.	.	H	α-helix	trans	-65.9	-42.1	-178.1	-63.4	159.7	0	0	0	110.4	I182 V183 G189 E190 L196 L197 L256	I182-I193 HydrophobicContact CG1-CD1 4.46Å; I182-I193 HydrophobicContact CG2-CD1 3.84Å; V183-I193 HydrophobicContact CB-CD1 4.29Å; V183-I193 HydrophobicContact CG2-CD1 3.63Å; G189-I193 WeakPolarHBondContact O-CG1 3.21Å; G189-I193 PolarHBondContact O-N 3.4Å; E190-I193 PolarHBondContact O-N 3.31Å; I193-L196 PolarHBondContact O-N 2.81Å; I193-L197 HydrophobicContact CG2-CD1 3.85Å; I193-L197 HydrophobicContact CG2-CG 4.24Å; I193-L197 WeakPolarHBondContact O-CB 3.37Å; I193-L197 VanDerWaalsContact O-CG 3.25Å; I193-L197 WeakPolarHBondContact O-CG 3.09Å; I193-L197 PolarHBondContact O-N 3.23Å; I193-L256 HydrophobicContact CD1-CD1 4.46Å; I193-L256 HydrophobicContact CG2-CD1 4.21Å
194	F	98.6	Very high	96.7	Very high	26 Å²	26	50.7 Å²	50.7	11%	0.114	28%	0.28	C	S	.	.	H	α-helix	trans	-60.1	-52.3	176.4	-175.7	-89.1	0	0	0	111.1	Y76 W78 E190 L196 L197 T198 S246 A249 K250 C253	Y76-F194 HydrophobicContact CD1-CD1 4.32Å; Y76-F194 HydrophobicContact CD1-CE1 4.23Å; Y76-F194 HydrophobicContact CD2-CD1 4.03Å; Y76-F194 AromaticContact CE1-CD1 3.88Å; Y76-F194 HydrophobicContact CE1-CD1 3.88Å; Y76-F194 AromaticContact CE1-CE1 3.71Å; Y76-F194 HydrophobicContact CE1-CE1 3.71Å; Y76-F194 HydrophobicContact CE2-CB 4.48Å; Y76-F194 AromaticContact CE2-CD1 3.56Å; Y76-F194 HydrophobicContact CE2-CD1 3.56Å; Y76-F194 HydrophobicContact CE2-CE1 4.25Å; Y76-F194 HydrophobicContact CE2-CG 4.39Å; Y76-F194 HydrophobicContact CG-CD1 4.39Å; Y76-F194 AromaticContact CZ-CD1 3.46Å; Y76-F194 VanDerWaalsContact CZ-CD1 3.46Å; Y76-F194 AromaticContact CZ-CE1 3.71Å; W78-F194 HydrophobicContact CH2-CB 3.88Å; W78-F194 AromaticContact CH2-CD2 3.87Å; W78-F194 HydrophobicContact CH2-CD2 3.87Å; W78-F194 HydrophobicContact CH2-CG 4.1Å; W78-F194 HydrophobicContact CZ2-CB 3.85Å; W78-F194 HydrophobicContact CZ2-CD2 4.49Å; W78-F194 HydrophobicContact CZ2-CG 4.28Å; E190-F194 VanDerWaalsContact O-CB 3.3Å; E190-F194 WeakPolarHBondContact O-CB 3.36Å; E190-F194 PolarHBondContact O-N 3.22Å; F194-L196 VanDerWaalsContact C-N 3.29Å; F194-L196 PolarHBondContact O-N 3.31Å; F194-L197 PolarHBondContact O-N 3.49Å; F194-T198 HydrophobicContact CE1-CG2 4.19Å; F194-T198 HydrophobicContact CE2-CG2 4.35Å; F194-T198 HydrophobicContact CZ-CG2 4.09Å; F194-T198 PolarHBondContact O-N 2.97Å; F194-T198 PolarHBondContact O-OG1 3.48Å; F194-S246 WeakPolarHBondContact CE2-O 3.49Å; F194-A249 HydrophobicContact CD2-CB 3.72Å; F194-A249 HydrophobicContact CE2-CB 3.72Å; F194-K250 HydrophobicContact CE2-CB 4.11Å; F194-C253 PolarHBondContact N-SG 3.49Å
195	S	98.2	Very high	96.4	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-60.2	-37.9	177	-69.2	0	0	0	0	112.8	P74 Y76 D191 Y192 G199 Y218	P74-S195 WeakPolarHBondContact CD-OG 3.46Å; Y76-S195 VanDerWaalsContact CE2-OG 3.31Å; Y76-S195 WeakPolarHBondContact CE2-OG 3.13Å; Y76-S195 PolarHBondContact OH-OG 3.44Å; Y76-S195 VanDerWaalsContact OH-OG 3.14Å; D191-S195 WeakPolarHBondContact O-CB 3.32Å; D191-S195 PolarHBondContact O-N 3.22Å; D191-S195 PolarHBondContact O-OG 2.92Å; Y192-S195 PolarHBondContact O-N 3.05Å; S195-G199 WeakPolarHBondContact O-CA 3.24Å; S195-G199 PolarHBondContact O-N 2.97Å; S195-Y218 WeakPolarHBondContact O-CD2 3.45Å
196	L	97.9	Very high	95.9	Very high	18 Å²	18	53.8 Å²	53.8	9%	0.094	33%	0.325	C	S	.	.	H	α-helix	trans	-63.6	-48.4	176.1	-176.3	72.3	0	0	0	110.8	Y192 I193 F194 N216 F219 I224 M226	Y192-L196 HydrophobicContact CE1-CD2 4.23Å; Y192-L196 WeakPolarHBondContact O-CB 3.23Å; Y192-L196 PolarHBondContact O-N 2.9Å; I193-L196 PolarHBondContact O-N 2.81Å; F194-L196 VanDerWaalsContact C-N 3.29Å; F194-L196 PolarHBondContact O-N 3.31Å; L196-N216 HydrophobicContact CD1-CB 4.47Å; L196-N216 PolarHBondContact O-ND2 3.41Å; L196-F219 HydrophobicContact CD1-CB 3.95Å; L196-F219 HydrophobicContact CD1-CD2 4.28Å; L196-I224 HydrophobicContact CD1-CD1 4.1Å; L196-I224 HydrophobicContact CD2-CD1 4.3Å; L196-M226 HydrophobicContact CD2-CE 4.42Å
197	L	98	Very high	95.5	Very high	21 Å²	21	52 Å²	52	11%	0.11	33%	0.326	C	S	.	.	H	α-helix	trans	-67.2	-39.5	-177.3	-69.7	175.1	0	0	0	112.6	I193 F194 M226 P229 I230 A249 V252	I193-L197 HydrophobicContact CG2-CD1 3.85Å; I193-L197 HydrophobicContact CG2-CG 4.24Å; I193-L197 WeakPolarHBondContact O-CB 3.37Å; I193-L197 VanDerWaalsContact O-CG 3.25Å; I193-L197 WeakPolarHBondContact O-CG 3.09Å; I193-L197 PolarHBondContact O-N 3.23Å; F194-L197 PolarHBondContact O-N 3.49Å; L197-M226 HydrophobicContact CD2-CE 4.35Å; L197-P229 HydrophobicContact CD2-CG 3.59Å; L197-I230 HydrophobicContact CB-CD1 3.79Å; L197-I230 HydrophobicContact CB-CG1 4.44Å; L197-A249 HydrophobicContact CB-CB 4.34Å; L197-V252 HydrophobicContact CD1-CG1 3.68Å
198	T	97.9	Very high	95.2	Very high	37 Å²	37	48.9 Å²	48.9	23%	0.227	32%	0.324	C	S	.	.	H	α-helix	trans	-92.9	-5.6	-178.9	64.3	0	0	0	0	114.1	F194 M245 A249	F194-T198 HydrophobicContact CE1-CG2 4.19Å; F194-T198 HydrophobicContact CE2-CG2 4.35Å; F194-T198 HydrophobicContact CZ-CG2 4.09Å; F194-T198 PolarHBondContact O-N 2.97Å; F194-T198 PolarHBondContact O-OG1 3.48Å; T198-M245 HydrophobicContact CG2-CE 4.26Å; T198-A249 HydrophobicContact CG2-CB 3.57Å
199	G	96.8	Very high	94.9	Very high	12 Å²	12	48.8 Å²	48.8	12%	0.124	32%	0.315	C	S	.	.			trans	-96.7	3.1	-169.1	0	0	0	0	0	115.4	S195 C201 P217	S195-G199 WeakPolarHBondContact O-CA 3.24Å; S195-G199 PolarHBondContact O-N 2.97Å; G199-C201 PolarHBondContact O-N 3.23Å; G199-P217 WeakPolarHBondContact O-CD 3.41Å
200	Y	96.6	Very high	94.6	Very high	44 Å²	44	58 Å²	58	17%	0.173	35%	0.347	C	S	.	.			trans	-58.6	129	174.3	-77.1	-83	0	0	0	110.6	N216 I224 M226 P228	Y200-N216 HydrophobicContact CD1-CB 4.3Å; Y200-N216 HydrophobicContact CE1-CB 4.28Å; Y200-I224 HydrophobicContact CE1-CG2 3.68Å; Y200-M226 HydrophobicContact CE2-CE 4.34Å; Y200-M226 WeakPolarHBondContact OH-CE 3.42Å; Y200-M226 PolarHBondContact OH-O 3.49Å; Y200-P228 HydrophobicContact CD1-CB 4.37Å; Y200-P228 HydrophobicContact CD1-CG 3.84Å; Y200-P228 HydrophobicContact CD2-CB 4.08Å; Y200-P228 HydrophobicContact CD2-CG 4.43Å; Y200-P228 HydrophobicContact CE1-CG 4.23Å; Y200-P228 HydrophobicContact CE2-CB 4.42Å; Y200-P228 HydrophobicContact CG-CB 4.04Å; Y200-P228 HydrophobicContact CG-CG 3.93Å
201	C	94.7	Very high	94.1	Very high	66 Å²	66	66.7 Å²	66.7	45%	0.446	39%	0.387	S	S	.	.			trans	-150.1	168.1	178.3	63.5	0	0	0	0	110.8	G199 Y215	G199-C201 PolarHBondContact O-N 3.23Å; C201-Y215 WeakPolarHBondContact O-CD1 3.22Å
202	E	93.9	Very high	93.6	Very high	168 Å²	168	66.6 Å²	66.6	79%	0.785	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-65	141.6	174.4	-68.4	-58.1	133.4	0	0	110.9
203	P	92.8	Very high	93.4	Very high	49 Å²	49	68.5 Å²	68.5	32%	0.318	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-61.6	136.4	178.8	24.5	-31.6	0	0	0	110.5	V207 V209 Y215	P203-V207 HydrophobicContact CB-CB 4.34Å; P203-V207 HydrophobicContact CB-CG1 4.37Å; P203-V209 HydrophobicContact CB-CG2 4.33Å; P203-Y215 HydrophobicContact CB-CD1 4.47Å; P203-Y215 HydrophobicContact CB-CD2 4.03Å; P203-Y215 HydrophobicContact CB-CG 3.91Å
204	P	91.3	Very high	93.3	Very high	64 Å²	64	72.7 Å²	72.7	42%	0.416	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-65.2	158.2	178.5	28.1	-34.8	0	0	0	110.9	G206 V207 Y215	P204-G206 PolarHBondContact O-N 2.76Å; P204-V207 HydrophobicContact CG-CB 4.31Å; P204-V207 HydrophobicContact CG-CG2 3.87Å; P204-V207 PolarHBondContact O-N 3.36Å; P204-Y215 WeakPolarHBondContact CD-OH 3.36Å; P204-Y215 HydrophobicContact CG-CE2 4.42Å
205	A	91.1	Very high	93.1	Very high	111 Å²	111	73.1 Å²	73.1	92%	0.917	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	126.1	-179	0	0	0	0	0	111.8
206	G	87.8	Confident	93	Very high	87 Å²	87	73.1 Å²	73.1	90%	0.897	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.5	-6	-179.1	0	0	0	0	0	115.3	P204	P204-G206 PolarHBondContact O-N 2.76Å
207	V	88.3	Confident	92.9	Very high	67 Å²	67	73.4 Å²	73.4	41%	0.406	42%	0.424	S	S	.	.			trans	-100.9	117.9	172.8	-180	0	0	0	0	109.4	P203 P204 V209 Y215	P203-V207 HydrophobicContact CB-CB 4.34Å; P203-V207 HydrophobicContact CB-CG1 4.37Å; P204-V207 HydrophobicContact CG-CB 4.31Å; P204-V207 HydrophobicContact CG-CG2 3.87Å; P204-V207 PolarHBondContact O-N 3.36Å; V207-V209 HydrophobicContact CG1-CG2 4.49Å; V207-Y215 HydrophobicContact CG1-CD2 4.25Å; V207-Y215 HydrophobicContact CG1-CE2 4.18Å
208	S	89.4	Confident	92.8	Very high	118 Å²	118	74.7 Å²	74.7	83%	0.825	43%	0.428	S	S	*	.			trans	-105.6	131.4	168.8	56.7	0	0	0	0	110.1
209	V	90.1	Very high	92.7	Very high	43 Å²	43	75.9 Å²	75.9	26%	0.261	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-99	140.1	177.6	-176.5	0	0	0	0	108.5	P203 V207 L213 Y215 A223	P203-V209 HydrophobicContact CB-CG2 4.33Å; V207-V209 HydrophobicContact CG1-CG2 4.49Å; V209-L213 VanDerWaalsContact CG1-C 3.43Å; V209-L213 HydrophobicContact CG1-CB 3.43Å; V209-L213 VanDerWaalsContact CG1-CB 3.43Å; V209-L213 WeakPolarHBondContact CG1-O 3.17Å; V209-Y215 HydrophobicContact CG2-CD2 4.27Å; V209-A223 HydrophobicContact CG1-CB 4.14Å
210	R	90.1	Very high	92.5	Very high	205 Å²	205	78.2 Å²	78.2	77%	0.774	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-66	152.8	178.1	-62.2	179.7	-176.3	170.3	1.7	110	G212 L213	R210-G212 PolarHBondContact O-N 2.81Å; R210-L213 HydrophobicContact CB-CD1 4.13Å; R210-L213 PolarHBondContact O-N 2.86Å
211	E	88.6	Confident	92.2	Very high	202 Å²	202	78.3 Å²	78.3	94%	0.944	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	134.4	174.8	-169.3	175.9	179.7	0	0	111	L213	E211-L213 VanDerWaalsContact C-N 3.3Å; E211-L213 PolarHBondContact O-N 3.02Å
212	G	87.9	Confident	92.1	Very high	27 Å²	27	76.2 Å²	76.2	28%	0.278	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	-3.6	-175.6	0	0	0	0	0	115.5	R210	R210-G212 PolarHBondContact O-N 2.81Å
213	L	93.9	Very high	92.1	Very high	63 Å²	63	69.8 Å²	69.8	33%	0.33	42%	0.417	S	S	.	.			trans	-106.2	152.9	169.2	-59.7	-179.9	0	0	0	110.2	V209 R210 E211 A223 I224	V209-L213 VanDerWaalsContact CG1-C 3.43Å; V209-L213 HydrophobicContact CG1-CB 3.43Å; V209-L213 VanDerWaalsContact CG1-CB 3.43Å; V209-L213 WeakPolarHBondContact CG1-O 3.17Å; R210-L213 HydrophobicContact CB-CD1 4.13Å; R210-L213 PolarHBondContact O-N 2.86Å; E211-L213 VanDerWaalsContact C-N 3.3Å; E211-L213 PolarHBondContact O-N 3.02Å; L213-A223 HydrophobicContact CB-CB 4.35Å; L213-A223 HydrophobicContact CD1-CB 4.06Å; L213-I224 CarbonylContact C-O 3.58Å; L213-I224 WeakPolarHBondContact CA-O 3.35Å
214	Y	95.3	Very high	92.2	Very high	98 Å²	98	68 Å²	68	38%	0.384	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	148.6	-179	-60.3	-89.1	0	0	0	110.2	A223 I224 M226 A227	Y214-A223 CarbonylContact O-C 3.6Å; Y214-A223 WeakPolarHBondContact O-CA 3.47Å; Y214-I224 PolarHBondContact N-O 2.95Å; Y214-I224 PolarHBondContact O-N 3.48Å; Y214-M226 WeakPolarHBondContact CD2-O 3.3Å; Y214-A227 HydrophobicContact CD2-CB 4.34Å; Y214-A227 HydrophobicContact CE1-CB 4.34Å; Y214-A227 VanDerWaalsContact CE2-CA 3.44Å; Y214-A227 HydrophobicContact CE2-CB 3.68Å
215	Y	95.4	Very high	92.4	Very high	36 Å²	36	66.6 Å²	66.6	14%	0.141	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	129.9	177.6	-174	-100.6	0	0	0	110.8	C201 P203 P204 V207 V209 P217 Q222	C201-Y215 WeakPolarHBondContact O-CD1 3.22Å; P203-Y215 HydrophobicContact CB-CD1 4.47Å; P203-Y215 HydrophobicContact CB-CD2 4.03Å; P203-Y215 HydrophobicContact CB-CG 3.91Å; P204-Y215 WeakPolarHBondContact CD-OH 3.36Å; P204-Y215 HydrophobicContact CG-CE2 4.42Å; V207-Y215 HydrophobicContact CG1-CD2 4.25Å; V207-Y215 HydrophobicContact CG1-CE2 4.18Å; V209-Y215 HydrophobicContact CG2-CD2 4.27Å; Y215-P217 HydrophobicContact CE1-CB 4.34Å; Y215-Q222 WeakPolarHBondContact CA-O 3.21Å; Y215-Q222 HydrophobicContact CD2-CB 4.06Å; Y215-Q222 WeakPolarHBondContact CD2-O 3.35Å; Y215-Q222 HydrophobicContact CE2-CB 3.57Å; Y215-Q222 HydrophobicContact CE2-CG 4.15Å
216	N	96.1	Very high	92.6	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	37%	0.369	C	S	.	.			trans	-147	118.4	170.2	-169.3	-51.5	0	0	0	109.8	L196 Y200 Y218 F219 Q222 I224	L196-N216 HydrophobicContact CD1-CB 4.47Å; L196-N216 PolarHBondContact O-ND2 3.41Å; Y200-N216 HydrophobicContact CD1-CB 4.3Å; Y200-N216 HydrophobicContact CE1-CB 4.28Å; N216-Y218 VanDerWaalsContact C-N 3.26Å; N216-Y218 PolarHBondContact O-N 3.34Å; N216-Y218 PolarHBondContact OD1-N 3.12Å; N216-F219 HydrophobicContact CB-CB 4.18Å; N216-F219 PolarHBondContact O-N 3.05Å; N216-Q222 PolarHBondContact N-O 2.83Å; N216-Q222 VanDerWaalsContact O-CA 3.3Å; N216-Q222 WeakPolarHBondContact O-CA 3.4Å; N216-I224 HydrophobicContact CB-CG2 4.06Å
217	P	94.7	Very high	93	Very high	24 Å²	24	61.6 Å²	61.6	16%	0.156	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-25.9	-173.5	28.5	-35.3	0	0	0	113.5	L71 G199 Y215	L71-P217 WeakPolarHBondContact CB-O 3.4Å; L71-P217 HydrophobicContact CD2-CB 3.96Å; L71-P217 HydrophobicContact CD2-CG 4.31Å; G199-P217 WeakPolarHBondContact O-CD 3.41Å; Y215-P217 HydrophobicContact CE1-CB 4.34Å
218	Y	95.6	Very high	93.4	Very high	47 Å²	47	61.4 Å²	61.4	18%	0.184	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-19.6	179.2	-64.3	-77.8	0	0	0	112.7	L71 Y192 S195 N216	L71-Y218 HydrophobicContact CB-CD1 4.35Å; L71-Y218 HydrophobicContact CD2-CD1 3.95Å; L71-Y218 HydrophobicContact CD2-CE1 3.57Å; L71-Y218 HydrophobicContact CD2-CE2 4.24Å; L71-Y218 HydrophobicContact CD2-CG 4.44Å; L71-Y218 HydrophobicContact CG-CD1 3.96Å; L71-Y218 HydrophobicContact CG-CE1 3.73Å; L71-Y218 WeakPolarHBondContact O-CD1 3.3Å; Y192-Y218 WeakPolarHBondContact CE2-O 3.49Å; S195-Y218 WeakPolarHBondContact O-CD2 3.45Å; N216-Y218 VanDerWaalsContact C-N 3.26Å; N216-Y218 PolarHBondContact O-N 3.34Å; N216-Y218 PolarHBondContact OD1-N 3.12Å
219	F	95.7	Very high	93.7	Very high	63 Å²	63	57.5 Å²	57.5	28%	0.276	32%	0.316	S	S	.	.	S	Bend	trans	-74.9	133	177.1	-170.4	-104.4	0	0	0	110.4	L196 N216 G221 Q222 A223 I224	L196-F219 HydrophobicContact CD1-CB 3.95Å; L196-F219 HydrophobicContact CD1-CD2 4.28Å; N216-F219 HydrophobicContact CB-CB 4.18Å; N216-F219 PolarHBondContact O-N 3.05Å; F219-G221 PolarHBondContact O-N 3.34Å; F219-Q222 WeakPolarHBondContact O-CA 3.19Å; F219-Q222 PolarHBondContact O-N 3.21Å; F219-A223 WeakPolarHBondContact CD1-O 3.14Å; F219-A223 VanDerWaalsContact CE1-O 3.31Å; F219-A223 WeakPolarHBondContact CE1-O 3.14Å; F219-I224 HydrophobicContact CB-CB 4.25Å; F219-I224 HydrophobicContact CD1-CB 3.85Å; F219-I224 HydrophobicContact CD1-CG1 4.3Å; F219-I224 HydrophobicContact CD2-CB 4.16Å; F219-I224 HydrophobicContact CD2-CD1 3.6Å; F219-I224 HydrophobicContact CD2-CG1 3.87Å; F219-I224 HydrophobicContact CE1-CB 4.21Å; F219-I224 HydrophobicContact CE1-CG1 4.34Å; F219-I224 HydrophobicContact CE2-CB 4.5Å; F219-I224 HydrophobicContact CE2-CD1 3.91Å; F219-I224 HydrophobicContact CE2-CG1 3.91Å; F219-I224 HydrophobicContact CG-CB 3.82Å; F219-I224 HydrophobicContact CG-CD1 4.09Å; F219-I224 HydrophobicContact CG-CG1 4.07Å; F219-I224 HydrophobicContact CZ-CG1 4.15Å
220	P	93.1	Very high	94	Very high	61 Å²	61	55.9 Å²	55.9	40%	0.396	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	122.8	174.7	-27	36.1	0	0	0	111.7	Q222	P220-Q222 VanDerWaalsContact C-N 3.29Å
221	G	90.4	Very high	94.2	Very high	46 Å²	46	52.9 Å²	52.9	47%	0.474	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	6.4	-173.9	0	0	0	0	0	115	F219 A223	F219-G221 PolarHBondContact O-N 3.34Å; G221-A223 PolarHBondContact O-N 2.83Å
222	Q	92.5	Very high	94.6	Very high	22 Å²	22	48.3 Å²	48.3	10%	0.103	28%	0.278	C	S	.	.	S	Bend	trans	58.8	-3.6	169.4	-62.3	76.4	38.8	0	0	118.1	S67 L69 Y215 N216 F219 P220	S67-Q222 PolarHBondContact O-OE1 2.93Å; L69-Q222 PolarHBondContact O-NE2 3.19Å; Y215-Q222 WeakPolarHBondContact CA-O 3.21Å; Y215-Q222 HydrophobicContact CD2-CB 4.06Å; Y215-Q222 WeakPolarHBondContact CD2-O 3.35Å; Y215-Q222 HydrophobicContact CE2-CB 3.57Å; Y215-Q222 HydrophobicContact CE2-CG 4.15Å; N216-Q222 PolarHBondContact N-O 2.83Å; N216-Q222 VanDerWaalsContact O-CA 3.3Å; N216-Q222 WeakPolarHBondContact O-CA 3.4Å; F219-Q222 WeakPolarHBondContact O-CA 3.19Å; F219-Q222 PolarHBondContact O-N 3.21Å; P220-Q222 VanDerWaalsContact C-N 3.29Å
223	A	93.4	Very high	94.9	Very high	33 Å²	33	55 Å²	55	27%	0.273	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	110.1	178	0	0	0	0	0	109.9	V209 L213 Y214 F219 G221	V209-A223 HydrophobicContact CG1-CB 4.14Å; L213-A223 HydrophobicContact CB-CB 4.35Å; L213-A223 HydrophobicContact CD1-CB 4.06Å; Y214-A223 CarbonylContact O-C 3.6Å; Y214-A223 WeakPolarHBondContact O-CA 3.47Å; F219-A223 WeakPolarHBondContact CD1-O 3.14Å; F219-A223 VanDerWaalsContact CE1-O 3.31Å; F219-A223 WeakPolarHBondContact CE1-O 3.14Å; G221-A223 PolarHBondContact O-N 2.83Å
224	I	95.4	Very high	94.9	Very high	11 Å²	11	54.1 Å²	54.1	6%	0.056	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	140.5	-177.5	-168	172.2	0	0	0	110.9	L196 Y200 L213 Y214 N216 F219 M226	L196-I224 HydrophobicContact CD1-CD1 4.1Å; L196-I224 HydrophobicContact CD2-CD1 4.3Å; Y200-I224 HydrophobicContact CE1-CG2 3.68Å; L213-I224 CarbonylContact C-O 3.58Å; L213-I224 WeakPolarHBondContact CA-O 3.35Å; Y214-I224 PolarHBondContact N-O 2.95Å; Y214-I224 PolarHBondContact O-N 3.48Å; N216-I224 HydrophobicContact CB-CG2 4.06Å; F219-I224 HydrophobicContact CB-CB 4.25Å; F219-I224 HydrophobicContact CD1-CB 3.85Å; F219-I224 HydrophobicContact CD1-CG1 4.3Å; F219-I224 HydrophobicContact CD2-CB 4.16Å; F219-I224 HydrophobicContact CD2-CD1 3.6Å; F219-I224 HydrophobicContact CD2-CG1 3.87Å; F219-I224 HydrophobicContact CE1-CB 4.21Å; F219-I224 HydrophobicContact CE1-CG1 4.34Å; F219-I224 HydrophobicContact CE2-CB 4.5Å; F219-I224 HydrophobicContact CE2-CD1 3.91Å; F219-I224 HydrophobicContact CE2-CG1 3.91Å; F219-I224 HydrophobicContact CG-CB 3.82Å; F219-I224 HydrophobicContact CG-CD1 4.09Å; F219-I224 HydrophobicContact CG-CG1 4.07Å; F219-I224 HydrophobicContact CZ-CG1 4.15Å; I224-M226 HydrophobicContact CD1-CB 3.95Å; I224-M226 HydrophobicContact CD1-CE 4.1Å; I224-M226 HydrophobicContact CG1-CB 3.95Å; I224-M226 PolarHBondContact O-N 3.25Å
225	G	95.1	Very high	94.9	Very high	35 Å²	35	50 Å²	50	36%	0.361	28%	0.282	S	S	.	.	S	Bend	trans	-82.1	14.7	176.1	0	0	0	0	0	114.7
226	M	96.4	Very high	95	Very high	45 Å²	45	56.6 Å²	56.6	22%	0.222	31%	0.314	C	S	.	.	S	Bend	trans	-107.8	124.5	179.4	-176.7	172.8	76.2	0	0	108	L196 L197 Y200 Y214 I224 P229	L196-M226 HydrophobicContact CD2-CE 4.42Å; L197-M226 HydrophobicContact CD2-CE 4.35Å; Y200-M226 HydrophobicContact CE2-CE 4.34Å; Y200-M226 WeakPolarHBondContact OH-CE 3.42Å; Y200-M226 PolarHBondContact OH-O 3.49Å; Y214-M226 WeakPolarHBondContact CD2-O 3.3Å; I224-M226 HydrophobicContact CD1-CB 3.95Å; I224-M226 HydrophobicContact CD1-CE 4.1Å; I224-M226 HydrophobicContact CG1-CB 3.95Å; I224-M226 PolarHBondContact O-N 3.25Å; M226-P229 HydrophobicContact CE-CG 4.16Å; M226-P229 HydrophobicContact SD-CG 4.47Å
227	A	95.3	Very high	95	Very high	47 Å²	47	57.2 Å²	57.2	39%	0.388	32%	0.316	S	S	.	.			trans	-65.5	153.9	169.6	0	0	0	0	0	110	Y214 P229	Y214-A227 HydrophobicContact CD2-CB 4.34Å; Y214-A227 HydrophobicContact CE1-CB 4.34Å; Y214-A227 VanDerWaalsContact CE2-CA 3.44Å; Y214-A227 HydrophobicContact CE2-CB 3.68Å; A227-P229 WeakPolarHBondContact O-CD 3.37Å
228	P	96.4	Very high	95	Very high	63 Å²	63	62.2 Å²	62.2	41%	0.409	34%	0.337	S	S	.	.			trans	-54.5	108.7	175.7	-22.5	32.2	0	0	0	110.2	Y200	Y200-P228 HydrophobicContact CD1-CB 4.37Å; Y200-P228 HydrophobicContact CD1-CG 3.84Å; Y200-P228 HydrophobicContact CD2-CB 4.08Å; Y200-P228 HydrophobicContact CD2-CG 4.43Å; Y200-P228 HydrophobicContact CE1-CG 4.23Å; Y200-P228 HydrophobicContact CE2-CB 4.42Å; Y200-P228 HydrophobicContact CG-CB 4.04Å; Y200-P228 HydrophobicContact CG-CG 3.93Å
229	P	96.2	Very high	95	Very high	36 Å²	36	64.1 Å²	64.1	23%	0.234	35%	0.351	C	S	.	.			trans	-84.1	-17.4	-165.4	32.6	-34.9	0	0	0	112.6	V102 L197 M226 A227	V102-P229 HydrophobicContact CG1-CB 4.39Å; V102-P229 WeakPolarHBondContact CG1-O 3.25Å; L197-P229 HydrophobicContact CD2-CG 3.59Å; M226-P229 HydrophobicContact CE-CG 4.16Å; M226-P229 HydrophobicContact SD-CG 4.47Å; A227-P229 WeakPolarHBondContact O-CD 3.37Å
230	I	96.5	Very high	95	Very high	10 Å²	10	64.1 Å²	64.1	5%	0.051	37%	0.369	C	S	.	.			trans	-129.5	143.3	-175	59.4	169.4	0	0	0	110.2	V102 L197 M245 V248 A249	V102-I230 HydrophobicContact CG1-CG2 4.37Å; L197-I230 HydrophobicContact CB-CD1 3.79Å; L197-I230 HydrophobicContact CB-CG1 4.44Å; I230-M245 HydrophobicContact CD1-CG 3.96Å; I230-M245 HydrophobicContact CG1-CG 4.03Å; I230-V248 HydrophobicContact CB-CG1 4.32Å; I230-V248 HydrophobicContact CG2-CG1 3.84Å; I230-A249 HydrophobicContact CD1-CB 3.74Å
231	Y	95.4	Very high	95.2	Very high	142 Å²	142	63 Å²	63	56%	0.557	36%	0.361	S	S	*	.			trans	-145.5	173.2	172.5	46.5	-94.4	0	0	0	108.5	E233 I234	Y231-E233 PolarHBondContact O-N 3.23Å; Y231-I234 HydrophobicContact CD1-CD1 4.37Å; Y231-I234 HydrophobicContact CD2-CB 4.24Å; Y231-I234 HydrophobicContact CE1-CD1 3.6Å; Y231-I234 HydrophobicContact CE2-CB 4.14Å; Y231-I234 HydrophobicContact CE2-CD1 3.85Å; Y231-I234 WeakPolarHBondContact O-CG2 3.49Å; Y231-I234 PolarHBondContact O-N 2.94Å; Y231-I234 VanDerWaalsContact OH-CD1 3.25Å; Y231-I234 WeakPolarHBondContact OH-CD1 3.36Å
232	N	95.5	Very high	95.5	Very high	106 Å²	106	65.5 Å²	65.5	57%	0.567	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	134.6	178.8	-67.2	-37.4	0	0	0	110.4	I234 M245	N232-I234 VanDerWaalsContact C-N 3.28Å; N232-I234 PolarHBondContact O-N 3.24Å; N232-M245 WeakPolarHBondContact OD1-CB 3.3Å; N232-M245 PolarHBondContact OD1-N 2.76Å
233	E	94.6	Very high	95.7	Very high	167 Å²	167	64.9 Å²	64.9	78%	0.78	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	30.3	177.2	-54.8	177.5	163.8	0	0	113.9	Y231 L235 A243	Y231-E233 PolarHBondContact O-N 3.23Å; E233-L235 PolarHBondContact O-N 3.39Å; E233-A243 PolarHBondContact N-O 2.88Å
234	I	94.4	Very high	96	Very high	44 Å²	44	66.2 Å²	66.2	23%	0.226	37%	0.372	C	S	.	.	S	Bend	trans	-60	-26.4	172.4	178.9	62.7	0	0	0	113	V102 Y231 N232 V248	V102-I234 HydrophobicContact CG2-CG1 3.77Å; Y231-I234 HydrophobicContact CD1-CD1 4.37Å; Y231-I234 HydrophobicContact CD2-CB 4.24Å; Y231-I234 HydrophobicContact CE1-CD1 3.6Å; Y231-I234 HydrophobicContact CE2-CB 4.14Å; Y231-I234 HydrophobicContact CE2-CD1 3.85Å; Y231-I234 WeakPolarHBondContact O-CG2 3.49Å; Y231-I234 PolarHBondContact O-N 2.94Å; Y231-I234 VanDerWaalsContact OH-CD1 3.25Å; Y231-I234 WeakPolarHBondContact OH-CD1 3.36Å; N232-I234 VanDerWaalsContact C-N 3.28Å; N232-I234 PolarHBondContact O-N 3.24Å; I234-V248 HydrophobicContact CG2-CG1 4.21Å; I234-V248 HydrophobicContact CG2-CG2 4.17Å
235	L	95.5	Very high	96.1	Very high	11 Å²	11	68.7 Å²	68.7	6%	0.058	38%	0.384	C	S	.	.	S	Bend	trans	-150.7	165.7	176.3	62.5	111.7	0	0	0	111.2	Q97 V98 V102 E233 Y237 A243	Q97-L235 HydrophobicContact CG-CD1 4.34Å; V98-L235 HydrophobicContact CB-CD2 4.31Å; V98-L235 HydrophobicContact CG1-CD2 4.35Å; V98-L235 HydrophobicContact CG2-CD2 3.96Å; V102-L235 HydrophobicContact CG2-CD2 4.15Å; E233-L235 PolarHBondContact O-N 3.39Å; L235-Y237 HydrophobicContact CD1-CD1 3.6Å; L235-Y237 HydrophobicContact CD1-CE1 3.62Å; L235-Y237 HydrophobicContact CD1-CG 4.17Å; L235-A243 WeakPolarHBondContact O-CB 3.47Å
236	E	96.5	Very high	96.2	Very high	175 Å²	175	69.9 Å²	69.9	82%	0.818	39%	0.387	S	S	*	.			trans	-106.7	123	171.7	-65.8	-177.6	175.8	0	0	109.7	Q97	Q97-E236 PolarHBondContact NE2-O 3.24Å
237	Y	97.3	Very high	96.3	Very high	13 Å²	13	69.8 Å²	69.8	5%	0.051	39%	0.386	C	S	.	.			trans	-73.3	140.5	177.5	-74.3	-57.3	0	0	0	111.7	R94 V98 L235 D239 G240 T241 A243 Q247 V248 D251	R94-Y237 HydrophobicContact CB-CD1 3.84Å; R94-Y237 HydrophobicContact CB-CE1 3.48Å; R94-Y237 VanDerWaalsContact CB-CE1 3.48Å; R94-Y237 HydrophobicContact CG-CD1 3.62Å; R94-Y237 HydrophobicContact CG-CE1 3.79Å; R94-Y237 HydrophobicContact CG-CG 4.12Å; V98-Y237 HydrophobicContact CG2-CE1 3.97Å; L235-Y237 HydrophobicContact CD1-CD1 3.6Å; L235-Y237 HydrophobicContact CD1-CE1 3.62Å; L235-Y237 HydrophobicContact CD1-CG 4.17Å; Y237-D239 WeakPolarHBondContact CB-OD1 3.15Å; Y237-D239 PolarHBondContact O-N 3.47Å; Y237-G240 PolarHBondContact O-N 3.48Å; Y237-T241 HydrophobicContact CD2-CG2 4.12Å; Y237-T241 WeakPolarHBondContact CD2-O 3.31Å; Y237-T241 HydrophobicContact CE2-CG2 4.35Å; Y237-A243 HydrophobicContact CD2-CB 4.11Å; Y237-A243 HydrophobicContact CE2-CB 4.16Å; Y237-Q247 HydrophobicContact CE2-CG 4.24Å; Y237-V248 HydrophobicContact CE2-CG2 4.36Å; Y237-V248 WeakPolarHBondContact OH-CA 3.24Å; Y237-D251 VanDerWaalsContact CZ-OD2 3.28Å; Y237-D251 WeakPolarHBondContact OH-CB 3.49Å; Y237-D251 PolarHBondContact OH-OD2 3.17Å
238	E	94.7	Very high	96.4	Very high	129 Å²	129	67.6 Å²	67.6	60%	0.603	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-29.7	176.8	-65	176.9	179.9	0	0	113.2	R93	R93-E238 IonicContact CZ-OE2 2.71Å; R93-E238 IonicContact NE-OE2 3.82Å; R93-E238 PolarHBondContact NE-OE2 2.94Å; R93-E238 IonicContact NH2-OE2 3.86Å; R93-E238 PolarHBondContact NH2-OE2 3.44Å
239	D	95	Very high	96.5	Very high	88 Å²	88	64.6 Å²	64.6	47%	0.471	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	0.7	-179.2	69.2	6.4	0	0	0	113.9	R94 Y237 T241	R94-D239 WeakPolarHBondContact CD-OD2 3.29Å; R94-D239 IonicContact CZ-OD2 2.79Å; R94-D239 IonicContact NE-OD2 3.73Å; R94-D239 IonicContact NH1-OD2 3.74Å; R94-D239 PolarHBondContact NH1-OD2 3.2Å; Y237-D239 WeakPolarHBondContact CB-OD1 3.15Å; Y237-D239 PolarHBondContact O-N 3.47Å; D239-T241 VanDerWaalsContact C-N 3.3Å; D239-T241 VanDerWaalsContact CG-OG1 3.23Å; D239-T241 PolarHBondContact O-N 3.23Å; D239-T241 WeakPolarHBondContact OD1-CB 3.42Å; D239-T241 PolarHBondContact OD1-N 2.84Å; D239-T241 PolarHBondContact OD1-OG1 3.03Å; D239-T241 PolarHBondContact OD2-OG1 2.88Å
240	G	95.6	Very high	96.6	Very high	63 Å²	63	66.3 Å²	66.3	65%	0.649	35%	0.352	S	S	*	.			trans	75.5	11.6	-179.1	0	0	0	0	0	115	Y237	Y237-G240 PolarHBondContact O-N 3.48Å
241	T	97.3	Very high	96.7	Very high	37 Å²	37	65.8 Å²	65.8	23%	0.227	35%	0.35	C	S	.	.			trans	-59.6	137.6	173.1	-60.7	0	0	0	0	110.2	Y237 D239 A243 Q247	Y237-T241 HydrophobicContact CD2-CG2 4.12Å; Y237-T241 WeakPolarHBondContact CD2-O 3.31Å; Y237-T241 HydrophobicContact CE2-CG2 4.35Å; D239-T241 VanDerWaalsContact C-N 3.3Å; D239-T241 VanDerWaalsContact CG-OG1 3.23Å; D239-T241 PolarHBondContact O-N 3.23Å; D239-T241 WeakPolarHBondContact OD1-CB 3.42Å; D239-T241 PolarHBondContact OD1-N 2.84Å; D239-T241 PolarHBondContact OD1-OG1 3.03Å; D239-T241 PolarHBondContact OD2-OG1 2.88Å; T241-A243 PolarHBondContact O-N 3.1Å; T241-A243 VanDerWaalsContact O-N 3.15Å; T241-Q247 HydrophobicContact CG2-CG 3.8Å
242	P	97.3	Very high	96.9	Very high	98 Å²	98	59.2 Å²	59.2	64%	0.636	32%	0.324	S	S	*	.			trans	-63.7	117.1	174.8	-22.5	33.4	0	0	0	111.6	T244	P242-T244 PolarHBondContact O-N 3.28Å
243	A	96.9	Very high	97	Very high	10 Å²	10	54.1 Å²	54.1	8%	0.083	30%	0.297	C	S	.	.			trans	-78.3	58	-177.2	0	0	0	0	0	112.8	E233 L235 Y237 T241 V248	E233-A243 PolarHBondContact N-O 2.88Å; L235-A243 WeakPolarHBondContact O-CB 3.47Å; Y237-A243 HydrophobicContact CD2-CB 4.11Å; Y237-A243 HydrophobicContact CE2-CB 4.16Å; T241-A243 PolarHBondContact O-N 3.1Å; T241-A243 VanDerWaalsContact O-N 3.15Å; A243-V248 HydrophobicContact CB-CG2 4.2Å
244	T	97.9	Very high	97.2	Very high	61 Å²	61	46.2 Å²	46.2	37%	0.374	26%	0.26	S	S	.	.			trans	-69.9	152.3	170.9	64	0	0	0	0	110.6	P242 S246 Q247 V248	P242-T244 PolarHBondContact O-N 3.28Å; T244-S246 VanDerWaalsContact C-N 3.27Å; T244-S246 PolarHBondContact O-N 2.71Å; T244-Q247 PolarHBondContact O-N 2.93Å; T244-Q247 VanDerWaalsContact OG1-CB 3.24Å; T244-Q247 WeakPolarHBondContact OG1-CB 3.44Å; T244-Q247 PolarHBondContact OG1-N 3.13Å; T244-V248 WeakPolarHBondContact O-CG2 3.4Å; T244-V248 PolarHBondContact O-N 3.26Å
245	M	97.4	Very high	97.4	Very high	62 Å²	62	44.1 Å²	44.1	31%	0.305	25%	0.25	S	C	.	.	H	α-helix	trans	-53.1	-43.1	-178.2	-178.1	-171.4	70.1	0	0	112.6	T198 I230 N232 A249	T198-M245 HydrophobicContact CG2-CE 4.26Å; I230-M245 HydrophobicContact CD1-CG 3.96Å; I230-M245 HydrophobicContact CG1-CG 4.03Å; N232-M245 WeakPolarHBondContact OD1-CB 3.3Å; N232-M245 PolarHBondContact OD1-N 2.76Å; M245-A249 WeakPolarHBondContact O-CB 3.42Å; M245-A249 PolarHBondContact O-N 3.41Å
246	S	97.6	Very high	97.6	Very high	61 Å²	61	43.9 Å²	43.9	43%	0.427	25%	0.248	S	C	.	.	H	α-helix	trans	-70.3	-36.1	178.5	52.8	0	0	0	0	112.6	F194 T244 A249 K250	F194-S246 WeakPolarHBondContact CE2-O 3.49Å; T244-S246 VanDerWaalsContact C-N 3.27Å; T244-S246 PolarHBondContact O-N 2.71Å; S246-A249 PolarHBondContact O-N 3.47Å; S246-K250 WeakPolarHBondContact O-CB 3.49Å; S246-K250 PolarHBondContact O-N 2.7Å
247	Q	98.3	Very high	97.7	Very high	43 Å²	43	37.6 Å²	37.6	20%	0.201	22%	0.217	C	C	.	.	H	α-helix	trans	-66.3	-44.8	175.8	-176	57.1	49.1	0	0	111	Y237 T241 T244 A249 K250 D251	Y237-Q247 HydrophobicContact CE2-CG 4.24Å; T241-Q247 HydrophobicContact CG2-CG 3.8Å; T244-Q247 PolarHBondContact O-N 2.93Å; T244-Q247 VanDerWaalsContact OG1-CB 3.24Å; T244-Q247 WeakPolarHBondContact OG1-CB 3.44Å; T244-Q247 PolarHBondContact OG1-N 3.13Å; Q247-A249 PolarHBondContact O-N 3.17Å; Q247-K250 WeakPolarHBondContact O-CB 3.31Å; Q247-K250 PolarHBondContact O-N 3.14Å; Q247-D251 PolarHBondContact NE2-OD1 3.49Å; Q247-D251 PolarHBondContact NE2-OD2 3.34Å; Q247-D251 PolarHBondContact O-N 3.08Å; Q247-D251 VanDerWaalsContact O-OD2 3.13Å
248	V	98.4	Very high	97.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-58.6	-47.3	173.8	173.3	0	0	0	0	111.1	V98 I230 I234 Y237 A243 T244 K250 D251 V252	V98-V248 HydrophobicContact CB-CG1 4.36Å; V98-V248 HydrophobicContact CG1-CG1 3.53Å; V98-V248 HydrophobicContact CG2-CG1 3.83Å; I230-V248 HydrophobicContact CB-CG1 4.32Å; I230-V248 HydrophobicContact CG2-CG1 3.84Å; I234-V248 HydrophobicContact CG2-CG1 4.21Å; I234-V248 HydrophobicContact CG2-CG2 4.17Å; Y237-V248 HydrophobicContact CE2-CG2 4.36Å; Y237-V248 WeakPolarHBondContact OH-CA 3.24Å; A243-V248 HydrophobicContact CB-CG2 4.2Å; T244-V248 WeakPolarHBondContact O-CG2 3.4Å; T244-V248 PolarHBondContact O-N 3.26Å; V248-K250 VanDerWaalsContact C-N 3.35Å; V248-K250 PolarHBondContact O-N 3.03Å; V248-D251 PolarHBondContact O-N 3.21Å; V248-V252 WeakPolarHBondContact O-CG1 3.43Å; V248-V252 PolarHBondContact O-N 2.75Å
249	A	98.4	Very high	97.9	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-60.1	-42.3	176	0	0	0	0	0	112.4	F194 L197 T198 I230 M245 S246 Q247 V252 C253	F194-A249 HydrophobicContact CD2-CB 3.72Å; F194-A249 HydrophobicContact CE2-CB 3.72Å; L197-A249 HydrophobicContact CB-CB 4.34Å; T198-A249 HydrophobicContact CG2-CB 3.57Å; I230-A249 HydrophobicContact CD1-CB 3.74Å; M245-A249 WeakPolarHBondContact O-CB 3.42Å; M245-A249 PolarHBondContact O-N 3.41Å; S246-A249 PolarHBondContact O-N 3.47Å; Q247-A249 PolarHBondContact O-N 3.17Å; A249-V252 WeakPolarHBondContact O-CG1 3.5Å; A249-C253 VanDerWaalsContact O-CB 3.3Å; A249-C253 WeakPolarHBondContact O-CB 3.47Å; A249-C253 PolarHBondContact O-N 2.99Å; A249-C253 PolarHBondContact O-SG 2.88Å
250	K	98.6	Very high	98	Very high	72 Å²	72	27.4 Å²	27.4	31%	0.313	17%	0.168	S	C	.	.	H	α-helix	trans	-63.8	-47.8	178.7	-177.7	-154.2	175.1	-166.4	0	111.5	W78 F194 S246 Q247 V248 C253 T254	W78-K250 HydrophobicContact CZ3-CG 4.02Å; F194-K250 HydrophobicContact CE2-CB 4.11Å; S246-K250 WeakPolarHBondContact O-CB 3.49Å; S246-K250 PolarHBondContact O-N 2.7Å; Q247-K250 WeakPolarHBondContact O-CB 3.31Å; Q247-K250 PolarHBondContact O-N 3.14Å; V248-K250 VanDerWaalsContact C-N 3.35Å; V248-K250 PolarHBondContact O-N 3.03Å; K250-C253 PolarHBondContact O-N 3.49Å; K250-T254 PolarHBondContact O-N 3.13Å; K250-T254 PolarHBondContact O-OG1 3.39Å
251	D	98.7	Very high	98.1	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-66.3	-46.3	-177.1	-67	-42.7	0	0	0	110.4	S91 R94 G95 Y237 Q247 V248 C253 T254 F255	S91-D251 PolarHBondContact OG-OD1 3.35Å; S91-D251 VanDerWaalsContact OG-OD1 3.04Å; R94-D251 HydrophobicContact CB-CB 3.86Å; R94-D251 IonicContact CZ-OD1 2.85Å; R94-D251 VanDerWaalsContact NE-CG 3.28Å; R94-D251 IonicContact NE-OD1 3.91Å; R94-D251 PolarHBondContact NE-OD1 3.46Å; R94-D251 VanDerWaalsContact NE-OD1 3.07Å; R94-D251 IonicContact NE-OD2 3.85Å; R94-D251 PolarHBondContact NE-OD2 3.5Å; R94-D251 IonicContact NH2-OD1 3.95Å; R94-D251 PolarHBondContact NH2-OD1 3.21Å; G95-D251 VanDerWaalsContact CA-C 3.43Å; G95-D251 WeakPolarHBondContact CA-O 3.33Å; Y237-D251 VanDerWaalsContact CZ-OD2 3.28Å; Y237-D251 WeakPolarHBondContact OH-CB 3.49Å; Y237-D251 PolarHBondContact OH-OD2 3.17Å; Q247-D251 PolarHBondContact NE2-OD1 3.49Å; Q247-D251 PolarHBondContact NE2-OD2 3.34Å; Q247-D251 PolarHBondContact O-N 3.08Å; Q247-D251 VanDerWaalsContact O-OD2 3.13Å; V248-D251 PolarHBondContact O-N 3.21Å; D251-C253 PolarHBondContact O-N 3.26Å; D251-T254 PolarHBondContact O-N 3.42Å; D251-T254 VanDerWaalsContact O-N 3.17Å; D251-F255 PolarHBondContact O-N 3.46Å
252	V	98.5	Very high	98.2	Very high	3 Å²	3	26.8 Å²	26.8	2%	0.018	15%	0.151	C	C	.	.	H	α-helix	trans	-63.8	-38.4	177.1	75.6	0	0	0	0	112.2	V98 L197 V248 A249 T254 F255 L256	V98-V252 HydrophobicContact CB-CB 4.03Å; V98-V252 HydrophobicContact CB-CG2 4.24Å; V98-V252 HydrophobicContact CG1-CB 3.87Å; V98-V252 HydrophobicContact CG1-CG1 4.48Å; V98-V252 HydrophobicContact CG1-CG2 4.06Å; L197-V252 HydrophobicContact CD1-CG1 3.68Å; V248-V252 WeakPolarHBondContact O-CG1 3.43Å; V248-V252 PolarHBondContact O-N 2.75Å; A249-V252 WeakPolarHBondContact O-CG1 3.5Å; V252-T254 VanDerWaalsContact C-N 3.33Å; V252-T254 PolarHBondContact O-N 2.73Å; V252-F255 PolarHBondContact O-N 2.84Å; V252-L256 HydrophobicContact CG2-CD1 4.36Å; V252-L256 HydrophobicContact CG2-CG 4.41Å; V252-L256 WeakPolarHBondContact O-CB 3.38Å; V252-L256 VanDerWaalsContact O-CG 3.26Å; V252-L256 WeakPolarHBondContact O-CG 3.43Å; V252-L256 PolarHBondContact O-N 3.39Å
253	C	98.6	Very high	98.2	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.1	-40.7	174.7	-71.3	0	0	0	0	111.8	W78 E190 F194 A249 K250 D251 F255 L256 R257	W78-C253 HydrophobicContact CH2-CB 3.49Å; W78-C253 VanDerWaalsContact CH2-CB 3.49Å; W78-C253 HydrophobicContact CZ2-CB 4.39Å; W78-C253 HydrophobicContact CZ3-CB 3.85Å; E190-C253 HydrophobicContact CB-CB 4.39Å; F194-C253 PolarHBondContact N-SG 3.49Å; A249-C253 VanDerWaalsContact O-CB 3.3Å; A249-C253 WeakPolarHBondContact O-CB 3.47Å; A249-C253 PolarHBondContact O-N 2.99Å; A249-C253 PolarHBondContact O-SG 2.88Å; K250-C253 PolarHBondContact O-N 3.49Å; D251-C253 PolarHBondContact O-N 3.26Å; C253-F255 VanDerWaalsContact C-N 3.34Å; C253-F255 PolarHBondContact O-N 2.95Å; C253-L256 PolarHBondContact O-N 3.41Å; C253-R257 WeakPolarHBondContact O-CB 3.19Å; C253-R257 PolarHBondContact O-N 3.39Å
254	T	98.7	Very high	98.2	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.006	14%	0.138	C	C	.	.	H	α-helix	trans	-64.5	-40.5	176.8	-50.8	0	0	0	0	111.2	L87 S91 I92 K250 D251 V252 R257 W258	L87-T254 HydrophobicContact CD2-CG2 4.11Å; S91-T254 VanDerWaalsContact OG-CB 3.23Å; S91-T254 WeakPolarHBondContact OG-CB 3.44Å; S91-T254 PolarHBondContact OG-OG1 2.88Å; I92-T254 HydrophobicContact CG1-CG2 4.05Å; K250-T254 PolarHBondContact O-N 3.13Å; K250-T254 PolarHBondContact O-OG1 3.39Å; D251-T254 PolarHBondContact O-N 3.42Å; D251-T254 VanDerWaalsContact O-N 3.17Å; V252-T254 VanDerWaalsContact C-N 3.33Å; V252-T254 PolarHBondContact O-N 2.73Å; T254-R257 WeakPolarHBondContact O-CB 3.44Å; T254-R257 PolarHBondContact O-N 3.08Å; T254-W258 PolarHBondContact O-N 2.9Å; T254-W258 VanDerWaalsContact O-N 3.1Å
255	F	98.7	Very high	98.2	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64	-45.3	173.9	170.1	-102.3	0	0	0	112.4	I92 Y96 Y99 M109 L112 L117 D251 V252 C253 R257 W258 A259	I92-F255 HydrophobicContact CG2-CD2 3.95Å; Y96-F255 AromaticContact CD2-CE2 3.76Å; Y96-F255 HydrophobicContact CD2-CE2 3.76Å; Y96-F255 AromaticContact CD2-CZ 3.73Å; Y96-F255 HydrophobicContact CD2-CZ 3.73Å; Y96-F255 HydrophobicContact CG-CE2 4.19Å; Y99-F255 HydrophobicContact CD1-CE1 4.29Å; Y99-F255 HydrophobicContact CD2-CE1 4.44Å; Y99-F255 AromaticContact CG-CE1 3.88Å; Y99-F255 HydrophobicContact CG-CE1 3.88Å; M109-F255 HydrophobicContact CE-CE1 3.5Å; M109-F255 VanDerWaalsContact CE-CE1 3.5Å; M109-F255 HydrophobicContact CE-CZ 3.48Å; M109-F255 VanDerWaalsContact CE-CZ 3.48Å; M109-F255 HydrophobicContact SD-CE1 3.94Å; M109-F255 HydrophobicContact SD-CZ 4.14Å; L112-F255 HydrophobicContact CD1-CZ 4.47Å; L117-F255 HydrophobicContact CD2-CE2 4.27Å; D251-F255 PolarHBondContact O-N 3.46Å; V252-F255 PolarHBondContact O-N 2.84Å; C253-F255 VanDerWaalsContact C-N 3.34Å; C253-F255 PolarHBondContact O-N 2.95Å; F255-R257 VanDerWaalsContact C-N 3.26Å; F255-R257 PolarHBondContact O-N 3.05Å; F255-W258 AromaticContact CD2-CE3 3.9Å; F255-W258 HydrophobicContact CD2-CE3 3.9Å; F255-W258 HydrophobicContact CD2-CZ3 4.22Å; F255-W258 AromaticContact CE2-CE3 3.71Å; F255-W258 HydrophobicContact CE2-CE3 3.71Å; F255-W258 AromaticContact CE2-CZ3 3.56Å; F255-W258 HydrophobicContact CE2-CZ3 3.56Å; F255-W258 HydrophobicContact CZ-CZ3 4.27Å; F255-W258 WeakPolarHBondContact O-CB 3.24Å; F255-W258 PolarHBondContact O-N 3.21Å; F255-A259 PolarHBondContact O-N 2.88Å
256	L	98.6	Very high	98.2	Very high	5 Å²	5	28.4 Å²	28.4	3%	0.026	14%	0.144	C	C	.	.	H	α-helix	trans	-64.7	-32.1	176.6	-68.7	176.2	0	0	0	112	L179 I182 V183 I193 V252 C253 A259 A260	L179-L256 HydrophobicContact CB-CD2 3.82Å; L179-L256 HydrophobicContact CD1-CD2 4.37Å; I182-L256 HydrophobicContact CG2-CD1 4.07Å; I182-L256 HydrophobicContact CG2-CD2 4.33Å; V183-L256 VanDerWaalsContact CG2-C 3.45Å; V183-L256 HydrophobicContact CG2-CB 3.64Å; V183-L256 WeakPolarHBondContact CG2-O 3.46Å; I193-L256 HydrophobicContact CD1-CD1 4.46Å; I193-L256 HydrophobicContact CG2-CD1 4.21Å; V252-L256 HydrophobicContact CG2-CD1 4.36Å; V252-L256 HydrophobicContact CG2-CG 4.41Å; V252-L256 WeakPolarHBondContact O-CB 3.38Å; V252-L256 VanDerWaalsContact O-CG 3.26Å; V252-L256 WeakPolarHBondContact O-CG 3.43Å; V252-L256 PolarHBondContact O-N 3.39Å; C253-L256 PolarHBondContact O-N 3.41Å; L256-A259 PolarHBondContact O-N 3.41Å; L256-A260 WeakPolarHBondContact O-CB 3.18Å; L256-A260 PolarHBondContact O-N 3.3Å
257	R	98.5	Very high	98.2	Very high	43 Å²	43	30.7 Å²	30.7	16%	0.162	14%	0.143	C	C	.	.	H	α-helix	trans	-63.4	-45.8	173.4	-177.7	63.5	176.5	154.7	10.3	111.1	L87 N184 E190 C253 T254 F255 A260 E261	L87-R257 HydrophobicContact CD2-CB 4.29Å; L87-R257 HydrophobicContact CD2-CG 3.9Å; N184-R257 PolarHBondContact OD1-NH1 3.21Å; E190-R257 WeakPolarHBondContact OE2-CB 3.27Å; E190-R257 WeakPolarHBondContact OE2-CD 3.41Å; E190-R257 WeakPolarHBondContact OE2-CG 3.25Å; E190-R257 IonicContact OE2-NE 2.66Å; C253-R257 WeakPolarHBondContact O-CB 3.19Å; C253-R257 PolarHBondContact O-N 3.39Å; T254-R257 WeakPolarHBondContact O-CB 3.44Å; T254-R257 PolarHBondContact O-N 3.08Å; F255-R257 VanDerWaalsContact C-N 3.26Å; F255-R257 PolarHBondContact O-N 3.05Å; R257-A260 PolarHBondContact O-N 2.98Å; R257-E261 IonicContact CZ-OE1 3.2Å; R257-E261 IonicContact CZ-OE2 3.37Å; R257-E261 VanDerWaalsContact NH1-CD 3.31Å; R257-E261 IonicContact NH1-OE1 2.81Å; R257-E261 PolarHBondContact NH1-OE1 2.83Å; R257-E261 IonicContact NH1-OE2 3.75Å; R257-E261 IonicContact NH2-OE1 2.93Å; R257-E261 PolarHBondContact NH2-OE1 3.34Å; R257-E261 IonicContact NH2-OE2 2.79Å; R257-E261 PolarHBondContact NH2-OE2 3.32Å; R257-E261 PolarHBondContact O-N 3.2Å
258	W	98.6	Very high	98.2	Very high	9 Å²	9	30.2 Å²	30.2	3%	0.034	14%	0.141	C	C	.	.	H	α-helix	trans	-62.9	-43.1	173.4	169.9	74.6	0	0	0	112	L87 I92 L112 N116 L117 V120 T254 F255 A260 E261 P262	L87-W258 HydrophobicContact CD1-CB 4.01Å; I92-W258 HydrophobicContact CD1-CB 3.69Å; I92-W258 HydrophobicContact CD1-CG 3.82Å; I92-W258 HydrophobicContact CG1-CB 4.05Å; I92-W258 HydrophobicContact CG1-CG 4.49Å; I92-W258 HydrophobicContact CG2-CB 4.37Å; I92-W258 HydrophobicContact CG2-CD2 4.16Å; I92-W258 HydrophobicContact CG2-CE3 4.14Å; I92-W258 HydrophobicContact CG2-CG 4.24Å; L112-W258 HydrophobicContact CD1-CE3 4.17Å; L112-W258 HydrophobicContact CD1-CH2 3.83Å; L112-W258 HydrophobicContact CD1-CZ3 3.38Å; L112-W258 HydrophobicContact CD2-CH2 4.49Å; N116-W258 HydrophobicContact CB-CH2 4.09Å; N116-W258 HydrophobicContact CB-CZ2 4.31Å; N116-W258 VanDerWaalsContact O-CZ2 3.27Å; N116-W258 WeakPolarHBondContact O-CZ2 3.38Å; L117-W258 HydrophobicContact CD2-CH2 3.73Å; L117-W258 HydrophobicContact CD2-CZ3 3.81Å; V120-W258 HydrophobicContact CB-CZ2 4.23Å; V120-W258 HydrophobicContact CG1-CD2 4.25Å; V120-W258 HydrophobicContact CG1-CG 4.43Å; V120-W258 HydrophobicContact CG1-CZ2 3.98Å; V120-W258 HydrophobicContact CG2-CZ2 4.06Å; T254-W258 PolarHBondContact O-N 2.9Å; T254-W258 VanDerWaalsContact O-N 3.1Å; F255-W258 AromaticContact CD2-CE3 3.9Å; F255-W258 HydrophobicContact CD2-CE3 3.9Å; F255-W258 HydrophobicContact CD2-CZ3 4.22Å; F255-W258 AromaticContact CE2-CE3 3.71Å; F255-W258 HydrophobicContact CE2-CE3 3.71Å; F255-W258 AromaticContact CE2-CZ3 3.56Å; F255-W258 HydrophobicContact CE2-CZ3 3.56Å; F255-W258 HydrophobicContact CZ-CZ3 4.27Å; F255-W258 WeakPolarHBondContact O-CB 3.24Å; F255-W258 PolarHBondContact O-N 3.21Å; W258-A260 VanDerWaalsContact C-N 3.29Å; W258-A260 PolarHBondContact O-N 3.43Å; W258-E261 CarbonylContact O-C 3.57Å; W258-E261 PolarHBondContact O-N 3.46Å; W258-P262 WeakPolarHBondContact O-CA 3.5Å; W258-P262 WeakPolarHBondContact O-CD 3.04Å; W258-P262 WeakPolarHBondContact O-CG 3.2Å
259	A	98.3	Very high	98.1	Very high	4 Å²	4	38.4 Å²	38.4	3%	0.033	17%	0.171	C	C	.	.	H	α-helix	trans	-60.3	-40	179.6	0	0	0	0	0	112.2	M109 L112 S180 F255 L256	M109-A259 HydrophobicContact SD-CB 3.97Å; L112-A259 HydrophobicContact CD1-CB 3.68Å; L112-A259 HydrophobicContact CG-CB 4.42Å; S180-A259 CarbonylContact O-C 3.6Å; F255-A259 PolarHBondContact O-N 2.88Å; L256-A259 PolarHBondContact O-N 3.41Å
260	A	98.3	Very high	98.1	Very high	3 Å²	3	42.9 Å²	42.9	3%	0.025	19%	0.194	C	C	.	.	H	α-helix	trans	-78.4	-27.8	179.2	0	0	0	0	0	113.9	S180 Y181 V183 N184 L256 R257 W258	S180-A260 WeakPolarHBondContact O-CA 3.28Å; S180-A260 PolarHBondContact O-N 3.48Å; Y181-A260 HydrophobicContact CD1-CB 4.26Å; Y181-A260 WeakPolarHBondContact CE1-O 3.35Å; V183-A260 HydrophobicContact CB-CB 4.01Å; V183-A260 HydrophobicContact CG2-CB 4.49Å; N184-A260 PolarHBondContact ND2-O 3.36Å; L256-A260 WeakPolarHBondContact O-CB 3.18Å; L256-A260 PolarHBondContact O-N 3.3Å; R257-A260 PolarHBondContact O-N 2.98Å; W258-A260 VanDerWaalsContact C-N 3.29Å; W258-A260 PolarHBondContact O-N 3.43Å
261	E	97.6	Very high	98	Very high	26 Å²	26	40.8 Å²	40.8	12%	0.121	19%	0.193	C	C	.	.			trans	-137.4	71.9	178.5	-62.3	-176	-167.7	0	0	112	N184 R257 W258 E263 H264 R267	N184-E261 WeakPolarHBondContact ND2-CG 3.44Å; N184-E261 PolarHBondContact OD1-OE1 2.86Å; R257-E261 IonicContact CZ-OE1 3.2Å; R257-E261 IonicContact CZ-OE2 3.37Å; R257-E261 VanDerWaalsContact NH1-CD 3.31Å; R257-E261 IonicContact NH1-OE1 2.81Å; R257-E261 PolarHBondContact NH1-OE1 2.83Å; R257-E261 IonicContact NH1-OE2 3.75Å; R257-E261 IonicContact NH2-OE1 2.93Å; R257-E261 PolarHBondContact NH2-OE1 3.34Å; R257-E261 IonicContact NH2-OE2 2.79Å; R257-E261 PolarHBondContact NH2-OE2 3.32Å; R257-E261 PolarHBondContact O-N 3.2Å; W258-E261 CarbonylContact O-C 3.57Å; W258-E261 PolarHBondContact O-N 3.46Å; E261-E263 PolarHBondContact O-N 3.03Å; E261-E263 VanDerWaalsContact O-N 3.11Å; E261-H264 HydrophobicContact CB-CB 4.29Å; E261-H264 VanDerWaalsContact O-CB 3.22Å; E261-H264 WeakPolarHBondContact O-CB 3.37Å; E261-H264 PolarHBondContact O-N 3.48Å; E261-H264 IonicContact OE2-CD2 2.96Å; E261-R267 IonicContact OE2-CZ 3.52Å; E261-R267 IonicContact OE2-NH2 2.85Å; E261-R267 PolarHBondContact OE2-NH2 3.48Å
262	P	97.8	Very high	98	Very high	62 Å²	62	44.2 Å²	44.2	40%	0.403	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-24.5	-179.3	-23.4	34.1	0	0	0	113.1	W258 H264	W258-P262 WeakPolarHBondContact O-CA 3.5Å; W258-P262 WeakPolarHBondContact O-CD 3.04Å; W258-P262 WeakPolarHBondContact O-CG 3.2Å; P262-H264 VanDerWaalsContact C-N 3.3Å; P262-H264 PolarHBondContact O-N 3.47Å
263	E	97.7	Very high	97.9	Very high	93 Å²	93	50.1 Å²	50.1	44%	0.435	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-0.7	178.6	81.5	-70.5	172.9	0	0	114.2	E261 D265 Q266 R267	E261-E263 PolarHBondContact O-N 3.03Å; E261-E263 VanDerWaalsContact O-N 3.11Å; E263-D265 VanDerWaalsContact C-N 3.33Å; E263-D265 PolarHBondContact O-N 3.21Å; E263-Q266 PolarHBondContact O-N 3.48Å; E263-R267 HydrophobicContact CG-CB 4.32Å; E263-R267 WeakPolarHBondContact O-CB 3.45Å; E263-R267 PolarHBondContact O-N 3.48Å; E263-R267 IonicContact OE1-NE 2.85Å
264	H	98.1	Very high	97.8	Very high	3 Å²	3	55.7 Å²	55.7	1%	0.014	27%	0.265	C	S	.	.	H	α-helix	trans	-46.6	-51.1	-173.3	175.7	-87.9	0	0	0	113.7	L87 E261 P262 R267 K268	L87-H264 HydrophobicContact CD1-CB 3.88Å; E261-H264 HydrophobicContact CB-CB 4.29Å; E261-H264 VanDerWaalsContact O-CB 3.22Å; E261-H264 WeakPolarHBondContact O-CB 3.37Å; E261-H264 PolarHBondContact O-N 3.48Å; E261-H264 IonicContact OE2-CD2 2.96Å; P262-H264 VanDerWaalsContact C-N 3.3Å; P262-H264 PolarHBondContact O-N 3.47Å; H264-R267 PolarHBondContact O-N 3.39Å; H264-K268 WeakPolarHBondContact CE1-CE 3.32Å; H264-K268 PolarHBondContact CE1-NZ 2.94Å; H264-K268 WeakPolarHBondContact NE2-CE 3.47Å; H264-K268 PolarHBondContact NE2-NZ 2.8Å; H264-K268 PolarHBondContact O-N 3.06Å
265	D	97.5	Very high	97.8	Very high	30 Å²	30	61.3 Å²	61.3	16%	0.16	29%	0.294	C	S	.	.	H	α-helix	trans	-72.9	-41.2	-175.2	-71.5	0.6	0	0	0	112.1	S86 L87 H89 E263 R267 R269	S86-D265 WeakPolarHBondContact CA-OD1 3.37Å; L87-D265 PolarHBondContact N-OD1 3.33Å; H89-D265 IonicContact NE2-OD2 2.65Å; H89-D265 PolarHBondContact NE2-OD2 2.94Å; E263-D265 VanDerWaalsContact C-N 3.33Å; E263-D265 PolarHBondContact O-N 3.21Å; D265-R267 VanDerWaalsContact C-N 3.34Å; D265-R269 VanDerWaalsContact O-CB 3.31Å; D265-R269 WeakPolarHBondContact O-CB 3.24Å; D265-R269 PolarHBondContact O-N 3.49Å
266	Q	97.5	Very high	97.7	Very high	139 Å²	139	67 Å²	67	65%	0.65	32%	0.323	S	S	*	.	H	α-helix	trans	-65	-40.4	174.8	-177.4	173.1	-11.4	0	0	111	E263 R269 M270	E263-Q266 PolarHBondContact O-N 3.48Å; Q266-R269 PolarHBondContact O-N 2.79Å; Q266-M270 HydrophobicContact CG-CG 4.31Å; Q266-M270 VanDerWaalsContact O-CB 3.32Å; Q266-M270 WeakPolarHBondContact O-CB 3.33Å; Q266-M270 VanDerWaalsContact O-CG 3.31Å; Q266-M270 WeakPolarHBondContact O-CG 3.43Å; Q266-M270 PolarHBondContact O-N 2.82Å
267	R	98.1	Very high	97.7	Very high	109 Å²	109	68.2 Å²	68.2	41%	0.411	34%	0.336	S	S	.	.	H	α-helix	trans	-62	-46.1	178.5	-179.6	167.4	56.6	70.4	-0.8	111.3	E261 E263 H264 D265 M270 G271	E261-R267 IonicContact OE2-CZ 3.52Å; E261-R267 IonicContact OE2-NH2 2.85Å; E261-R267 PolarHBondContact OE2-NH2 3.48Å; E263-R267 HydrophobicContact CG-CB 4.32Å; E263-R267 WeakPolarHBondContact O-CB 3.45Å; E263-R267 PolarHBondContact O-N 3.48Å; E263-R267 IonicContact OE1-NE 2.85Å; H264-R267 PolarHBondContact O-N 3.39Å; D265-R267 VanDerWaalsContact C-N 3.34Å; R267-M270 PolarHBondContact O-N 3.09Å; R267-G271 PolarHBondContact O-N 2.93Å
268	K	97.6	Very high	97.7	Very high	32 Å²	32	68 Å²	68	14%	0.139	34%	0.341	C	S	.	.	H	α-helix	trans	-67.2	-42.1	175.8	-72.2	-175.7	179.8	-178.1	0	112.6	H80 G82 P83 S85 H264 M270 G271 L272	H80-K268 PolarHBondContact O-NZ 3.43Å; G82-K268 PolarHBondContact O-NZ 3.4Å; P83-K268 WeakPolarHBondContact O-CD 3.26Å; S85-K268 VanDerWaalsContact O-CD 3.24Å; S85-K268 WeakPolarHBondContact O-CD 3.26Å; S85-K268 PolarHBondContact O-NZ 2.82Å; H264-K268 WeakPolarHBondContact CE1-CE 3.32Å; H264-K268 PolarHBondContact CE1-NZ 2.94Å; H264-K268 WeakPolarHBondContact NE2-CE 3.47Å; H264-K268 PolarHBondContact NE2-NZ 2.8Å; H264-K268 PolarHBondContact O-N 3.06Å; K268-M270 VanDerWaalsContact C-N 3.35Å; K268-M270 PolarHBondContact O-N 2.86Å; K268-G271 PolarHBondContact O-N 3.25Å; K268-L272 PolarHBondContact O-N 3.48Å
269	R	96.8	Very high	97.6	Very high	172 Å²	172	70.9 Å²	70.9	65%	0.649	37%	0.366	S	S	*	.	H	α-helix	trans	-59.7	-45	174.9	-175.1	-175.7	-65.1	-179	-0.1	111.8	D265 Q266 L272 K273	D265-R269 VanDerWaalsContact O-CB 3.31Å; D265-R269 WeakPolarHBondContact O-CB 3.24Å; D265-R269 PolarHBondContact O-N 3.49Å; Q266-R269 PolarHBondContact O-N 2.79Å; R269-L272 PolarHBondContact O-N 3.41Å; R269-K273 WeakPolarHBondContact O-CG 3.32Å; R269-K273 PolarHBondContact O-N 3.4Å
270	M	97.7	Very high	97.6	Very high	95 Å²	95	76.5 Å²	76.5	47%	0.468	40%	0.395	S	S	.	.	H	α-helix	trans	-68	-38.3	176.1	-74.9	-53.5	-48.6	0	0	112	Q266 R267 K268 L272 K273 L274	Q266-M270 HydrophobicContact CG-CG 4.31Å; Q266-M270 VanDerWaalsContact O-CB 3.32Å; Q266-M270 WeakPolarHBondContact O-CB 3.33Å; Q266-M270 VanDerWaalsContact O-CG 3.31Å; Q266-M270 WeakPolarHBondContact O-CG 3.43Å; Q266-M270 PolarHBondContact O-N 2.82Å; R267-M270 PolarHBondContact O-N 3.09Å; K268-M270 VanDerWaalsContact C-N 3.35Å; K268-M270 PolarHBondContact O-N 2.86Å; M270-L272 PolarHBondContact O-N 2.83Å; M270-K273 HydrophobicContact CE-CD 4.49Å; M270-K273 PolarHBondContact O-N 2.94Å; M270-K273 HydrophobicContact SD-CD 4.09Å; M270-L274 WeakPolarHBondContact O-CB 3.49Å; M270-L274 PolarHBondContact O-N 3Å
271	G	97.1	Very high	97.6	Very high	28 Å²	28	81.4 Å²	81.4	29%	0.289	42%	0.42	S	S	.	.	H	α-helix	trans	-56.6	-46.4	173.2	0	0	0	0	0	112.2	R267 K268 K273 L274 L275	R267-G271 PolarHBondContact O-N 2.93Å; K268-G271 PolarHBondContact O-N 3.25Å; G271-K273 PolarHBondContact O-N 3.44Å; G271-L274 PolarHBondContact O-N 3.29Å; G271-L275 WeakPolarHBondContact O-CB 3.34Å; G271-L275 VanDerWaalsContact O-CG 3.31Å; G271-L275 WeakPolarHBondContact O-CG 3.49Å; G271-L275 PolarHBondContact O-N 3.01Å
272	L	97.1	Very high	97.7	Very high	71 Å²	71	85.6 Å²	85.6	37%	0.372	44%	0.442	S	S	.	.	H	α-helix	trans	-59.8	-47.7	175.3	179	62.3	0	0	0	112.1	L84 K268 R269 M270 L274 L275 M276	L84-L272 HydrophobicContact CD1-CD1 4.25Å; L84-L272 HydrophobicContact CD2-CB 3.85Å; L84-L272 HydrophobicContact CD2-CD1 3.91Å; L84-L272 HydrophobicContact CD2-CD2 4.21Å; L84-L272 HydrophobicContact CD2-CG 4.19Å; K268-L272 PolarHBondContact O-N 3.48Å; R269-L272 PolarHBondContact O-N 3.41Å; M270-L272 PolarHBondContact O-N 2.83Å; L272-L274 VanDerWaalsContact C-N 3.3Å; L272-L274 PolarHBondContact O-N 3.29Å; L272-L275 PolarHBondContact O-N 3.05Å; L272-M276 HydrophobicContact CD1-CG 4.28Å; L272-M276 HydrophobicContact CD1-SD 4.27Å; L272-M276 HydrophobicContact CG-SD 4.16Å; L272-M276 WeakPolarHBondContact O-CG 3.32Å; L272-M276 PolarHBondContact O-N 2.88Å
273	K	96.9	Very high	97.7	Very high	127 Å²	127	86 Å²	86	55%	0.552	45%	0.445	S	S	*	.	H	α-helix	trans	-59.2	-42.4	177.4	-69.7	179.7	-179.8	-176.6	0	111.6	R269 M270 G271 M276 G277	R269-K273 WeakPolarHBondContact O-CG 3.32Å; R269-K273 PolarHBondContact O-N 3.4Å; M270-K273 HydrophobicContact CE-CD 4.49Å; M270-K273 PolarHBondContact O-N 2.94Å; M270-K273 HydrophobicContact SD-CD 4.09Å; G271-K273 PolarHBondContact O-N 3.44Å; K273-M276 PolarHBondContact O-N 3.01Å; K273-G277 PolarHBondContact O-N 2.94Å
274	L	97.5	Very high	97.8	Very high	118 Å²	118	86 Å²	86	62%	0.618	45%	0.447	S	S	*	.	H	α-helix	trans	-64.6	-43.3	177.3	-178.5	67.3	0	0	0	111.7	M270 G271 L272 G277 S278	M270-L274 WeakPolarHBondContact O-CB 3.49Å; M270-L274 PolarHBondContact O-N 3Å; G271-L274 PolarHBondContact O-N 3.29Å; L272-L274 VanDerWaalsContact C-N 3.3Å; L272-L274 PolarHBondContact O-N 3.29Å; L274-G277 PolarHBondContact O-N 3.16Å; L274-S278 VanDerWaalsContact O-CB 3.24Å; L274-S278 WeakPolarHBondContact O-CB 3.31Å; L274-S278 PolarHBondContact O-N 2.94Å; L274-S278 PolarHBondContact O-OG 2.81Å
275	L	97.6	Very high	97.8	Very high	119 Å²	119	90.2 Å²	90.2	62%	0.623	47%	0.473	S	S	*	.	H	α-helix	trans	-62.9	-44.7	177.3	-73.2	175.7	0	0	0	111.4	G271 L272 S278 A279	G271-L275 WeakPolarHBondContact O-CB 3.34Å; G271-L275 VanDerWaalsContact O-CG 3.31Å; G271-L275 WeakPolarHBondContact O-CG 3.49Å; G271-L275 PolarHBondContact O-N 3.01Å; L272-L275 PolarHBondContact O-N 3.05Å; L275-S278 PolarHBondContact O-N 3.39Å; L275-A279 WeakPolarHBondContact O-CB 3.34Å; L275-A279 PolarHBondContact O-N 2.97Å
276	M	97.4	Very high	97.8	Very high	120 Å²	120	94.8 Å²	94.8	59%	0.591	49%	0.489	S	S	*	.	H	α-helix	trans	-62.9	-45.3	176	-69.3	178.6	69.8	0	0	112	L272 K273 S278 A279 I280	L272-M276 HydrophobicContact CD1-CG 4.28Å; L272-M276 HydrophobicContact CD1-SD 4.27Å; L272-M276 HydrophobicContact CG-SD 4.16Å; L272-M276 WeakPolarHBondContact O-CG 3.32Å; L272-M276 PolarHBondContact O-N 2.88Å; K273-M276 PolarHBondContact O-N 3.01Å; M276-S278 PolarHBondContact O-N 2.91Å; M276-A279 PolarHBondContact O-N 3.36Å; M276-I280 PolarHBondContact O-N 3.28Å
277	G	98	Very high	97.9	Very high	30 Å²	30	95.5 Å²	95.5	31%	0.309	49%	0.487	S	S	.	.	H	α-helix	trans	-63.1	-41.8	176.4	0	0	0	0	0	112.5	K273 L274 A279 I280 L281	K273-G277 PolarHBondContact O-N 2.94Å; L274-G277 PolarHBondContact O-N 3.16Å; G277-A279 VanDerWaalsContact C-N 3.35Å; G277-A279 PolarHBondContact O-N 2.93Å; G277-I280 PolarHBondContact O-N 2.99Å; G277-L281 WeakPolarHBondContact O-CG 3.31Å; G277-L281 PolarHBondContact O-N 2.96Å
278	S	98.1	Very high	97.9	Very high	39 Å²	39	95.4 Å²	95.4	27%	0.273	49%	0.492	S	S	.	.	H	α-helix	trans	-66.2	-36.9	177.5	-58.8	0	0	0	0	112	L274 L275 M276 I280 L281 I282	L274-S278 VanDerWaalsContact O-CB 3.24Å; L274-S278 WeakPolarHBondContact O-CB 3.31Å; L274-S278 PolarHBondContact O-N 2.94Å; L274-S278 PolarHBondContact O-OG 2.81Å; L275-S278 PolarHBondContact O-N 3.39Å; M276-S278 PolarHBondContact O-N 2.91Å; S278-I280 PolarHBondContact O-N 2.86Å; S278-L281 PolarHBondContact O-N 2.93Å; S278-I282 VanDerWaalsContact O-CB 3.27Å; S278-I282 WeakPolarHBondContact O-CB 3.3Å; S278-I282 VanDerWaalsContact O-CG1 3.25Å; S278-I282 WeakPolarHBondContact O-CG1 3.3Å; S278-I282 PolarHBondContact O-N 3.22Å
279	A	98	Very high	97.9	Very high	68 Å²	68	98.4 Å²	98.4	56%	0.562	51%	0.505	S	S	*	.	H	α-helix	trans	-61.5	-24.4	176.1	0	0	0	0	0	113	L275 M276 G277 P283	L275-A279 WeakPolarHBondContact O-CB 3.34Å; L275-A279 PolarHBondContact O-N 2.97Å; M276-A279 PolarHBondContact O-N 3.36Å; G277-A279 VanDerWaalsContact C-N 3.35Å; G277-A279 PolarHBondContact O-N 2.93Å; A279-P283 WeakPolarHBondContact O-CD 3.45Å; A279-P283 WeakPolarHBondContact O-CG 3.32Å
280	I	98	Very high	98	Very high	123 Å²	123	97 Å²	97	63%	0.631	50%	0.5	S	S	*	.	H	α-helix	trans	-90.1	-46.7	175	-60.9	169.9	0	0	0	110.9	M276 G277 S278 P283 L284	M276-I280 PolarHBondContact O-N 3.28Å; G277-I280 PolarHBondContact O-N 2.99Å; S278-I280 PolarHBondContact O-N 2.86Å; I280-P283 WeakPolarHBondContact O-CD 3.21Å; I280-L284 WeakPolarHBondContact O-CB 3.29Å; I280-L284 PolarHBondContact O-N 2.81Å
281	L	98.4	Very high	98	Very high	105 Å²	105	97.9 Å²	97.9	55%	0.55	50%	0.503	S	S	.	.	H	α-helix	trans	-69.8	-39.7	-174.8	-72.1	173.2	0	0	0	112.9	G277 S278 L284 V285	G277-L281 WeakPolarHBondContact O-CG 3.31Å; G277-L281 PolarHBondContact O-N 2.96Å; S278-L281 PolarHBondContact O-N 2.93Å; L281-L284 PolarHBondContact O-N 2.87Å; L281-V285 WeakPolarHBondContact O-CB 3.39Å; L281-V285 VanDerWaalsContact O-CG2 3.32Å; L281-V285 WeakPolarHBondContact O-CG2 3.34Å; L281-V285 PolarHBondContact O-N 3.26Å
282	I	98.6	Very high	98	Very high	115 Å²	115	106 Å²	106	59%	0.59	53%	0.525	S	S	*	.	H	α-helix	trans	-62.3	-50.8	-177.4	-68.3	168.4	0	0	0	111.1	S278 L284 V285 Y286	S278-I282 VanDerWaalsContact O-CB 3.27Å; S278-I282 WeakPolarHBondContact O-CB 3.3Å; S278-I282 VanDerWaalsContact O-CG1 3.25Å; S278-I282 WeakPolarHBondContact O-CG1 3.3Å; S278-I282 PolarHBondContact O-N 3.22Å; I282-L284 VanDerWaalsContact C-N 3.32Å; I282-L284 PolarHBondContact O-N 2.82Å; I282-V285 PolarHBondContact O-N 3Å; I282-Y286 WeakPolarHBondContact O-CB 3.4Å; I282-Y286 PolarHBondContact O-N 3.1Å
283	P	98.5	Very high	98.1	Very high	71 Å²	71	108.2 Å²	108.2	46%	0.461	53%	0.528	S	S	.	.	H	α-helix	trans	-61.7	-37.1	175.4	-25.8	36.3	0	0	0	113.5	A279 I280 Y286 Y287	A279-P283 WeakPolarHBondContact O-CD 3.45Å; A279-P283 WeakPolarHBondContact O-CG 3.32Å; I280-P283 WeakPolarHBondContact O-CD 3.21Å; P283-Y286 PolarHBondContact O-N 2.81Å; P283-Y287 WeakPolarHBondContact O-CB 3.36Å; P283-Y287 PolarHBondContact O-N 3.44Å
284	L	98.4	Very high	98.1	Very high	92 Å²	92	105.7 Å²	105.7	48%	0.482	52%	0.524	S	S	.	.	H	α-helix	trans	-64.5	-50.2	178.3	-179.4	65.8	0	0	0	111.5	I280 L281 I282 Y286 Y287 M288	I280-L284 WeakPolarHBondContact O-CB 3.29Å; I280-L284 PolarHBondContact O-N 2.81Å; L281-L284 PolarHBondContact O-N 2.87Å; I282-L284 VanDerWaalsContact C-N 3.32Å; I282-L284 PolarHBondContact O-N 2.82Å; L284-Y286 VanDerWaalsContact C-N 3.28Å; L284-Y286 PolarHBondContact O-N 3.44Å; L284-Y287 WeakPolarHBondContact O-CB 3.24Å; L284-Y287 PolarHBondContact O-N 2.93Å; L284-M288 WeakPolarHBondContact O-CG 3.18Å; L284-M288 PolarHBondContact O-N 2.91Å
285	V	98.6	Very high	98.2	Very high	91 Å²	91	105.4 Å²	105.4	55%	0.552	53%	0.527	S	S	*	.	H	α-helix	trans	-62.2	-40.9	176.1	171.9	0	0	0	0	110.3	L281 I282 Y287 M288 K289	L281-V285 WeakPolarHBondContact O-CB 3.39Å; L281-V285 VanDerWaalsContact O-CG2 3.32Å; L281-V285 WeakPolarHBondContact O-CG2 3.34Å; L281-V285 PolarHBondContact O-N 3.26Å; I282-V285 PolarHBondContact O-N 3Å; V285-Y287 PolarHBondContact O-N 3.39Å; V285-M288 PolarHBondContact O-N 2.93Å; V285-K289 WeakPolarHBondContact O-CB 3.31Å; V285-K289 PolarHBondContact O-N 3.48Å
286	Y	98.4	Very high	98.1	Very high	127 Å²	127	104 Å²	104	50%	0.498	52%	0.519	S	S	.	.	H	α-helix	trans	-61.8	-43.1	175.8	179.2	-110.9	0	0	0	111.7	I282 P283 L284 K289 R290	I282-Y286 WeakPolarHBondContact O-CB 3.4Å; I282-Y286 PolarHBondContact O-N 3.1Å; P283-Y286 PolarHBondContact O-N 2.81Å; L284-Y286 VanDerWaalsContact C-N 3.28Å; L284-Y286 PolarHBondContact O-N 3.44Å; Y286-K289 WeakPolarHBondContact O-CB 3.29Å; Y286-K289 PolarHBondContact O-N 2.97Å; Y286-R290 HydrophobicContact CD1-CG 4.34Å; Y286-R290 HydrophobicContact CD2-CG 4.42Å; Y286-R290 HydrophobicContact CE1-CG 3.95Å; Y286-R290 HydrophobicContact CE2-CG 4.01Å; Y286-R290 VanDerWaalsContact O-CG 3.31Å; Y286-R290 WeakPolarHBondContact O-CG 3.14Å; Y286-R290 PolarHBondContact O-N 3.03Å; Y286-R290 PolarHBondContact OH-NH1 3.33Å
287	Y	98.4	Very high	98.1	Very high	153 Å²	153	106 Å²	106	60%	0.6	52%	0.524	S	S	*	.	H	α-helix	trans	-60.2	-49.7	174	173.8	-94.4	0	0	0	111.4	P283 L284 V285 K289 R290 H291	P283-Y287 WeakPolarHBondContact O-CB 3.36Å; P283-Y287 PolarHBondContact O-N 3.44Å; L284-Y287 WeakPolarHBondContact O-CB 3.24Å; L284-Y287 PolarHBondContact O-N 2.93Å; V285-Y287 PolarHBondContact O-N 3.39Å; Y287-K289 VanDerWaalsContact C-N 3.28Å; Y287-K289 PolarHBondContact O-N 3.06Å; Y287-R290 PolarHBondContact O-N 2.8Å; Y287-R290 VanDerWaalsContact O-N 3.09Å; Y287-H291 WeakPolarHBondContact O-CB 3.38Å; Y287-H291 PolarHBondContact O-N 3.01Å
288	M	98.5	Very high	98.1	Very high	107 Å²	107	108.4 Å²	108.4	53%	0.527	54%	0.537	S	S	.	.	H	α-helix	trans	-58.1	-42.3	176.8	-69.4	176.4	70.6	0	0	111.6	L284 V285 H291 R292	L284-M288 WeakPolarHBondContact O-CG 3.18Å; L284-M288 PolarHBondContact O-N 2.91Å; V285-M288 PolarHBondContact O-N 2.93Å; M288-H291 PolarHBondContact O-N 3.01Å; M288-R292 WeakPolarHBondContact O-CB 3.38Å; M288-R292 WeakPolarHBondContact O-CG 3.49Å; M288-R292 PolarHBondContact O-N 3.14Å
289	K	98.6	Very high	98	Very high	95 Å²	95	114 Å²	114	41%	0.413	55%	0.552	S	S	.	*	H	α-helix	trans	-60.4	-48.1	174.3	-175.8	-90.8	179.9	165.8	0	110.7	V285 Y286 Y287 H291 R292 W293	V285-K289 WeakPolarHBondContact O-CB 3.31Å; V285-K289 PolarHBondContact O-N 3.48Å; Y286-K289 WeakPolarHBondContact O-CB 3.29Å; Y286-K289 PolarHBondContact O-N 2.97Å; Y287-K289 VanDerWaalsContact C-N 3.28Å; Y287-K289 PolarHBondContact O-N 3.06Å; K289-H291 PolarHBondContact O-N 3.29Å; K289-R292 PolarHBondContact O-N 3.39Å; K289-W293 HydrophobicContact CD-CG 4.47Å; K289-W293 VanDerWaalsContact O-CB 3.32Å; K289-W293 WeakPolarHBondContact O-CB 3.22Å; K289-W293 PolarHBondContact O-N 3.47Å
290	R	98.2	Very high	98	Very high	142 Å²	142	120.7 Å²	120.7	54%	0.536	57%	0.568	S	S	.	*	H	α-helix	trans	-61.3	-45.1	178.4	-70	-64.3	-64.5	-112	-1.1	111.2	Y286 Y287 W293 T294	Y286-R290 HydrophobicContact CD1-CG 4.34Å; Y286-R290 HydrophobicContact CD2-CG 4.42Å; Y286-R290 HydrophobicContact CE1-CG 3.95Å; Y286-R290 HydrophobicContact CE2-CG 4.01Å; Y286-R290 VanDerWaalsContact O-CG 3.31Å; Y286-R290 WeakPolarHBondContact O-CG 3.14Å; Y286-R290 PolarHBondContact O-N 3.03Å; Y286-R290 PolarHBondContact OH-NH1 3.33Å; Y287-R290 PolarHBondContact O-N 2.8Å; Y287-R290 VanDerWaalsContact O-N 3.09Å; R290-W293 CarbonylContact O-C 3.56Å; R290-W293 PolarHBondContact O-N 3.07Å; R290-T294 PolarHBondContact O-N 3.44Å; R290-T294 PolarHBondContact O-OG1 3.44Å
291	H	97.9	Very high	97.9	Very high	114 Å²	114	120.9 Å²	120.9	53%	0.528	57%	0.569	S	S	.	*	H	α-helix	trans	-59.3	-49.3	178.2	179.8	78.6	0	0	0	112.3	Y287 M288 K289 W293 T294	Y287-H291 WeakPolarHBondContact O-CB 3.38Å; Y287-H291 PolarHBondContact O-N 3.01Å; M288-H291 PolarHBondContact O-N 3.01Å; K289-H291 PolarHBondContact O-N 3.29Å; H291-W293 VanDerWaalsContact C-N 3.32Å; H291-W293 PolarHBondContact O-N 3.08Å; H291-T294 WeakPolarHBondContact O-CB 3.47Å; H291-T294 PolarHBondContact O-N 3.46Å; H291-T294 PolarHBondContact O-OG1 3.16Å; H291-T294 VanDerWaalsContact O-OG1 3.06Å
292	R	97.8	Very high	97.7	Very high	199 Å²	199	119.6 Å²	119.6	75%	0.751	57%	0.574	S	S	*	*	H	α-helix	trans	-63.8	-37.2	177.3	-70.5	-66.4	-175.1	179.5	0.2	112.7	M288 K289 T294	M288-R292 WeakPolarHBondContact O-CB 3.38Å; M288-R292 WeakPolarHBondContact O-CG 3.49Å; M288-R292 PolarHBondContact O-N 3.14Å; K289-R292 PolarHBondContact O-N 3.39Å; R292-T294 VanDerWaalsContact C-N 3.3Å; R292-T294 PolarHBondContact O-N 3.15Å
293	W	98.2	Very high	97.5	Very high	117 Å²	117	123.7 Å²	123.7	44%	0.443	58%	0.583	S	S	.	*	H	α-helix	trans	-80.4	-7.7	179.6	-79.2	72	0	0	0	114	K289 R290 H291 V295 L296 K297	K289-W293 HydrophobicContact CD-CG 4.47Å; K289-W293 VanDerWaalsContact O-CB 3.32Å; K289-W293 WeakPolarHBondContact O-CB 3.22Å; K289-W293 PolarHBondContact O-N 3.47Å; R290-W293 CarbonylContact O-C 3.56Å; R290-W293 PolarHBondContact O-N 3.07Å; H291-W293 VanDerWaalsContact C-N 3.32Å; H291-W293 PolarHBondContact O-N 3.08Å; W293-V295 VanDerWaalsContact C-N 3.28Å; W293-V295 PolarHBondContact O-N 3.33Å; W293-L296 HydrophobicContact CE3-CB 4.49Å; W293-L296 HydrophobicContact CE3-CD1 4.23Å; W293-L296 HydrophobicContact CZ3-CD1 4.26Å; W293-L296 PolarHBondContact O-N 3.09Å; W293-K297 HydrophobicContact CB-CG 4.36Å; W293-K297 WeakPolarHBondContact O-CB 3.4Å; W293-K297 VanDerWaalsContact O-CG 3.31Å; W293-K297 WeakPolarHBondContact O-CG 3.44Å; W293-K297 PolarHBondContact O-N 3.38Å
294	T	98.1	Very high	97.3	Very high	75 Å²	75	131 Å²	131	46%	0.46	60%	0.601	S	S	.	*	H	α-helix	trans	-53.4	-46.1	-179.4	-58.9	0	0	0	0	111.3	R290 H291 R292 L296 K297 S298	R290-T294 PolarHBondContact O-N 3.44Å; R290-T294 PolarHBondContact O-OG1 3.44Å; H291-T294 WeakPolarHBondContact O-CB 3.47Å; H291-T294 PolarHBondContact O-N 3.46Å; H291-T294 PolarHBondContact O-OG1 3.16Å; H291-T294 VanDerWaalsContact O-OG1 3.06Å; R292-T294 VanDerWaalsContact C-N 3.3Å; R292-T294 PolarHBondContact O-N 3.15Å; T294-L296 PolarHBondContact O-N 3.46Å; T294-K297 PolarHBondContact O-N 2.9Å; T294-K297 VanDerWaalsContact O-N 3.16Å; T294-S298 WeakPolarHBondContact O-CB 3.49Å; T294-S298 PolarHBondContact O-N 3.47Å; T294-S298 PolarHBondContact O-OG 3.44Å
295	V	97.6	Very high	97	Very high	112 Å²	112	130.4 Å²	130.4	68%	0.679	60%	0.603	S	S	*	*	H	α-helix	trans	-58.7	-46.6	-178.4	-179.6	0	0	0	0	112.1	W293 R299	W293-V295 VanDerWaalsContact C-N 3.28Å; W293-V295 PolarHBondContact O-N 3.33Å; V295-R299 PolarHBondContact O-N 3.25Å
296	L	97.5	Very high	96.6	Very high	90 Å²	90	132 Å²	132	47%	0.471	62%	0.615	S	S	.	*	H	α-helix	trans	-72.1	-31.9	179.1	-70.9	176	0	0	0	112.5	W293 T294 R299	W293-L296 HydrophobicContact CE3-CB 4.49Å; W293-L296 HydrophobicContact CE3-CD1 4.23Å; W293-L296 HydrophobicContact CZ3-CD1 4.26Å; W293-L296 PolarHBondContact O-N 3.09Å; T294-L296 PolarHBondContact O-N 3.46Å; L296-R299 WeakPolarHBondContact O-CD 3.12Å; L296-R299 VanDerWaalsContact O-CG 3.29Å; L296-R299 WeakPolarHBondContact O-CG 2.85Å
297	K	97.1	Very high	95.5	Very high	160 Å²	160	139.4 Å²	139.4	70%	0.696	65%	0.65	S	S	*	*	H	α-helix	trans	-83	-26	-177.7	-68.4	-66.7	-176.1	-179.3	0	113.1	W293 T294	W293-K297 HydrophobicContact CB-CG 4.36Å; W293-K297 WeakPolarHBondContact O-CB 3.4Å; W293-K297 VanDerWaalsContact O-CG 3.31Å; W293-K297 WeakPolarHBondContact O-CG 3.44Å; W293-K297 PolarHBondContact O-N 3.38Å; T294-K297 PolarHBondContact O-N 2.9Å; T294-K297 VanDerWaalsContact O-N 3.16Å
298	S	97	Very high	95.4	Very high	81 Å²	81	138.7 Å²	138.7	57%	0.566	65%	0.653	S	S	*	*	H	α-helix	trans	-93.5	-4.3	177.5	70	0	0	0	0	113.9	T294	T294-S298 WeakPolarHBondContact O-CB 3.49Å; T294-S298 PolarHBondContact O-N 3.47Å; T294-S298 PolarHBondContact O-OG 3.44Å
299	R	96.9	Very high	95.2	Very high	158 Å²	158	140.4 Å²	140.4	60%	0.596	66%	0.659	S	S	*	*			trans	-62.9	137.3	-177.5	76.3	-171.2	177.2	166.1	4.1	111.5	V295 L296 I301	V295-R299 PolarHBondContact O-N 3.25Å; L296-R299 WeakPolarHBondContact O-CD 3.12Å; L296-R299 VanDerWaalsContact O-CG 3.29Å; L296-R299 WeakPolarHBondContact O-CG 2.85Å; R299-I301 HydrophobicContact CG-CD1 4.35Å; R299-I301 HydrophobicContact CG-CG1 4.19Å
300	K	96.4	Very high	95	Very high	207 Å²	207	142.9 Å²	142.9	90%	0.9	67%	0.673	S	S	*	*			trans	-105.5	125.8	169.3	-61.9	-176.4	-179	-178.9	0	108
301	I	95.9	Very high	94.9	Very high	128 Å²	128	142.9 Å²	142.9	66%	0.656	68%	0.681	S	S	*	*			trans	-112.6	129.7	-178.5	-55.6	176.9	0	0	0	108	R299	R299-I301 HydrophobicContact CG-CD1 4.35Å; R299-I301 HydrophobicContact CG-CG1 4.19Å
302	A	94.9	Very high	94.7	Very high	78 Å²	78	144.8 Å²	144.8	65%	0.645	69%	0.691	S	S	*	*			trans	-110.4	116.5	170.8	0	0	0	0	0	108.8
303	Y	95.7	Very high	94.5	Very high	200 Å²	200	141.1 Å²	141.1	78%	0.784	69%	0.686	S	S	*	*			trans	-84.6	119.3	173	-177.5	-115.2	0	0	0	109.3	P305	Y303-P305 HydrophobicContact CD1-CG 4.44Å; Y303-P305 HydrophobicContact CE1-CB 4Å; Y303-P305 HydrophobicContact CE1-CG 3.99Å
304	R	93.1	Very high	94.2	Very high	224 Å²	224	142.9 Å²	142.9	85%	0.845	70%	0.704	S	S	*	*			trans	-124.5	89.7	179.3	-68.6	-173.2	176.9	175.6	-0.4	109.2
305	P	92.6	Very high	93.9	Very high	80 Å²	80	148.1 Å²	148.1	52%	0.519	72%	0.723	S	S	.	*			trans	-66.6	142.8	177.8	27.5	-32.2	0	0	0	110.2	Y303	Y303-P305 HydrophobicContact CD1-CG 4.44Å; Y303-P305 HydrophobicContact CE1-CB 4Å; Y303-P305 HydrophobicContact CE1-CG 3.99Å
306	P	89.3	Confident	93.6	Very high	124 Å²	124	151.1 Å²	151.1	81%	0.805	73%	0.726	S	S	*	*			trans	-64.3	153.7	173.8	27.6	-32.6	0	0	0	110.9
307	K	76.9	Confident	93.2	Very high	283 Å²	283	156.6 Å²	156.6	100%	1.23	75%	0.749	S	S	*	*			trans	-75.5	0	175.1	-74.3	-173.9	177.6	-178.1	0	111.5

Retrieved 307 of 307 residues in 56.8 ms (Link to these results)

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