A0A096NP16_PAPAN Loading...

NAD kinase 2, mitochondrial

Mitochondrial NAD(+) kinase that phosphorylates NAD(+) to yield NADP(+). Can use both ATP or inorganic polyphosphate as the phosphoryl donor.

AlphaFold DB (A0A2K6AUQ6), UniProt , Accession A0A096NP16, Species PAPAN (Papio anubis, Olive baboon), Gene NADK2, Length 442 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	23.6	Very low	24.9	Very low	246 Å²	246	162 Å²	162	100%	1.212	89%	0.885	S	S	*	*				0	96.6	0	-85.3	-177.7	174.2	0	0	109
2	T	24	Very low	24.9	Very low	146 Å²	146	159.6 Å²	159.6	90%	0.896	89%	0.886	S	S	*	*			trans	-106.5	101.2	177.4	3.2	0	0	0	0	107.5
3	C	22.6	Very low	25.1	Very low	119 Å²	119	156.8 Å²	156.8	80%	0.804	88%	0.882	S	S	*	*			trans	-84.8	117.8	-176.4	-157.6	0	0	0	0	109.2	R5	C3-R5 PolarHBondContact O-N 2.72Å
4	Y	24.9	Very low	25.2	Very low	232 Å²	232	163.4 Å²	163.4	91%	0.91	89%	0.886	S	S	*	*			trans	-75.1	106.4	169.6	-102	-98	0	0	0	108.6
5	R	27.9	Very low	25.4	Very low	225 Å²	225	162.2 Å²	162.2	85%	0.849	89%	0.886	S	S	*	*			trans	-82.2	113.7	168.6	-85.7	-174.2	167.1	-171.7	-3.2	109.3	C3	C3-R5 PolarHBondContact O-N 2.72Å
6	G	23.2	Very low	25.5	Very low	77 Å²	77	158.4 Å²	158.4	79%	0.794	88%	0.882	S	S	*	*	P	Polyproline II helix	trans	-65.5	136	167.7	0	0	0	0	0	111.1
7	F	24.6	Very low	25.6	Very low	204 Å²	204	153.9 Å²	153.9	90%	0.895	88%	0.88	S	S	*	*	P	Polyproline II helix	trans	-93.2	124	172.3	-100.5	-92.4	0	0	0	110.2
8	L	24.3	Very low	25.5	Very low	169 Å²	169	149.3 Å²	149.3	89%	0.885	87%	0.872	S	S	*	*	P	Polyproline II helix	trans	-66.5	127.8	167.1	-81.2	143.9	0	0	0	109.7	G10	L8-G10 PolarHBondContact O-N 3.07Å
9	L	27.2	Very low	25.6	Very low	173 Å²	173	154.5 Å²	154.5	91%	0.906	88%	0.876	S	S	*	*			trans	-76.6	105.8	169.5	-82.4	159.5	0	0	0	109.4
10	G	24.1	Very low	25.7	Very low	74 Å²	74	151.9 Å²	151.9	76%	0.763	87%	0.874	S	S	*	*			trans	-82.8	113.6	163	0	0	0	0	0	110	L8	L8-G10 PolarHBondContact O-N 3.07Å
11	S	27	Very low	25.8	Very low	117 Å²	117	149.6 Å²	149.6	82%	0.818	87%	0.873	S	S	*	*			trans	-62.8	129.8	170.8	-61.3	0	0	0	0	110.8
12	C	25.7	Very low	25.9	Very low	133 Å²	133	142.6 Å²	142.6	90%	0.899	86%	0.855	S	S	*	*			trans	-137.4	130.9	160.7	-107.8	0	0	0	0	110.7
13	C	26.7	Very low	26.2	Very low	123 Å²	123	144.3 Å²	144.3	83%	0.831	86%	0.857	S	S	*	*			trans	-68.2	149.1	-162.7	-64.9	0	0	0	0	114.8
14	R	27.3	Very low	26.4	Very low	249 Å²	249	150.4 Å²	150.4	94%	0.94	86%	0.863	S	S	*	*			trans	-62.5	136.3	159.6	-73.7	178.8	174.2	178.1	-2.3	109.9
15	V	27.6	Very low	26.4	Very low	146 Å²	146	142.7 Å²	142.7	89%	0.885	85%	0.854	S	S	*	*			trans	-115.9	128.2	156.2	179.3	0	0	0	0	107.8
16	A	27.7	Very low	26.8	Very low	101 Å²	101	138.7 Å²	138.7	84%	0.835	86%	0.858	S	S	*	*			trans	-92.4	158.6	-179	0	0	0	0	0	111.8
17	G	26.3	Very low	27	Very low	82 Å²	82	138.8 Å²	138.8	85%	0.845	86%	0.858	S	S	*	*			trans	141.2	127.9	165.9	0	0	0	0	0	109.4
18	G	24.6	Very low	27.2	Very low	71 Å²	71	134.5 Å²	134.5	73%	0.732	86%	0.86	S	S	*	*			cis	160.7	156.6	5.8	0	0	0	0	0	107.3
19	R	27	Very low	27.4	Very low	249 Å²	249	130.2 Å²	130.2	94%	0.94	86%	0.858	S	S	*	*			trans	91.4	97.5	165.4	-63.1	-172.6	169.8	-166.6	-2.9	119.9
20	A	26.8	Very low	27.3	Very low	101 Å²	101	125.5 Å²	125.5	84%	0.835	85%	0.851	S	S	*	*			trans	-4.6	144.2	132.3	0	0	0	0	0	120.3
21	A	27.9	Very low	28.2	Very low	105 Å²	105	128.2 Å²	128.2	87%	0.868	86%	0.855	S	S	*	*				-163.4	127.3	117.2	0	0	0	0	0	111
22	A	26.8	Very low	28.4	Very low	99 Å²	99	127.5 Å²	127.5	82%	0.818	86%	0.856	S	S	*	*			trans	-88.9	141.9	170	0	0	0	0	0	109.9
23	L	29.3	Very low	28.5	Very low	181 Å²	181	126 Å²	126	95%	0.948	85%	0.853	S	S	*	*			trans	-136.7	136.6	160.4	-86.1	167.5	0	0	0	110.3
24	R	27.1	Very low	28.8	Very low	247 Å²	247	131.8 Å²	131.8	93%	0.932	86%	0.858	S	S	*	*			trans	-72.8	158.3	-170.2	-70.4	172.4	164.3	-163.1	-4.9	113.2
25	G	25.6	Very low	29.1	Very low	70 Å²	70	125.9 Å²	125.9	72%	0.722	85%	0.851	S	S	*	*			trans	-67.2	-162.4	168.6	0	0	0	0	0	114.3
26	P	37	Very low	29.1	Very low	142 Å²	142	130.5 Å²	130.5	92%	0.922	85%	0.853	S	S	*	*				-147	-177.9	52.1	38.3	-17.6	0	0	0	115.4
27	G	27.6	Very low	29.3	Very low	78 Å²	78	134 Å²	134	80%	0.804	86%	0.857	S	S	*	*			trans	150.6	105.5	153.7	0	0	0	0	0	116.6
28	A	28.8	Very low	29.4	Very low	114 Å²	114	133.9 Å²	133.9	94%	0.942	86%	0.855	S	S	*	*			trans	-67.7	157.4	179.8	0	0	0	0	0	115.3
29	G	26.9	Very low	29.5	Very low	80 Å²	80	134 Å²	134	83%	0.825	86%	0.857	S	S	*	*			trans	166.1	89.9	161.8	0	0	0	0	0	114.2
30	G	26.7	Very low	29.6	Very low	74 Å²	74	130.8 Å²	130.8	76%	0.763	86%	0.858	S	S	*	*			trans	-111	-171.3	149.8	0	0	0	0	0	108.8
31	P	43	Very low	29.6	Very low	130 Å²	130	129.2 Å²	129.2	84%	0.844	85%	0.852	S	S	*	*			cis	-127.2	170.1	-17	38.3	-23.1	0	0	0	111.8
32	A	29.3	Very low	29.4	Very low	103 Å²	103	128.5 Å²	128.5	85%	0.851	85%	0.854	S	S	*	*			trans	-163.8	127.8	152.4	0	0	0	0	0	112.6
33	A	28.9	Very low	29.4	Very low	101 Å²	101	127.3 Å²	127.3	84%	0.835	85%	0.852	S	S	*	*			trans	-67.7	154.9	175.8	0	0	0	0	0	112.9
34	R	33.2	Very low	29.5	Very low	245 Å²	245	130.9 Å²	130.9	93%	0.925	85%	0.853	S	S	*	*			trans	-120.1	147.3	157.2	-82.2	-172.6	175.2	-173	-0.5	109.9
35	P	32.8	Very low	29.6	Very low	125 Å²	125	130.4 Å²	130.4	81%	0.812	85%	0.851	S	S	*	*			trans	-93.7	158.9	-158.6	22.8	-7.9	0	0	0	113.8
36	R	28.1	Very low	29.8	Very low	243 Å²	243	136.5 Å²	136.5	92%	0.917	86%	0.861	S	S	*	*			trans	-79.4	141.8	166.9	-65	178.7	174.2	-171.5	-2.6	110.9
37	L	32.7	Very low	29.5	Very low	174 Å²	174	137.9 Å²	137.9	91%	0.911	86%	0.859	S	S	*	*			trans	-140.4	119.7	152.3	-71.6	167.1	0	0	0	103.1
38	G	27.4	Very low	29.5	Very low	79 Å²	79	137.7 Å²	137.7	81%	0.814	86%	0.857	S	S	*	*				66.7	108.6	51.4	0	0	0	0	0	108.2
39	G	27	Very low	29.7	Very low	74 Å²	74	142.1 Å²	142.1	76%	0.763	86%	0.858	S	S	*	*			cis	126.8	109.6	22.6	0	0	0	0	0	107.2
40	D	28.7	Very low	29.7	Very low	181 Å²	181	141.6 Å²	141.6	97%	0.968	85%	0.854	S	S	*	*			trans	156.1	144.3	160.1	-100.7	-11.3	0	0	0	107.8
41	G	26.7	Very low	29.8	Very low	68 Å²	68	146.8 Å²	146.8	70%	0.701	86%	0.858	S	S	*	*			cis	159.5	140.5	8.9	0	0	0	0	0	107.2
42	G	24.8	Very low	29.1	Very low	90 Å²	90	146.5 Å²	146.5	93%	0.928	86%	0.856	S	S	*	*			trans	63	115.9	151.1	0	0	0	0	0	120.3
43	G	26.7	Very low	29	Very low	75 Å²	75	153 Å²	153	77%	0.773	86%	0.858	S	S	*	*			trans	175.7	59.4	162.9	0	0	0	0	0	116.8	R45	G43-R45 PolarHBondContact O-N 3.03Å
44	R	30.7	Very low	28.9	Very low	255 Å²	255	157.2 Å²	157.2	96%	0.962	86%	0.861	S	S	*	*			trans	-58.7	119.2	161.9	-84.1	179.3	171.9	175.4	-2.9	109.2
45	R	29.8	Very low	28.9	Very low	238 Å²	238	153.8 Å²	153.8	90%	0.898	86%	0.86	S	S	*	*			trans	-133.6	114.4	154.9	-76.6	-169.6	179.4	-174.1	0.7	109.8	G43	G43-R45 PolarHBondContact O-N 3.03Å
46	H	29.4	Very low	28.8	Very low	198 Å²	198	152.4 Å²	152.4	92%	0.917	86%	0.859	S	S	*	*			trans	-59.2	129.7	162	-82.8	-25.2	0	0	0	110.1
47	L	30.6	Very low	28.9	Very low	171 Å²	171	144 Å²	144	90%	0.895	85%	0.849	S	S	*	*			trans	-134.9	111.3	158.8	-84.6	167.7	0	0	0	108.7
48	G	27.3	Very low	29.3	Very low	74 Å²	74	141.7 Å²	141.7	76%	0.763	85%	0.845	S	S	*	*			trans	58.3	110.5	137.3	0	0	0	0	0	118.5	G50	G48-G50 PolarHBondContact O-N 3.15Å
49	Q	33.5	Very low	29.5	Very low	206 Å²	206	141.2 Å²	141.2	96%	0.963	84%	0.84	S	S	*	*			trans	-47.7	106.5	155.4	-71	175.1	-22.2	0	0	110.5
50	G	26.6	Very low	30.1	Very low	70 Å²	70	143.3 Å²	143.3	72%	0.722	84%	0.844	S	S	*	*			trans	-96.7	110.1	161.7	0	0	0	0	0	108.1	G48	G48-G50 PolarHBondContact O-N 3.15Å
51	Q	28.2	Very low	30.7	Very low	183 Å²	183	144.8 Å²	144.8	86%	0.855	84%	0.835	S	S	*	*			trans	-51.3	138.2	168	-73.4	173.4	-29.5	0	0	109.5	R53	Q51-R53 PolarHBondContact O-N 2.94Å
52	P	28.1	Very low	31.2	Very low	123 Å²	123	148.1 Å²	148.1	80%	0.799	85%	0.845	S	S	*	*			trans	-62.5	116.2	167.7	-1.2	13.8	0	0	0	107	E54	P52-E54 PolarHBondContact O-N 2.85Å
53	R	27.8	Very low	32.2	Very low	240 Å²	240	150.7 Å²	150.7	91%	0.906	84%	0.837	S	S	*	*			trans	-56.1	115	165.6	-80.1	-178.3	169.2	-178.8	-3.5	106.9	Q51 L55	Q51-R53 PolarHBondContact O-N 2.94Å; R53-L55 PolarHBondContact O-N 2.99Å
54	E	26.8	Very low	34.3	Very low	189 Å²	189	150.1 Å²	150.1	88%	0.883	83%	0.831	S	S	*	*			trans	-48.9	110.1	162.6	-76	177.5	141.2	0	0	107.6	P52 A56	P52-E54 PolarHBondContact O-N 2.85Å; E54-A56 PolarHBondContact O-N 2.97Å
55	L	32.6	Very low	37.1	Very low	173 Å²	173	139.5 Å²	139.5	91%	0.906	80%	0.801	S	S	*	*			trans	-60.7	109.8	162.8	-90.2	149.9	0	0	0	105.8	R53 G57	R53-L55 PolarHBondContact O-N 2.99Å; L55-G57 PolarHBondContact O-N 3.23Å; L55-G57 VanDerWaalsContact O-N 3.15Å
56	A	31.9	Very low	40.1	Very low	96 Å²	96	129.4 Å²	129.4	79%	0.793	76%	0.764	S	S	*	*			trans	-41.2	119.9	178.1	0	0	0	0	0	110	E54	E54-A56 PolarHBondContact O-N 2.97Å
57	G	30.3	Very low	43.3	Very low	68 Å²	68	128.7 Å²	128.7	70%	0.701	75%	0.753	S	S	*	*			trans	-52.6	140.4	179.9	0	0	0	0	0	111.3	L55 G59	L55-G57 PolarHBondContact O-N 3.23Å; L55-G57 VanDerWaalsContact O-N 3.15Å; G57-G59 VanDerWaalsContact C-N 3.34Å; G57-G59 PolarHBondContact O-N 3.35Å
58	C	39.8	Very low	46.5	Very low	124 Å²	124	121.2 Å²	121.2	84%	0.838	72%	0.715	S	S	*	*			trans	-52.4	103.4	161.2	-78.5	0	0	0	0	108	S60	C58-S60 PolarHBondContact O-N 3.04Å
59	G	33.3	Very low	49.8	Very low	69 Å²	69	121.7 Å²	121.7	71%	0.711	71%	0.706	S	S	*	*			trans	-62.9	101.9	177.5	0	0	0	0	0	109.7	G57 R61	G57-G59 VanDerWaalsContact C-N 3.34Å; G57-G59 PolarHBondContact O-N 3.35Å; G59-R61 VanDerWaalsContact C-N 3.25Å; G59-R61 PolarHBondContact O-N 3.33Å
60	S	38.7	Very low	52.9	Low	119 Å²	119	116 Å²	116	83%	0.832	68%	0.676	S	S	*	*			trans	-62	97.7	150.5	52	0	0	0	0	106.3	C58	C58-S60 PolarHBondContact O-N 3.04Å
61	R	40.4	Very low	56.4	Low	211 Å²	211	112.8 Å²	112.8	80%	0.796	64%	0.642	S	S	*	*			trans	-62.5	154.9	168.6	-73.9	-174.8	176.5	-175.3	-0.1	108.6	G59 D63	G59-R61 VanDerWaalsContact C-N 3.25Å; G59-R61 PolarHBondContact O-N 3.33Å; R61-D63 CarbonylContact O-C 3.58Å; R61-D63 PolarHBondContact O-N 3.04Å; R61-D63 VanDerWaalsContact O-N 3.07Å
62	P	38.7	Very low	59.7	Low	139 Å²	139	104 Å²	104	90%	0.903	60%	0.602	S	S	*	*	S	Bend	trans	-63.9	-13.4	-176.2	-18.2	31.4	0	0	0	114.3
63	D	45.9	Very low	63.1	Low	144 Å²	144	98.2 Å²	98.2	77%	0.77	56%	0.564	S	S	*	*	S	Bend	trans	-92.2	113.2	166.2	-70.8	-27.3	0	0	0	108.5	R61 G65	R61-D63 CarbonylContact O-C 3.58Å; R61-D63 PolarHBondContact O-N 3.04Å; R61-D63 VanDerWaalsContact O-N 3.07Å; D63-G65 PolarHBondContact O-N 2.79Å
64	G	69.9	Low	66.4	Low	62 Å²	62	86.8 Å²	86.8	64%	0.639	52%	0.52	S	S	*	.			trans	-62.6	24.9	-170.4	0	0	0	0	0	118.3	G212	G64-G212 WeakPolarHBondContact O-CA 3.43Å
65	G	88.6	Confident	69.8	Low	33 Å²	33	78.1 Å²	78.1	34%	0.34	48%	0.481	S	S	.	.			trans	-78.8	160.6	174.6	0	0	0	0	0	114.2	D63 F209	D63-G65 PolarHBondContact O-N 2.79Å; G65-F209 CarbonylContact C-O 3.45Å; G65-F209 VanDerWaalsContact CA-O 3.23Å; G65-F209 WeakPolarHBondContact CA-O 3.46Å
66	F	94.8	Very high	72.8	Confident	26 Å²	26	72.7 Å²	72.7	11%	0.114	45%	0.45	C	S	.	.			trans	-122.3	117	179.1	173.2	-113.1	0	0	0	110.6	P68 A154 P177 I179 F209 Y210 F214 W216	F66-P68 HydrophobicContact CE1-CB 4.31Å; F66-P68 HydrophobicContact CE1-CG 3.89Å; F66-P68 HydrophobicContact CZ-CB 3.91Å; F66-P68 HydrophobicContact CZ-CG 4.01Å; F66-A154 HydrophobicContact CE1-CB 4.12Å; F66-A154 HydrophobicContact CZ-CB 3.69Å; F66-P177 HydrophobicContact CE1-CG 4.49Å; F66-P177 HydrophobicContact CE2-CG 3.82Å; F66-P177 HydrophobicContact CZ-CB 4.28Å; F66-P177 HydrophobicContact CZ-CG 3.72Å; F66-I179 HydrophobicContact CE1-CD1 4.23Å; F66-F209 HydrophobicContact CD1-CB 4.48Å; F66-F209 PolarHBondContact N-O 3.48Å; F66-Y210 VanDerWaalsContact O-CD1 3.3Å; F66-Y210 WeakPolarHBondContact O-CD1 3.31Å; F66-F214 HydrophobicContact CB-CE1 4.05Å; F66-F214 HydrophobicContact CB-CZ 3.66Å; F66-W216 HydrophobicContact CB-CH2 4.22Å; F66-W216 HydrophobicContact CB-CZ2 3.99Å; F66-W216 HydrophobicContact CD1-CH2 4.11Å; F66-W216 AromaticContact CD2-CH2 3.94Å; F66-W216 HydrophobicContact CD2-CH2 3.94Å; F66-W216 HydrophobicContact CD2-CZ2 4.02Å; F66-W216 HydrophobicContact CE1-CH2 4.49Å; F66-W216 HydrophobicContact CE2-CH2 4.35Å; F66-W216 AromaticContact CG-CH2 3.82Å; F66-W216 HydrophobicContact CG-CH2 3.82Å; F66-W216 AromaticContact CG-CZ2 3.99Å; F66-W216 HydrophobicContact CG-CZ2 3.99Å
67	R	95.8	Very high	75.7	Confident	182 Å²	182	70.5 Å²	70.5	69%	0.687	43%	0.427	S	S	*	.			trans	-130	91.8	-177.8	-66.7	-177.6	-176.1	-148.8	2	110.4	Y210	R67-Y210 HydrophobicContact CB-CD1 4.36Å; R67-Y210 HydrophobicContact CB-CE1 4.43Å; R67-Y210 HydrophobicContact CG-CD1 3.48Å; R67-Y210 VanDerWaalsContact CG-CD1 3.48Å; R67-Y210 HydrophobicContact CG-CE1 3.96Å; R67-Y210 HydrophobicContact CG-CG 4.02Å
68	P	96.8	Very high	78.6	Confident	15 Å²	15	67.6 Å²	67.6	10%	0.097	40%	0.396	C	S	.	.			trans	-74.2	146.1	177.7	30.9	-33	0	0	0	110.8	F66 V71 I134 D153 A154	F66-P68 HydrophobicContact CE1-CB 4.31Å; F66-P68 HydrophobicContact CE1-CG 3.89Å; F66-P68 HydrophobicContact CZ-CB 3.91Å; F66-P68 HydrophobicContact CZ-CG 4.01Å; P68-V71 HydrophobicContact CB-CG2 3.78Å; P68-V71 HydrophobicContact CG-CG2 3.67Å; P68-I134 HydrophobicContact CG-CD1 4.27Å; P68-D153 HydrophobicContact CB-CB 3.96Å; P68-A154 HydrophobicContact CB-CB 4.24Å
69	S	97.9	Very high	81	Confident	83 Å²	83	67.8 Å²	67.8	58%	0.58	38%	0.379	S	S	*	.	S	Bend	trans	-94.7	-29.9	172.2	-60.7	0	0	0	0	111.8	E135 D153	S69-E135 PolarHBondContact O-N 3.34Å; S69-D153 WeakPolarHBondContact CA-OD2 3.36Å; S69-D153 PolarHBondContact N-OD2 3.47Å
70	R	98.6	Very high	83.7	Confident	88 Å²	88	65.4 Å²	65.4	33%	0.332	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	130.3	178.7	-66.7	176.7	-63	171.1	7.2	110.8	E135 W151 D153 A154	R70-E135 CarbonylContact C-O 3.56Å; R70-E135 WeakPolarHBondContact CA-O 3.39Å; R70-E135 HydrophobicContact CG-CB 4.11Å; R70-W151 HydrophobicContact CB-CD2 4.45Å; R70-W151 HydrophobicContact CB-CE3 4.36Å; R70-W151 HydrophobicContact CB-CH2 3.75Å; R70-W151 HydrophobicContact CB-CZ2 3.85Å; R70-W151 HydrophobicContact CB-CZ3 4.02Å; R70-W151 HydrophobicContact CG-CH2 4.15Å; R70-W151 HydrophobicContact CG-CZ2 3.78Å; R70-W151 PolarHBondContact NE-O 3.24Å; R70-W151 PolarHBondContact NH1-O 3.08Å; R70-W151 PolarHBondContact NH2-O 3.04Å; R70-D153 PolarHBondContact N-OD2 3.44Å; R70-D153 IonicContact NH2-OD1 2.67Å; R70-D153 PolarHBondContact O-N 3.3Å; R70-A154 PolarHBondContact O-N 2.78Å
71	V	98.7	Very high	86.1	Confident	1 Å²	1	61 Å²	61	1%	0.006	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	130.5	-180	174.6	0	0	0	0	110.6	P68 V73 L129 I134 E135 V136 R137 A154 I156	P68-V71 HydrophobicContact CB-CG2 3.78Å; P68-V71 HydrophobicContact CG-CG2 3.67Å; V71-V73 HydrophobicContact CG1-CG2 4.3Å; V71-L129 HydrophobicContact CB-CD1 4.5Å; V71-L129 HydrophobicContact CG1-CD1 4.1Å; V71-L129 HydrophobicContact CG2-CD2 4.47Å; V71-I134 HydrophobicContact CB-CG2 4.04Å; V71-I134 HydrophobicContact CG2-CG2 3.68Å; V71-E135 PolarHBondContact N-O 2.81Å; V71-V136 WeakPolarHBondContact O-CA 3.37Å; V71-R137 PolarHBondContact O-N 2.87Å; V71-A154 WeakPolarHBondContact CA-O 3.23Å; V71-A154 HydrophobicContact CG2-CB 4.18Å; V71-I156 HydrophobicContact CG1-CB 4.34Å; V71-I156 HydrophobicContact CG1-CD1 3.63Å; V71-I156 HydrophobicContact CG1-CG1 3.75Å
72	V	98.8	Very high	88.3	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	128.2	164.8	164.1	0	0	0	0	108.6	V74 R137 V139 Y144 T148 W151 A152 A154 I156	V72-V74 HydrophobicContact CG1-CG2 3.86Å; V72-R137 CarbonylContact C-O 3.5Å; V72-R137 WeakPolarHBondContact CA-O 3.39Å; V72-R137 HydrophobicContact CG2-CB 4.04Å; V72-V139 HydrophobicContact CG1-CG2 3.55Å; V72-Y144 HydrophobicContact CG1-CD2 4.37Å; V72-Y144 HydrophobicContact CG1-CE2 4.3Å; V72-T148 WeakPolarHBondContact CG2-O 3.02Å; V72-W151 HydrophobicContact CG2-CE3 3.67Å; V72-W151 HydrophobicContact CG2-CZ3 3.72Å; V72-A152 HydrophobicContact CB-CB 4.06Å; V72-A152 HydrophobicContact CG2-CB 3.83Å; V72-A154 PolarHBondContact N-O 2.82Å; V72-I156 PolarHBondContact O-N 2.87Å
73	V	98.8	Very high	90.5	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	111.3	169.6	-179.8	0	0	0	0	107.9	V71 I125 I126 L129 V136 R137 L138 V139 I156 A158	V71-V73 HydrophobicContact CG1-CG2 4.3Å; V73-I125 HydrophobicContact CG2-CG2 4.42Å; V73-I126 HydrophobicContact CG2-CG1 4.34Å; V73-L129 HydrophobicContact CG2-CD1 3.92Å; V73-V136 HydrophobicContact CG2-CG1 3.74Å; V73-R137 PolarHBondContact N-O 3.5Å; V73-L138 HydrophobicContact CB-CD1 4.28Å; V73-L138 HydrophobicContact CG1-CD1 4.09Å; V73-L138 WeakPolarHBondContact O-CA 3.28Å; V73-V139 PolarHBondContact O-N 2.66Å; V73-I156 CarbonylContact C-O 3.59Å; V73-I156 WeakPolarHBondContact CA-O 3.3Å; V73-I156 HydrophobicContact CG2-CB 4.31Å; V73-A158 HydrophobicContact CG1-CB 3.74Å
74	V	98.6	Very high	92.2	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	103.9	174.3	-172.4	0	0	0	0	108.1	V72 V139 Y144 V155 I156 A158 T163 L166 A167	V72-V74 HydrophobicContact CG1-CG2 3.86Å; V74-V139 WeakPolarHBondContact CA-O 3.23Å; V74-V139 HydrophobicContact CG2-CG2 4.06Å; V74-Y144 HydrophobicContact CG1-CD1 4.48Å; V74-Y144 HydrophobicContact CG1-CG 4.3Å; V74-Y144 HydrophobicContact CG2-CD1 4.46Å; V74-Y144 HydrophobicContact CG2-CD2 3.56Å; V74-Y144 HydrophobicContact CG2-CE1 4.42Å; V74-Y144 HydrophobicContact CG2-CE2 3.52Å; V74-Y144 HydrophobicContact CG2-CG 4.05Å; V74-V155 HydrophobicContact CG2-CG1 3.75Å; V74-I156 PolarHBondContact N-O 3.48Å; V74-A158 PolarHBondContact O-N 3.31Å; V74-T163 HydrophobicContact CG1-CG2 4.42Å; V74-T163 VanDerWaalsContact O-CG2 3.31Å; V74-T163 WeakPolarHBondContact O-CG2 3.07Å; V74-L166 HydrophobicContact CG1-CD2 4.04Å; V74-L166 HydrophobicContact CG1-CG 4.43Å; V74-A167 HydrophobicContact CG2-CB 4.41Å
75	A	97.8	Very high	92.7	Very high	7 Å²	7	43.2 Å²	43.2	6%	0.058	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	142.6	179.7	0	0	0	0	0	111.7	V122 L138 V139	A75-V122 HydrophobicContact CB-CG1 4.34Å; A75-V122 HydrophobicContact CB-CG2 4.24Å; A75-L138 HydrophobicContact CB-CD1 3.65Å; A75-V139 PolarHBondContact N-O 3.25Å
76	K	94.6	Very high	92	Very high	60 Å²	60	48 Å²	48	26%	0.261	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-60.6	141.2	170.6	83.8	-176.6	-71.1	-175.4	0	110	T78 H118 A158 T163	K76-T78 HydrophobicContact CD-CG2 4.5Å; K76-T78 HydrophobicContact CG-CG2 4.22Å; K76-T78 PolarHBondContact O-N 3.47Å; K76-H118 WeakPolarHBondContact CD-CE1 3.49Å; K76-H118 WeakPolarHBondContact CD-ND1 3.27Å; K76-H118 WeakPolarHBondContact CD-NE2 3.48Å; K76-H118 PolarHBondContact NZ-CE1 2.89Å; K76-H118 PolarHBondContact NZ-NE2 3.37Å; K76-A158 PolarHBondContact N-O 3.43Å; K76-T163 VanDerWaalsContact CB-OG1 3.31Å; K76-T163 WeakPolarHBondContact CB-OG1 3.15Å
77	T	92.5	Very high	91	Very high	50 Å²	50	48.1 Å²	48.1	31%	0.307	21%	0.214	S	C	.	.	P	Polyproline II helix	trans	-75.2	119.3	158	-53.8	0	0	0	0	107.6	E81 F82	T77-E81 HydrophobicContact CG2-CB 4.05Å; T77-F82 HydrophobicContact CG2-CB 4.32Å
78	T	92.5	Very high	89.6	Confident	7 Å²	7	48.6 Å²	48.6	4%	0.043	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-73.3	157.9	-179.8	74.1	0	0	0	0	110.2	K76 Y80 E81 F82 H115 H118	K76-T78 HydrophobicContact CD-CG2 4.5Å; K76-T78 HydrophobicContact CG-CG2 4.22Å; K76-T78 PolarHBondContact O-N 3.47Å; T78-Y80 PolarHBondContact O-N 2.79Å; T78-E81 PolarHBondContact N-OE2 3.01Å; T78-E81 PolarHBondContact O-N 2.87Å; T78-E81 WeakPolarHBondContact OG1-CG 3.45Å; T78-E81 PolarHBondContact OG1-N 2.87Å; T78-E81 VanDerWaalsContact OG1-N 3.12Å; T78-F82 WeakPolarHBondContact O-CB 3.38Å; T78-F82 PolarHBondContact O-N 3Å; T78-H115 HydrophobicContact CG2-CB 4.44Å; T78-H115 PolarHBondContact OG1-ND1 3.23Å; T78-H118 HydrophobicContact CG2-CB 3.98Å
79	R	89.1	Confident	87.8	Confident	127 Å²	127	56.6 Å²	56.6	48%	0.479	25%	0.246	S	C	.	.	H	α-helix	trans	-59.8	-35.4	174.6	-179.5	170.5	175.7	-158.1	-5.3	111.5	F82 E83 S106 L111	R79-F82 PolarHBondContact O-N 3.14Å; R79-E83 HydrophobicContact CG-CG 4.27Å; R79-E83 IonicContact NE-OE1 3.58Å; R79-E83 IonicContact NH2-OE1 3.14Å; R79-E83 WeakPolarHBondContact O-CG 3.46Å; R79-E83 PolarHBondContact O-N 3.44Å; R79-S106 PolarHBondContact NH2-OG 3.05Å; R79-L111 HydrophobicContact CB-CD2 4Å; R79-L111 HydrophobicContact CG-CD2 3.87Å
80	Y	90.1	Very high	86.3	Confident	20 Å²	20	55.3 Å²	55.3	8%	0.078	24%	0.24	C	C	.	.	H	α-helix	trans	-58.3	-53.2	173.4	176.9	-100	0	0	0	111.7	T78 F82 E83 Q84 Y108 L111 L112 H115	T78-Y80 PolarHBondContact O-N 2.79Å; Y80-F82 VanDerWaalsContact C-N 3.3Å; Y80-F82 PolarHBondContact O-N 2.93Å; Y80-E83 PolarHBondContact O-N 3.11Å; Y80-Q84 HydrophobicContact CD1-CG 4.39Å; Y80-Q84 HydrophobicContact CE1-CG 4.05Å; Y80-Q84 VanDerWaalsContact CE1-NE2 3.26Å; Y80-Q84 VanDerWaalsContact CE1-OE1 3.29Å; Y80-Q84 HydrophobicContact CE2-CG 4.45Å; Y80-Q84 VanDerWaalsContact CZ-CD 3.47Å; Y80-Q84 WeakPolarHBondContact O-CB 3.41Å; Y80-Q84 WeakPolarHBondContact O-CG 3.28Å; Y80-Q84 PolarHBondContact O-N 2.9Å; Y80-Q84 PolarHBondContact OH-NE2 3.06Å; Y80-Y108 HydrophobicContact CD2-CE2 4.31Å; Y80-Y108 HydrophobicContact CE2-CD2 4.28Å; Y80-Y108 AromaticContact CE2-CE2 3.5Å; Y80-Y108 HydrophobicContact CE2-CE2 3.5Å; Y80-Y108 VanDerWaalsContact CE2-CE2 3.5Å; Y80-Y108 AromaticContact CE2-CZ 3.71Å; Y80-Y108 PolarHBondContact OH-OH 2.97Å; Y80-L111 HydrophobicContact CD2-CB 4.3Å; Y80-L112 HydrophobicContact CD2-CB 4.24Å; Y80-L112 HydrophobicContact CD2-CD1 4.42Å; Y80-L112 HydrophobicContact CE1-CD1 3.94Å; Y80-L112 HydrophobicContact CE2-CB 4.05Å; Y80-L112 HydrophobicContact CE2-CD1 3.82Å; Y80-L112 HydrophobicContact CE2-CG 4.47Å; Y80-H115 HydrophobicContact CD1-CB 3.98Å; Y80-H115 AromaticContact CD1-CD2 3.48Å; Y80-H115 VanDerWaalsContact CD1-CD2 3.48Å; Y80-H115 WeakPolarHBondContact CD1-CD2 3.45Å; Y80-H115 AromaticContact CD1-CG 3.7Å; Y80-H115 AromaticContact CE1-CD2 3.77Å; Y80-H115 HydrophobicContact CG-CB 4.07Å
81	E	89.4	Confident	85	Confident	27 Å²	27	60.1 Å²	60.1	13%	0.126	27%	0.266	C	S	.	.	H	α-helix	trans	-61.4	-39.6	178.4	-70.6	176.4	154.9	0	0	112.2	T77 T78 Q84 Q85 H115 K140	T77-E81 HydrophobicContact CG2-CB 4.05Å; T78-E81 PolarHBondContact N-OE2 3.01Å; T78-E81 PolarHBondContact O-N 2.87Å; T78-E81 WeakPolarHBondContact OG1-CG 3.45Å; T78-E81 PolarHBondContact OG1-N 2.87Å; T78-E81 VanDerWaalsContact OG1-N 3.12Å; E81-Q84 PolarHBondContact O-N 3.4Å; E81-Q85 WeakPolarHBondContact O-CB 3.3Å; E81-Q85 VanDerWaalsContact O-CG 3.26Å; E81-Q85 WeakPolarHBondContact O-CG 3.5Å; E81-Q85 PolarHBondContact O-N 3.48Å; E81-H115 IonicContact OE1-CE1 3.99Å; E81-H115 PolarHBondContact OE1-CE1 2.92Å; E81-H115 IonicContact OE1-ND1 2.71Å; E81-K140 IonicContact OE1-NZ 2.9Å; E81-K140 PolarHBondContact OE1-NZ 3.14Å; E81-K140 IonicContact OE2-NZ 2.83Å; E81-K140 PolarHBondContact OE2-NZ 3.19Å
82	F	86.9	Confident	83.5	Confident	55 Å²	55	63.7 Å²	63.7	24%	0.241	29%	0.285	C	S	.	.	H	α-helix	trans	-62.3	-48.6	177.8	177.6	-96.3	0	0	0	111.9	T77 T78 R79 Y80 Q85 R86 Q242	T77-F82 HydrophobicContact CG2-CB 4.32Å; T78-F82 WeakPolarHBondContact O-CB 3.38Å; T78-F82 PolarHBondContact O-N 3Å; R79-F82 PolarHBondContact O-N 3.14Å; Y80-F82 VanDerWaalsContact C-N 3.3Å; Y80-F82 PolarHBondContact O-N 2.93Å; F82-Q85 PolarHBondContact O-N 3.12Å; F82-R86 PolarHBondContact O-N 3.26Å; F82-R86 VanDerWaalsContact O-N 3.08Å; F82-Q242 VanDerWaalsContact CZ-CD 3.46Å; F82-Q242 HydrophobicContact CZ-CG 4.26Å; F82-Q242 VanDerWaalsContact CZ-OE1 3.24Å
83	E	84.7	Confident	82.7	Confident	16 Å²	16	66.6 Å²	66.6	8%	0.075	31%	0.305	C	S	.	.	H	α-helix	trans	-61.5	-49.6	176.2	-61.3	-81.3	-174.2	0	0	108.6	R79 Y80 Q85 R86 Y87 L97 L101 K104	R79-E83 HydrophobicContact CG-CG 4.27Å; R79-E83 IonicContact NE-OE1 3.58Å; R79-E83 IonicContact NH2-OE1 3.14Å; R79-E83 WeakPolarHBondContact O-CG 3.46Å; R79-E83 PolarHBondContact O-N 3.44Å; Y80-E83 PolarHBondContact O-N 3.11Å; E83-Q85 VanDerWaalsContact C-N 3.32Å; E83-Q85 PolarHBondContact O-N 3.29Å; E83-R86 PolarHBondContact O-N 3.27Å; E83-R86 VanDerWaalsContact O-N 3.09Å; E83-Y87 HydrophobicContact CB-CD2 4.08Å; E83-Y87 HydrophobicContact CB-CE2 4.04Å; E83-Y87 WeakPolarHBondContact O-CD2 3.49Å; E83-Y87 PolarHBondContact O-N 2.89Å; E83-Y87 VanDerWaalsContact OE2-CE2 3.22Å; E83-Y87 WeakPolarHBondContact OE2-CE2 3.16Å; E83-L97 HydrophobicContact CB-CD1 4.4Å; E83-L101 HydrophobicContact CG-CD2 4.12Å; E83-K104 IonicContact OE2-NZ 2.96Å
84	Q	82.6	Confident	82	Confident	44 Å²	44	71.5 Å²	71.5	21%	0.206	33%	0.328	C	S	.	.	H	α-helix	trans	-52.5	-45.5	176.8	-78.7	-167.8	-34.1	0	0	113.6	Y80 E81 Y87 R88 L97	Y80-Q84 HydrophobicContact CD1-CG 4.39Å; Y80-Q84 HydrophobicContact CE1-CG 4.05Å; Y80-Q84 VanDerWaalsContact CE1-NE2 3.26Å; Y80-Q84 VanDerWaalsContact CE1-OE1 3.29Å; Y80-Q84 HydrophobicContact CE2-CG 4.45Å; Y80-Q84 VanDerWaalsContact CZ-CD 3.47Å; Y80-Q84 WeakPolarHBondContact O-CB 3.41Å; Y80-Q84 WeakPolarHBondContact O-CG 3.28Å; Y80-Q84 PolarHBondContact O-N 2.9Å; Y80-Q84 PolarHBondContact OH-NE2 3.06Å; E81-Q84 PolarHBondContact O-N 3.4Å; Q84-Y87 PolarHBondContact O-N 3.23Å; Q84-R88 WeakPolarHBondContact O-CB 3.44Å; Q84-R88 WeakPolarHBondContact O-CG 3.4Å; Q84-R88 PolarHBondContact O-N 2.98Å; Q84-L97 HydrophobicContact CG-CD2 4Å
85	Q	80.3	Confident	81.3	Confident	66 Å²	66	76.4 Å²	76.4	31%	0.308	35%	0.351	S	S	.	.	H	α-helix	trans	-60.7	-49.8	177.6	-75.4	172.8	8.3	0	0	110.9	E81 F82 E83 Y87 R88 Y89	E81-Q85 WeakPolarHBondContact O-CB 3.3Å; E81-Q85 VanDerWaalsContact O-CG 3.26Å; E81-Q85 WeakPolarHBondContact O-CG 3.5Å; E81-Q85 PolarHBondContact O-N 3.48Å; F82-Q85 PolarHBondContact O-N 3.12Å; E83-Q85 VanDerWaalsContact C-N 3.32Å; E83-Q85 PolarHBondContact O-N 3.29Å; Q85-Y87 PolarHBondContact O-N 2.97Å; Q85-R88 PolarHBondContact O-N 3.08Å; Q85-Y89 WeakPolarHBondContact O-CD2 3.48Å; Q85-Y89 PolarHBondContact O-N 3.48Å
86	R	74.1	Confident	80.7	Confident	135 Å²	135	78.9 Å²	78.9	51%	0.509	36%	0.363	S	S	.	.	H	α-helix	trans	-58.6	-34.7	179.1	-171.7	175.8	179.1	138.8	2.9	112.4	F82 E83	F82-R86 PolarHBondContact O-N 3.26Å; F82-R86 VanDerWaalsContact O-N 3.08Å; E83-R86 PolarHBondContact O-N 3.27Å; E83-R86 VanDerWaalsContact O-N 3.09Å
87	Y	73.4	Confident	80.2	Confident	28 Å²	28	76.4 Å²	76.4	11%	0.11	35%	0.353	C	S	.	.	H	α-helix	trans	-88.3	-29	-177.4	-71.1	-67.4	0	0	0	114.1	E83 Q84 Q85 Y89 A90 E91 L92 L97 L100 K104	E83-Y87 HydrophobicContact CB-CD2 4.08Å; E83-Y87 HydrophobicContact CB-CE2 4.04Å; E83-Y87 WeakPolarHBondContact O-CD2 3.49Å; E83-Y87 PolarHBondContact O-N 2.89Å; E83-Y87 VanDerWaalsContact OE2-CE2 3.22Å; E83-Y87 WeakPolarHBondContact OE2-CE2 3.16Å; Q84-Y87 PolarHBondContact O-N 3.23Å; Q85-Y87 PolarHBondContact O-N 2.97Å; Y87-Y89 VanDerWaalsContact C-N 3.26Å; Y87-Y89 PolarHBondContact O-N 3.5Å; Y87-A90 CarbonylContact O-C 3.45Å; Y87-A90 WeakPolarHBondContact O-CA 3.49Å; Y87-A90 WeakPolarHBondContact O-CB 3.45Å; Y87-A90 PolarHBondContact O-N 3.05Å; Y87-E91 PolarHBondContact O-N 3.25Å; Y87-L92 HydrophobicContact CD1-CD1 3.87Å; Y87-L92 HydrophobicContact CE1-CD1 4.44Å; Y87-L97 HydrophobicContact CD2-CD1 3.19Å; Y87-L97 HydrophobicContact CE2-CD1 3.47Å; Y87-L97 VanDerWaalsContact CE2-CD1 3.47Å; Y87-L97 HydrophobicContact CG-CD1 3.89Å; Y87-L100 HydrophobicContact CD1-CD1 4.14Å; Y87-L100 HydrophobicContact CE1-CD1 3.54Å; Y87-K104 WeakPolarHBondContact OH-CE 3.5Å; Y87-K104 PolarHBondContact OH-NZ 3.49Å
88	R	65.5	Low	80	Confident	191 Å²	191	77.1 Å²	77.1	72%	0.721	35%	0.352	S	S	*	.	H	α-helix	trans	-62.6	-33.7	169.9	-79.9	-175.8	-177.5	-179.9	2.8	112.1	Q84 Q85 A90 E91	Q84-R88 WeakPolarHBondContact O-CB 3.44Å; Q84-R88 WeakPolarHBondContact O-CG 3.4Å; Q84-R88 PolarHBondContact O-N 2.98Å; Q85-R88 PolarHBondContact O-N 3.08Å; R88-A90 PolarHBondContact O-N 3.46Å; R88-E91 PolarHBondContact O-N 3.33Å
89	Y	59.8	Low	79.7	Confident	183 Å²	183	82.7 Å²	82.7	72%	0.718	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-16.1	170.3	-80.8	-71.9	0	0	0	113.8	Q85 Y87	Q85-Y89 WeakPolarHBondContact O-CD2 3.48Å; Q85-Y89 PolarHBondContact O-N 3.48Å; Y87-Y89 VanDerWaalsContact C-N 3.26Å; Y87-Y89 PolarHBondContact O-N 3.5Å
90	A	64.8	Low	79.5	Confident	56 Å²	56	79.3 Å²	79.3	46%	0.463	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	6.9	179.9	0	0	0	0	0	113.5	Y87 R88 L92	Y87-A90 CarbonylContact O-C 3.45Å; Y87-A90 WeakPolarHBondContact O-CA 3.49Å; Y87-A90 WeakPolarHBondContact O-CB 3.45Å; Y87-A90 PolarHBondContact O-N 3.05Å; R88-A90 PolarHBondContact O-N 3.46Å; A90-L92 HydrophobicContact CB-CD1 4.05Å; A90-L92 HydrophobicContact CB-CG 4.2Å; A90-L92 PolarHBondContact O-N 3.01Å
91	E	71.4	Confident	79.4	Confident	189 Å²	189	78.5 Å²	78.5	88%	0.883	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	28.3	179.5	-58.6	-173.5	155.8	0	0	115.2	Y87 R88	Y87-E91 PolarHBondContact O-N 3.25Å; R88-E91 PolarHBondContact O-N 3.33Å
92	L	68.4	Low	79.4	Confident	77 Å²	77	80.3 Å²	80.3	40%	0.403	39%	0.385	S	S	.	.			trans	-86.7	151.1	-178.2	-69.9	169.7	0	0	0	112.8	Y87 A90 D96 L100	Y87-L92 HydrophobicContact CD1-CD1 3.87Å; Y87-L92 HydrophobicContact CE1-CD1 4.44Å; A90-L92 HydrophobicContact CB-CD1 4.05Å; A90-L92 HydrophobicContact CB-CG 4.2Å; A90-L92 PolarHBondContact O-N 3.01Å; L92-D96 HydrophobicContact CB-CB 4.06Å; L92-D96 HydrophobicContact CD2-CB 4.15Å; L92-L100 HydrophobicContact CD1-CD1 3.93Å
93	S	81	Confident	79.5	Confident	60 Å²	60	84.8 Å²	84.8	42%	0.42	41%	0.411	S	S	.	.			trans	-75	165.3	176.2	75	0	0	0	0	112.2	E95 D96 L97	S93-E95 PolarHBondContact O-N 3.11Å; S93-D96 WeakPolarHBondContact CB-OD2 3.46Å; S93-D96 PolarHBondContact N-OD2 2.87Å; S93-D96 PolarHBondContact O-N 2.57Å; S93-D96 PolarHBondContact OG-N 3.13Å; S93-D96 PolarHBondContact OG-OD2 3.37Å; S93-L97 PolarHBondContact O-N 3.48Å; S93-L97 VanDerWaalsContact O-N 3.16Å
94	E	83.6	Confident	79.7	Confident	103 Å²	103	89.4 Å²	89.4	48%	0.481	43%	0.431	S	S	.	.	H	α-helix	trans	-63.3	-31.1	174.8	-166.3	-176.3	158.9	0	0	112.3	L97 K98 Y108	E94-L97 WeakPolarHBondContact O-CB 3.3Å; E94-L97 PolarHBondContact O-N 3.22Å; E94-K98 WeakPolarHBondContact O-CG 3.27Å; E94-K98 PolarHBondContact O-N 3.25Å; E94-K98 VanDerWaalsContact O-N 3.09Å; E94-K98 IonicContact OE1-NZ 2.9Å; E94-Y108 PolarHBondContact OE1-OH 3.03Å
95	E	84.8	Confident	80	Confident	104 Å²	104	90.8 Å²	90.8	49%	0.486	46%	0.457	S	S	.	.	H	α-helix	trans	-69.5	-38	176	-68.4	-54.3	135.7	0	0	111.9	S93 L97 K98 Q99	S93-E95 PolarHBondContact O-N 3.11Å; E95-L97 VanDerWaalsContact C-N 3.29Å; E95-L97 PolarHBondContact O-N 3.38Å; E95-K98 WeakPolarHBondContact O-CB 3.27Å; E95-K98 PolarHBondContact O-N 2.83Å; E95-K98 IonicContact OE1-NZ 3.92Å; E95-K98 PolarHBondContact OE1-NZ 2.91Å; E95-K98 IonicContact OE2-NZ 3.27Å; E95-Q99 WeakPolarHBondContact O-CG 3.44Å; E95-Q99 PolarHBondContact O-N 3.3Å
96	D	84.4	Confident	80.5	Confident	58 Å²	58	88.6 Å²	88.6	31%	0.31	45%	0.449	S	S	.	.	H	α-helix	trans	-62.5	-40	173.7	-59.1	-46	0	0	0	110.8	L92 S93 K98 Q99 L100	L92-D96 HydrophobicContact CB-CB 4.06Å; L92-D96 HydrophobicContact CD2-CB 4.15Å; S93-D96 WeakPolarHBondContact CB-OD2 3.46Å; S93-D96 PolarHBondContact N-OD2 2.87Å; S93-D96 PolarHBondContact O-N 2.57Å; S93-D96 PolarHBondContact OG-N 3.13Å; S93-D96 PolarHBondContact OG-OD2 3.37Å; D96-K98 PolarHBondContact O-N 2.6Å; D96-Q99 PolarHBondContact O-N 2.85Å; D96-L100 WeakPolarHBondContact O-CB 3.38Å; D96-L100 WeakPolarHBondContact O-CG 3.28Å; D96-L100 PolarHBondContact O-N 2.77Å
97	L	84.1	Confident	81.4	Confident	9 Å²	9	85.4 Å²	85.4	5%	0.047	45%	0.447	C	S	.	.	H	α-helix	trans	-60	-44.9	175	177	58.6	0	0	0	111.6	E83 Q84 Y87 S93 E94 E95 L100 L101 Y108	E83-L97 HydrophobicContact CB-CD1 4.4Å; Q84-L97 HydrophobicContact CG-CD2 4Å; Y87-L97 HydrophobicContact CD2-CD1 3.19Å; Y87-L97 HydrophobicContact CE2-CD1 3.47Å; Y87-L97 VanDerWaalsContact CE2-CD1 3.47Å; Y87-L97 HydrophobicContact CG-CD1 3.89Å; S93-L97 PolarHBondContact O-N 3.48Å; S93-L97 VanDerWaalsContact O-N 3.16Å; E94-L97 WeakPolarHBondContact O-CB 3.3Å; E94-L97 PolarHBondContact O-N 3.22Å; E95-L97 VanDerWaalsContact C-N 3.29Å; E95-L97 PolarHBondContact O-N 3.38Å; L97-L100 PolarHBondContact O-N 3.18Å; L97-L101 HydrophobicContact CD1-CD1 3.8Å; L97-L101 HydrophobicContact CD1-CG 4.03Å; L97-L101 HydrophobicContact CG-CD1 3.94Å; L97-L101 WeakPolarHBondContact O-CB 3.27Å; L97-L101 VanDerWaalsContact O-CG 3.3Å; L97-L101 WeakPolarHBondContact O-CG 3.28Å; L97-L101 PolarHBondContact O-N 2.76Å; L97-Y108 HydrophobicContact CD2-CD2 4.46Å; L97-Y108 HydrophobicContact CD2-CE2 3.94Å; L97-Y108 HydrophobicContact CG-CD2 4.37Å; L97-Y108 HydrophobicContact CG-CE2 4.28Å
98	K	88.7	Confident	82.2	Confident	65 Å²	65	85.3 Å²	85.3	28%	0.283	45%	0.447	S	S	.	.	H	α-helix	trans	-60.6	-47.8	177.3	-71.6	170.6	-171.4	168.4	0	111.3	E94 E95 D96 L101 A102 Y108	E94-K98 WeakPolarHBondContact O-CG 3.27Å; E94-K98 PolarHBondContact O-N 3.25Å; E94-K98 VanDerWaalsContact O-N 3.09Å; E94-K98 IonicContact OE1-NZ 2.9Å; E95-K98 WeakPolarHBondContact O-CB 3.27Å; E95-K98 PolarHBondContact O-N 2.83Å; E95-K98 IonicContact OE1-NZ 3.92Å; E95-K98 PolarHBondContact OE1-NZ 2.91Å; E95-K98 IonicContact OE2-NZ 3.27Å; D96-K98 PolarHBondContact O-N 2.6Å; K98-L101 PolarHBondContact O-N 3.47Å; K98-A102 WeakPolarHBondContact O-CB 3.35Å; K98-A102 PolarHBondContact O-N 2.88Å; K98-Y108 HydrophobicContact CD-CD1 4.24Å; K98-Y108 HydrophobicContact CD-CE1 4.44Å; K98-Y108 HydrophobicContact CG-CD1 3.77Å; K98-Y108 HydrophobicContact CG-CD2 3.9Å; K98-Y108 HydrophobicContact CG-CE1 4.19Å; K98-Y108 HydrophobicContact CG-CE2 4.3Å; K98-Y108 HydrophobicContact CG-CG 3.61Å
99	Q	86.2	Confident	83.5	Confident	124 Å²	124	80.1 Å²	80.1	58%	0.579	44%	0.44	S	S	*	.	H	α-helix	trans	-62.9	-44.5	179.2	-69.8	-176.6	16.1	0	0	111.9	E95 D96 L101 A102 L103	E95-Q99 WeakPolarHBondContact O-CG 3.44Å; E95-Q99 PolarHBondContact O-N 3.3Å; D96-Q99 PolarHBondContact O-N 2.85Å; Q99-L101 PolarHBondContact O-N 3.24Å; Q99-A102 WeakPolarHBondContact O-CB 3.46Å; Q99-A102 PolarHBondContact O-N 3.08Å; Q99-L103 WeakPolarHBondContact O-CG 3.38Å; Q99-L103 PolarHBondContact O-N 3.49Å
100	L	84.8	Confident	85.1	Confident	56 Å²	56	72.6 Å²	72.6	29%	0.293	42%	0.418	S	S	.	.	H	α-helix	trans	-64.9	-40.8	179.4	-73	170	0	0	0	112.6	Y87 L92 D96 L97 A102 L103 K104	Y87-L100 HydrophobicContact CD1-CD1 4.14Å; Y87-L100 HydrophobicContact CE1-CD1 3.54Å; L92-L100 HydrophobicContact CD1-CD1 3.93Å; D96-L100 WeakPolarHBondContact O-CB 3.38Å; D96-L100 WeakPolarHBondContact O-CG 3.28Å; D96-L100 PolarHBondContact O-N 2.77Å; L97-L100 PolarHBondContact O-N 3.18Å; L100-A102 VanDerWaalsContact C-N 3.34Å; L100-L103 PolarHBondContact O-N 2.94Å; L100-K104 WeakPolarHBondContact O-CG 3.38Å; L100-K104 PolarHBondContact O-N 3.37Å; L100-K104 VanDerWaalsContact O-N 3.07Å
101	L	87.6	Confident	86.4	Confident	2 Å²	2	71.1 Å²	71.1	1%	0.01	40%	0.402	C	S	.	.	H	α-helix	trans	-64.1	-42.1	174.9	-73.8	168.9	0	0	0	111	E83 L97 K98 Q99 L103 K104 G105 S106 Y108 L111	E83-L101 HydrophobicContact CG-CD2 4.12Å; L97-L101 HydrophobicContact CD1-CD1 3.8Å; L97-L101 HydrophobicContact CD1-CG 4.03Å; L97-L101 HydrophobicContact CG-CD1 3.94Å; L97-L101 WeakPolarHBondContact O-CB 3.27Å; L97-L101 VanDerWaalsContact O-CG 3.3Å; L97-L101 WeakPolarHBondContact O-CG 3.28Å; L97-L101 PolarHBondContact O-N 2.76Å; K98-L101 PolarHBondContact O-N 3.47Å; Q99-L101 PolarHBondContact O-N 3.24Å; L101-L103 PolarHBondContact O-N 3.4Å; L101-K104 CarbonylContact O-C 3.47Å; L101-K104 WeakPolarHBondContact O-CA 3.5Å; L101-K104 PolarHBondContact O-N 3.04Å; L101-K104 VanDerWaalsContact O-N 3.12Å; L101-G105 PolarHBondContact O-N 2.83Å; L101-S106 CarbonylContact C-O 3.59Å; L101-S106 WeakPolarHBondContact O-CA 3.37Å; L101-S106 PolarHBondContact O-N 3.25Å; L101-S106 VanDerWaalsContact O-O 3.1Å; L101-Y108 HydrophobicContact CD1-CD2 3.78Å; L101-L111 HydrophobicContact CD1-CD1 4.05Å; L101-L111 HydrophobicContact CD2-CD1 4Å
102	A	89.6	Confident	87.4	Confident	66 Å²	66	64.1 Å²	64.1	55%	0.545	37%	0.37	S	S	.	.	H	α-helix	trans	-61.2	-43.3	175.7	0	0	0	0	0	112	K98 Q99 L100 K104 G105 S106	K98-A102 WeakPolarHBondContact O-CB 3.35Å; K98-A102 PolarHBondContact O-N 2.88Å; Q99-A102 WeakPolarHBondContact O-CB 3.46Å; Q99-A102 PolarHBondContact O-N 3.08Å; L100-A102 VanDerWaalsContact C-N 3.34Å; A102-K104 PolarHBondContact O-N 3.2Å; A102-G105 WeakPolarHBondContact O-CA 3.44Å; A102-G105 PolarHBondContact O-N 2.87Å; A102-S106 PolarHBondContact N-O 2.66Å
103	L	90.4	Very high	88.7	Confident	149 Å²	149	65.8 Å²	65.8	78%	0.78	38%	0.376	S	S	*	.	H	α-helix	trans	-60.9	-32.4	174.6	-72.7	171.1	0	0	0	112.7	Q99 L100 L101 G105	Q99-L103 WeakPolarHBondContact O-CG 3.38Å; Q99-L103 PolarHBondContact O-N 3.49Å; L100-L103 PolarHBondContact O-N 2.94Å; L101-L103 PolarHBondContact O-N 3.4Å; L103-G105 VanDerWaalsContact C-N 3.25Å; L103-G105 PolarHBondContact O-N 2.85Å
104	K	87.6	Confident	89.3	Confident	113 Å²	113	65.4 Å²	65.4	49%	0.491	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	2.2	172.6	-68.3	174.5	174.3	179.4	0	113.6	E83 Y87 L100 L101 A102 S106	E83-K104 IonicContact OE2-NZ 2.96Å; Y87-K104 WeakPolarHBondContact OH-CE 3.5Å; Y87-K104 PolarHBondContact OH-NZ 3.49Å; L100-K104 WeakPolarHBondContact O-CG 3.38Å; L100-K104 PolarHBondContact O-N 3.37Å; L100-K104 VanDerWaalsContact O-N 3.07Å; L101-K104 CarbonylContact O-C 3.47Å; L101-K104 WeakPolarHBondContact O-CA 3.5Å; L101-K104 PolarHBondContact O-N 3.04Å; L101-K104 VanDerWaalsContact O-N 3.12Å; A102-K104 PolarHBondContact O-N 3.2Å; K104-S106 VanDerWaalsContact C-N 3.33Å; K104-S106 PolarHBondContact O-N 3.5Å
105	G	90.3	Very high	89.9	Confident	73 Å²	73	61.8 Å²	61.8	75%	0.753	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	23.1	-176.4	0	0	0	0	0	114.4	L101 A102 L103	L101-G105 PolarHBondContact O-N 2.83Å; A102-G105 WeakPolarHBondContact O-CA 3.44Å; A102-G105 PolarHBondContact O-N 2.87Å; L103-G105 VanDerWaalsContact C-N 3.25Å; L103-G105 PolarHBondContact O-N 2.85Å
106	S	89.9	Confident	90.5	Very high	20 Å²	20	62 Å²	62	14%	0.14	35%	0.349	C	S	.	.			trans	-108.4	134.7	179.9	-61.7	0	0	0	0	111.3	R79 L101 A102 K104	R79-S106 PolarHBondContact NH2-OG 3.05Å; L101-S106 CarbonylContact C-O 3.59Å; L101-S106 WeakPolarHBondContact O-CA 3.37Å; L101-S106 PolarHBondContact O-N 3.25Å; L101-S106 VanDerWaalsContact O-O 3.1Å; A102-S106 PolarHBondContact N-O 2.66Å; K104-S106 VanDerWaalsContact C-N 3.33Å; K104-S106 PolarHBondContact O-N 3.5Å
107	S	92.3	Very high	91	Very high	68 Å²	68	61.3 Å²	61.3	48%	0.476	35%	0.345	S	S	.	.			trans	-83.2	117.8	177	173.4	0	0	0	0	111.2	S109 G110 L111	S107-S109 PolarHBondContact OG-OG 3.23Å; S107-S109 VanDerWaalsContact OG-OG 3.12Å; S107-G110 PolarHBondContact O-N 3.33Å; S107-G110 PolarHBondContact OG-N 3.25Å; S107-G110 VanDerWaalsContact OG-N 3.14Å; S107-L111 WeakPolarHBondContact O-CG 3.29Å; S107-L111 PolarHBondContact O-N 3.17Å
108	Y	90.7	Very high	91.6	Very high	25 Å²	25	61.4 Å²	61.4	10%	0.098	35%	0.345	C	S	.	.	H	α-helix	trans	-59.9	-49	174.2	177.2	-97.6	0	0	0	111.9	Y80 E94 L97 K98 L101 G110 L111 L112	Y80-Y108 HydrophobicContact CD2-CE2 4.31Å; Y80-Y108 HydrophobicContact CE2-CD2 4.28Å; Y80-Y108 AromaticContact CE2-CE2 3.5Å; Y80-Y108 HydrophobicContact CE2-CE2 3.5Å; Y80-Y108 VanDerWaalsContact CE2-CE2 3.5Å; Y80-Y108 AromaticContact CE2-CZ 3.71Å; Y80-Y108 PolarHBondContact OH-OH 2.97Å; E94-Y108 PolarHBondContact OE1-OH 3.03Å; L97-Y108 HydrophobicContact CD2-CD2 4.46Å; L97-Y108 HydrophobicContact CD2-CE2 3.94Å; L97-Y108 HydrophobicContact CG-CD2 4.37Å; L97-Y108 HydrophobicContact CG-CE2 4.28Å; K98-Y108 HydrophobicContact CD-CD1 4.24Å; K98-Y108 HydrophobicContact CD-CE1 4.44Å; K98-Y108 HydrophobicContact CG-CD1 3.77Å; K98-Y108 HydrophobicContact CG-CD2 3.9Å; K98-Y108 HydrophobicContact CG-CE1 4.19Å; K98-Y108 HydrophobicContact CG-CE2 4.3Å; K98-Y108 HydrophobicContact CG-CG 3.61Å; L101-Y108 HydrophobicContact CD1-CD2 3.78Å; Y108-G110 VanDerWaalsContact C-N 3.31Å; Y108-G110 PolarHBondContact O-N 2.6Å; Y108-L111 PolarHBondContact O-N 3.32Å; Y108-L111 VanDerWaalsContact O-N 3.13Å; Y108-L112 HydrophobicContact CE1-CD2 4.09Å; Y108-L112 WeakPolarHBondContact O-CB 3.39Å; Y108-L112 PolarHBondContact O-N 2.94Å
109	S	92.8	Very high	92	Very high	83 Å²	83	60.5 Å²	60.5	58%	0.58	35%	0.345	S	S	*	.	H	α-helix	trans	-61.6	-40.5	-179.3	52.8	0	0	0	0	111.7	S107 L111 L112 E113	S107-S109 PolarHBondContact OG-OG 3.23Å; S107-S109 VanDerWaalsContact OG-OG 3.12Å; S109-L111 PolarHBondContact O-N 3.34Å; S109-L112 PolarHBondContact O-N 2.91Å; S109-E113 WeakPolarHBondContact O-CB 3.34Å; S109-E113 PolarHBondContact O-N 3.24Å
110	G	93.2	Very high	92.6	Very high	24 Å²	24	61.5 Å²	61.5	25%	0.247	35%	0.348	C	S	.	.	H	α-helix	trans	-65.4	-36.9	175.3	0	0	0	0	0	112.9	S107 Y108 R114	S107-G110 PolarHBondContact O-N 3.33Å; S107-G110 PolarHBondContact OG-N 3.25Å; S107-G110 VanDerWaalsContact OG-N 3.14Å; Y108-G110 VanDerWaalsContact C-N 3.31Å; Y108-G110 PolarHBondContact O-N 2.6Å; G110-R114 WeakPolarHBondContact O-CB 3.28Å; G110-R114 WeakPolarHBondContact O-CG 3.36Å; G110-R114 PolarHBondContact O-N 3.24Å
111	L	92.1	Very high	93.2	Very high	26 Å²	26	59.4 Å²	59.4	14%	0.136	34%	0.337	C	S	.	.	H	α-helix	trans	-67.7	-41.4	174.5	-71.8	175	0	0	0	112	R79 Y80 L101 S107 Y108 S109 R114 H115	R79-L111 HydrophobicContact CB-CD2 4Å; R79-L111 HydrophobicContact CG-CD2 3.87Å; Y80-L111 HydrophobicContact CD2-CB 4.3Å; L101-L111 HydrophobicContact CD1-CD1 4.05Å; L101-L111 HydrophobicContact CD2-CD1 4Å; S107-L111 WeakPolarHBondContact O-CG 3.29Å; S107-L111 PolarHBondContact O-N 3.17Å; Y108-L111 PolarHBondContact O-N 3.32Å; Y108-L111 VanDerWaalsContact O-N 3.13Å; S109-L111 PolarHBondContact O-N 3.34Å; L111-R114 PolarHBondContact O-N 3.44Å; L111-H115 WeakPolarHBondContact O-CB 3.44Å; L111-H115 PolarHBondContact O-N 3.42Å
112	L	93.7	Very high	93.7	Very high	42 Å²	42	60 Å²	60	22%	0.22	34%	0.34	C	S	.	.	H	α-helix	trans	-66.9	-45.8	178.8	179.4	61.2	0	0	0	112	Y80 Y108 S109 R114 H115 H116	Y80-L112 HydrophobicContact CD2-CB 4.24Å; Y80-L112 HydrophobicContact CD2-CD1 4.42Å; Y80-L112 HydrophobicContact CE1-CD1 3.94Å; Y80-L112 HydrophobicContact CE2-CB 4.05Å; Y80-L112 HydrophobicContact CE2-CD1 3.82Å; Y80-L112 HydrophobicContact CE2-CG 4.47Å; Y108-L112 HydrophobicContact CE1-CD2 4.09Å; Y108-L112 WeakPolarHBondContact O-CB 3.39Å; Y108-L112 PolarHBondContact O-N 2.94Å; S109-L112 PolarHBondContact O-N 2.91Å; L112-R114 VanDerWaalsContact C-N 3.29Å; L112-R114 PolarHBondContact O-N 3.47Å; L112-H115 WeakPolarHBondContact O-CB 3.47Å; L112-H115 PolarHBondContact O-N 2.82Å; L112-H115 VanDerWaalsContact O-N 3.14Å; L112-H116 WeakPolarHBondContact CD1-NE2 3.49Å; L112-H116 PolarHBondContact O-N 3.12Å
113	E	95.3	Very high	94.1	Very high	111 Å²	111	61.7 Å²	61.7	52%	0.519	34%	0.337	S	S	.	.	H	α-helix	trans	-55	-47.5	175	179.5	-173.9	-160.4	0	0	111.1	S109 H115 H116 I117	S109-E113 WeakPolarHBondContact O-CB 3.34Å; S109-E113 PolarHBondContact O-N 3.24Å; E113-H115 VanDerWaalsContact C-N 3.32Å; E113-H115 PolarHBondContact O-N 3Å; E113-H116 WeakPolarHBondContact O-CB 3.33Å; E113-H116 PolarHBondContact O-N 3.13Å; E113-H116 VanDerWaalsContact O-N 3.16Å; E113-I117 HydrophobicContact CG-CD1 4.32Å; E113-I117 WeakPolarHBondContact O-CG1 3.27Å; E113-I117 PolarHBondContact O-N 2.99Å
114	R	93.6	Very high	94.5	Very high	52 Å²	52	57.3 Å²	57.3	20%	0.196	31%	0.313	C	S	.	.	H	α-helix	trans	-66.8	-35.9	178.9	-64.2	-73.2	161.5	-178.8	-6.4	112.1	G110 L111 L112 H116 I117 H118 D184 E186	G110-R114 WeakPolarHBondContact O-CB 3.28Å; G110-R114 WeakPolarHBondContact O-CG 3.36Å; G110-R114 PolarHBondContact O-N 3.24Å; L111-R114 PolarHBondContact O-N 3.44Å; L112-R114 VanDerWaalsContact C-N 3.29Å; L112-R114 PolarHBondContact O-N 3.47Å; R114-H116 VanDerWaalsContact C-N 3.34Å; R114-I117 PolarHBondContact O-N 3.38Å; R114-H118 PolarHBondContact O-CD2 2.98Å; R114-H118 PolarHBondContact O-N 3.45Å; R114-D184 WeakPolarHBondContact CD-OD2 3.24Å; R114-D184 IonicContact NH1-OD1 3.81Å; R114-D184 PolarHBondContact NH1-OD1 2.88Å; R114-D184 IonicContact NH1-OD2 3.5Å; R114-D184 PolarHBondContact NH1-OD2 3.07Å; R114-E186 IonicContact NH1-OE2 3.12Å; R114-E186 PolarHBondContact NH1-OE2 2.81Å; R114-E186 IonicContact NH2-OE2 2.74Å
115	H	95.6	Very high	95	Very high	28 Å²	28	52 Å²	52	13%	0.13	29%	0.289	C	S	.	.	H	α-helix	trans	-59.8	-45.6	171.3	173.3	50.8	0	0	0	111.5	T78 Y80 E81 L111 L112 E113 I117 H118 T119	T78-H115 HydrophobicContact CG2-CB 4.44Å; T78-H115 PolarHBondContact OG1-ND1 3.23Å; Y80-H115 HydrophobicContact CD1-CB 3.98Å; Y80-H115 AromaticContact CD1-CD2 3.48Å; Y80-H115 VanDerWaalsContact CD1-CD2 3.48Å; Y80-H115 WeakPolarHBondContact CD1-CD2 3.45Å; Y80-H115 AromaticContact CD1-CG 3.7Å; Y80-H115 AromaticContact CE1-CD2 3.77Å; Y80-H115 HydrophobicContact CG-CB 4.07Å; E81-H115 IonicContact OE1-CE1 3.99Å; E81-H115 PolarHBondContact OE1-CE1 2.92Å; E81-H115 IonicContact OE1-ND1 2.71Å; L111-H115 WeakPolarHBondContact O-CB 3.44Å; L111-H115 PolarHBondContact O-N 3.42Å; L112-H115 WeakPolarHBondContact O-CB 3.47Å; L112-H115 PolarHBondContact O-N 2.82Å; L112-H115 VanDerWaalsContact O-N 3.14Å; E113-H115 VanDerWaalsContact C-N 3.32Å; E113-H115 PolarHBondContact O-N 3Å; H115-I117 PolarHBondContact O-N 3.27Å; H115-H118 PolarHBondContact O-N 2.91Å; H115-T119 PolarHBondContact CE1-OG1 3Å; H115-T119 VanDerWaalsContact CE1-OG1 3.23Å; H115-T119 PolarHBondContact ND1-OG1 2.82Å; H115-T119 WeakPolarHBondContact O-CB 3.35Å; H115-T119 PolarHBondContact O-N 2.85Å; H115-T119 PolarHBondContact O-OG1 2.81Å
116	H	97.3	Very high	95.4	Very high	107 Å²	107	49.1 Å²	49.1	50%	0.495	26%	0.256	S	S	.	.	H	α-helix	trans	-62.3	-40.8	176.4	-63.9	161.7	0	0	0	112.8	L112 E113 R114 H118 T119 K120	L112-H116 WeakPolarHBondContact CD1-NE2 3.49Å; L112-H116 PolarHBondContact O-N 3.12Å; E113-H116 WeakPolarHBondContact O-CB 3.33Å; E113-H116 PolarHBondContact O-N 3.13Å; E113-H116 VanDerWaalsContact O-N 3.16Å; R114-H116 VanDerWaalsContact C-N 3.34Å; H116-H118 PolarHBondContact O-N 2.93Å; H116-T119 PolarHBondContact O-N 3.17Å; H116-K120 VanDerWaalsContact O-CB 3.24Å; H116-K120 WeakPolarHBondContact O-CB 3.35Å; H116-K120 PolarHBondContact O-N 2.81Å
117	I	96.3	Very high	95.8	Very high	45 Å²	45	52 Å²	52	23%	0.231	27%	0.271	C	S	.	.	H	α-helix	trans	-58.2	-48.8	174.8	-68.8	165.8	0	0	0	110.5	E113 R114 H115 N121 D184	E113-I117 HydrophobicContact CG-CD1 4.32Å; E113-I117 WeakPolarHBondContact O-CG1 3.27Å; E113-I117 PolarHBondContact O-N 2.99Å; R114-I117 PolarHBondContact O-N 3.38Å; H115-I117 PolarHBondContact O-N 3.27Å; I117-N121 PolarHBondContact O-N 2.9Å; I117-N121 VanDerWaalsContact O-N 3.08Å; I117-N121 PolarHBondContact O-ND2 3.4Å; I117-D184 HydrophobicContact CG2-CB 4.3Å
118	H	96.5	Very high	96.1	Very high	11 Å²	11	49.2 Å²	49.2	5%	0.051	25%	0.251	C	S	.	.	H	α-helix	trans	-60.2	-50.3	177.1	-80.1	-59.5	0	0	0	112.2	K76 T78 R114 H115 H116 K120 N121 V122 T183 D184	K76-H118 WeakPolarHBondContact CD-CE1 3.49Å; K76-H118 WeakPolarHBondContact CD-ND1 3.27Å; K76-H118 WeakPolarHBondContact CD-NE2 3.48Å; K76-H118 PolarHBondContact NZ-CE1 2.89Å; K76-H118 PolarHBondContact NZ-NE2 3.37Å; T78-H118 HydrophobicContact CG2-CB 3.98Å; R114-H118 PolarHBondContact O-CD2 2.98Å; R114-H118 PolarHBondContact O-N 3.45Å; H115-H118 PolarHBondContact O-N 2.91Å; H116-H118 PolarHBondContact O-N 2.93Å; H118-K120 PolarHBondContact O-N 2.8Å; H118-N121 PolarHBondContact O-N 3.03Å; H118-V122 VanDerWaalsContact O-CG2 3.29Å; H118-V122 WeakPolarHBondContact O-CG2 3.33Å; H118-V122 PolarHBondContact O-N 3.48Å; H118-T183 PolarHBondContact CE1-OG1 2.6Å; H118-T183 WeakPolarHBondContact ND1-CB 3.29Å; H118-T183 PolarHBondContact ND1-O 3.17Å; H118-T183 PolarHBondContact ND1-OG1 3.06Å; H118-D184 WeakPolarHBondContact CE1-CB 3.41Å; H118-D184 WeakPolarHBondContact NE2-CB 3.49Å; H118-D184 IonicContact NE2-OD2 3.6Å
119	T	97.1	Very high	96.5	Very high	45 Å²	45	48 Å²	48	28%	0.276	25%	0.246	S	C	.	.	H	α-helix	trans	-59.5	-47.7	-178.8	-59	0	0	0	0	111	H115 H116 N121 V122 E123	H115-T119 PolarHBondContact CE1-OG1 3Å; H115-T119 VanDerWaalsContact CE1-OG1 3.23Å; H115-T119 PolarHBondContact ND1-OG1 2.82Å; H115-T119 WeakPolarHBondContact O-CB 3.35Å; H115-T119 PolarHBondContact O-N 2.85Å; H115-T119 PolarHBondContact O-OG1 2.81Å; H116-T119 PolarHBondContact O-N 3.17Å; T119-N121 VanDerWaalsContact C-N 3.33Å; T119-N121 PolarHBondContact O-N 3.09Å; T119-V122 PolarHBondContact O-N 3.47Å; T119-V122 VanDerWaalsContact O-N 3.16Å; T119-E123 HydrophobicContact CG2-CG 4.46Å; T119-E123 WeakPolarHBondContact O-CG 3.45Å; T119-E123 PolarHBondContact O-N 2.63Å
120	K	97.9	Very high	96.8	Very high	145 Å²	145	50.7 Å²	50.7	63%	0.63	24%	0.243	S	C	*	.	H	α-helix	trans	-57.3	-44.1	177	-178.9	-175.5	176.6	-175.6	0	112.3	H116 H118 E123 H124	H116-K120 VanDerWaalsContact O-CB 3.24Å; H116-K120 WeakPolarHBondContact O-CB 3.35Å; H116-K120 PolarHBondContact O-N 2.81Å; H118-K120 PolarHBondContact O-N 2.8Å; K120-E123 PolarHBondContact O-N 3.24Å; K120-H124 WeakPolarHBondContact O-CB 3.42Å; K120-H124 PolarHBondContact O-N 3.08Å
121	N	97.9	Very high	97	Very high	12 Å²	12	56.1 Å²	56.1	6%	0.064	27%	0.267	C	S	.	.	H	α-helix	trans	-72	-33	179.7	-72.1	-28	0	0	0	112.1	I117 H118 T119 I125 T183 T199	I117-N121 PolarHBondContact O-N 2.9Å; I117-N121 VanDerWaalsContact O-N 3.08Å; I117-N121 PolarHBondContact O-ND2 3.4Å; H118-N121 PolarHBondContact O-N 3.03Å; T119-N121 VanDerWaalsContact C-N 3.33Å; T119-N121 PolarHBondContact O-N 3.09Å; N121-I125 WeakPolarHBondContact O-CD1 3.34Å; N121-I125 VanDerWaalsContact O-CG1 3.29Å; N121-I125 WeakPolarHBondContact O-CG1 3.48Å; N121-I125 PolarHBondContact O-N 3.22Å; N121-I125 VanDerWaalsContact O-N 3.16Å; N121-T183 HydrophobicContact CB-CG2 4.2Å; N121-T183 PolarHBondContact ND2-O 3.21Å; N121-T199 HydrophobicContact CB-CG2 4.4Å
122	V	98.3	Very high	97.2	Very high	14 Å²	14	59 Å²	59	9%	0.085	28%	0.279	C	S	.	.	H	α-helix	trans	-64.7	-46.2	171.7	170.8	0	0	0	0	110.7	A75 H118 T119 H124 I125 I126 L138 A158 T183	A75-V122 HydrophobicContact CB-CG1 4.34Å; A75-V122 HydrophobicContact CB-CG2 4.24Å; H118-V122 VanDerWaalsContact O-CG2 3.29Å; H118-V122 WeakPolarHBondContact O-CG2 3.33Å; H118-V122 PolarHBondContact O-N 3.48Å; T119-V122 PolarHBondContact O-N 3.47Å; T119-V122 VanDerWaalsContact O-N 3.16Å; V122-H124 VanDerWaalsContact C-N 3.34Å; V122-H124 PolarHBondContact O-N 2.98Å; V122-I125 WeakPolarHBondContact O-CB 3.31Å; V122-I125 PolarHBondContact O-N 2.88Å; V122-I126 HydrophobicContact CG1-CD1 3.78Å; V122-I126 HydrophobicContact CG1-CG1 4.49Å; V122-I126 WeakPolarHBondContact O-CG1 3.44Å; V122-I126 PolarHBondContact O-N 3.48Å; V122-L138 HydrophobicContact CG1-CD1 3.94Å; V122-L138 HydrophobicContact CG1-CD2 4.49Å; V122-A158 HydrophobicContact CG2-CB 3.96Å; V122-T183 HydrophobicContact CG2-CG2 3.92Å
123	E	98.3	Very high	97.4	Very high	103 Å²	103	60.3 Å²	60.3	48%	0.481	30%	0.304	S	S	.	.	H	α-helix	trans	-58.5	-46.3	175.6	-73	169	172.5	0	0	111	T119 K120 I125 I126 D127	T119-E123 HydrophobicContact CG2-CG 4.46Å; T119-E123 WeakPolarHBondContact O-CG 3.45Å; T119-E123 PolarHBondContact O-N 2.63Å; K120-E123 PolarHBondContact O-N 3.24Å; E123-I125 VanDerWaalsContact C-N 3.3Å; E123-I125 PolarHBondContact O-N 3.14Å; E123-I126 PolarHBondContact O-N 3.16Å; E123-I126 VanDerWaalsContact O-N 3.09Å; E123-D127 WeakPolarHBondContact O-CB 3.41Å; E123-D127 PolarHBondContact O-N 3.29Å
124	H	98.3	Very high	97.6	Very high	57 Å²	57	55.5 Å²	55.5	26%	0.264	28%	0.281	S	S	.	.	H	α-helix	trans	-55.2	-43	175.7	176.6	59.1	0	0	0	113	K120 V122 S128 T199 H200 F202	K120-H124 WeakPolarHBondContact O-CB 3.42Å; K120-H124 PolarHBondContact O-N 3.08Å; V122-H124 VanDerWaalsContact C-N 3.34Å; V122-H124 PolarHBondContact O-N 2.98Å; H124-S128 VanDerWaalsContact O-CB 3.28Å; H124-S128 WeakPolarHBondContact O-CB 3.45Å; H124-S128 PolarHBondContact O-N 2.87Å; H124-S128 PolarHBondContact O-OG 2.67Å; H124-T199 PolarHBondContact CD2-O 2.96Å; H124-H200 PolarHBondContact NE2-O 3.36Å; H124-F202 PolarHBondContact NE2-N 3.23Å
125	I	98.4	Very high	97.8	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-63.1	-48.2	176	-67	161	0	0	0	110.4	V73 N121 V122 E123 S128 L129 I156 A158 V181 T183 F202	V73-I125 HydrophobicContact CG2-CG2 4.42Å; N121-I125 WeakPolarHBondContact O-CD1 3.34Å; N121-I125 VanDerWaalsContact O-CG1 3.29Å; N121-I125 WeakPolarHBondContact O-CG1 3.48Å; N121-I125 PolarHBondContact O-N 3.22Å; N121-I125 VanDerWaalsContact O-N 3.16Å; V122-I125 WeakPolarHBondContact O-CB 3.31Å; V122-I125 PolarHBondContact O-N 2.88Å; E123-I125 VanDerWaalsContact C-N 3.3Å; E123-I125 PolarHBondContact O-N 3.14Å; I125-S128 PolarHBondContact O-N 3.07Å; I125-L129 HydrophobicContact CG2-CD1 3.98Å; I125-L129 VanDerWaalsContact O-CG 3.29Å; I125-L129 WeakPolarHBondContact O-CG 3.46Å; I125-L129 PolarHBondContact O-N 2.9Å; I125-L129 VanDerWaalsContact O-N 3.08Å; I125-I156 HydrophobicContact CG2-CD1 4.38Å; I125-I156 HydrophobicContact CG2-CG2 4.3Å; I125-A158 HydrophobicContact CD1-CB 4.02Å; I125-V181 HydrophobicContact CD1-CB 3.84Å; I125-V181 HydrophobicContact CD1-CG1 3.62Å; I125-V181 HydrophobicContact CD1-CG2 4.37Å; I125-V181 HydrophobicContact CG1-CG1 4.23Å; I125-T183 HydrophobicContact CD1-CG2 4.18Å; I125-F202 HydrophobicContact CB-CD1 4.43Å; I125-F202 HydrophobicContact CG1-CD1 4.43Å; I125-F202 HydrophobicContact CG1-CD2 4.36Å; I125-F202 HydrophobicContact CG1-CG 4.19Å; I125-F202 HydrophobicContact CG2-CD1 4.21Å; I125-F202 HydrophobicContact CG2-CE1 3.91Å; I125-F202 HydrophobicContact CG2-CZ 4.14Å
126	I	98.6	Very high	97.9	Very high	12 Å²	12	57.6 Å²	57.6	6%	0.062	30%	0.295	C	S	.	.	H	α-helix	trans	-62.8	-47	-177.8	-68.1	167.7	0	0	0	111	V73 V122 E123 S128 L129 R130 V136 L138	V73-I126 HydrophobicContact CG2-CG1 4.34Å; V122-I126 HydrophobicContact CG1-CD1 3.78Å; V122-I126 HydrophobicContact CG1-CG1 4.49Å; V122-I126 WeakPolarHBondContact O-CG1 3.44Å; V122-I126 PolarHBondContact O-N 3.48Å; E123-I126 PolarHBondContact O-N 3.16Å; E123-I126 VanDerWaalsContact O-N 3.09Å; I126-S128 VanDerWaalsContact C-N 3.33Å; I126-S128 PolarHBondContact O-N 2.67Å; I126-L129 PolarHBondContact O-N 2.83Å; I126-R130 HydrophobicContact CG2-CG 4.37Å; I126-R130 VanDerWaalsContact CG2-CZ 3.45Å; I126-R130 WeakPolarHBondContact O-CG 3.4Å; I126-R130 PolarHBondContact O-N 2.76Å; I126-V136 HydrophobicContact CG1-CG1 4.23Å; I126-V136 HydrophobicContact CG2-CG1 4.3Å; I126-L138 HydrophobicContact CD1-CB 4.09Å; I126-L138 HydrophobicContact CD1-CD1 4.12Å; I126-L138 HydrophobicContact CD1-CD2 3.83Å; I126-L138 HydrophobicContact CD1-CG 4.23Å
127	D	98.4	Very high	98	Very high	82 Å²	82	57 Å²	57	44%	0.439	29%	0.288	S	S	.	.	H	α-helix	trans	-63.8	-42.1	-179.8	-69.1	-17	0	0	0	110.7	E123 L129 R130 N131	E123-D127 WeakPolarHBondContact O-CB 3.41Å; E123-D127 PolarHBondContact O-N 3.29Å; D127-L129 VanDerWaalsContact C-N 3.31Å; D127-L129 PolarHBondContact O-N 2.67Å; D127-R130 PolarHBondContact O-N 3.13Å; D127-N131 VanDerWaalsContact O-CB 3.3Å; D127-N131 WeakPolarHBondContact O-CB 3.32Å; D127-N131 PolarHBondContact O-N 2.99Å; D127-N131 PolarHBondContact O-ND2 2.94Å; D127-N131 PolarHBondContact O-OD1 3.47Å
128	S	98.4	Very high	98.1	Very high	8 Å²	8	58.8 Å²	58.8	6%	0.056	30%	0.298	C	S	.	.	H	α-helix	trans	-59.3	-40.1	175.6	-60.6	0	0	0	0	112.5	H124 I125 I126 E132 P203	H124-S128 VanDerWaalsContact O-CB 3.28Å; H124-S128 WeakPolarHBondContact O-CB 3.45Å; H124-S128 PolarHBondContact O-N 2.87Å; H124-S128 PolarHBondContact O-OG 2.67Å; I125-S128 PolarHBondContact O-N 3.07Å; I126-S128 VanDerWaalsContact C-N 3.33Å; I126-S128 PolarHBondContact O-N 2.67Å; S128-E132 WeakPolarHBondContact O-CG 3.36Å; S128-P203 WeakPolarHBondContact OG-CD 3.48Å; S128-P203 WeakPolarHBondContact OG-CG 3.33Å
129	L	98.5	Very high	98.2	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-69.4	-47	176.4	-68.1	163.3	0	0	0	111.6	V71 V73 I125 I126 D127 N131 E132 I134 V136 I156 F202 L206	V71-L129 HydrophobicContact CB-CD1 4.5Å; V71-L129 HydrophobicContact CG1-CD1 4.1Å; V71-L129 HydrophobicContact CG2-CD2 4.47Å; V73-L129 HydrophobicContact CG2-CD1 3.92Å; I125-L129 HydrophobicContact CG2-CD1 3.98Å; I125-L129 VanDerWaalsContact O-CG 3.29Å; I125-L129 WeakPolarHBondContact O-CG 3.46Å; I125-L129 PolarHBondContact O-N 2.9Å; I125-L129 VanDerWaalsContact O-N 3.08Å; I126-L129 PolarHBondContact O-N 2.83Å; D127-L129 VanDerWaalsContact C-N 3.31Å; D127-L129 PolarHBondContact O-N 2.67Å; L129-N131 VanDerWaalsContact C-N 3.33Å; L129-N131 PolarHBondContact O-N 3.12Å; L129-E132 PolarHBondContact O-N 2.96Å; L129-E132 VanDerWaalsContact O-N 3.12Å; L129-I134 HydrophobicContact CB-CB 4.22Å; L129-I134 HydrophobicContact CB-CD1 4.41Å; L129-I134 HydrophobicContact CD2-CD1 3.66Å; L129-I134 VanDerWaalsContact O-CB 3.3Å; L129-I134 WeakPolarHBondContact O-CB 3.26Å; L129-I134 PolarHBondContact O-N 2.89Å; L129-I134 VanDerWaalsContact O-N 3.14Å; L129-V136 HydrophobicContact CB-CG2 3.55Å; L129-V136 HydrophobicContact CD1-CG1 4.42Å; L129-V136 HydrophobicContact CD1-CG2 3.92Å; L129-V136 HydrophobicContact CG-CG2 4.37Å; L129-I156 HydrophobicContact CD1-CD1 3.84Å; L129-I156 HydrophobicContact CD2-CD1 4.15Å; L129-F202 HydrophobicContact CD2-CE1 4.04Å; L129-F202 HydrophobicContact CG-CE1 4.04Å; L129-L206 HydrophobicContact CD2-CD1 4.18Å; L129-L206 HydrophobicContact CD2-CD2 3.9Å
130	R	98.4	Very high	98.1	Very high	138 Å²	138	59.5 Å²	59.5	52%	0.521	30%	0.298	S	S	.	.	H	α-helix	trans	-64.5	-36.8	-178.5	-74.6	176.4	174.7	165	-2	112.4	I126 D127 E132 G133 V136	I126-R130 HydrophobicContact CG2-CG 4.37Å; I126-R130 VanDerWaalsContact CG2-CZ 3.45Å; I126-R130 WeakPolarHBondContact O-CG 3.4Å; I126-R130 PolarHBondContact O-N 2.76Å; D127-R130 PolarHBondContact O-N 3.13Å; R130-E132 PolarHBondContact O-N 3.45Å; R130-G133 WeakPolarHBondContact O-CA 3.34Å; R130-G133 PolarHBondContact O-N 3.42Å; R130-V136 HydrophobicContact CG-CB 4.5Å; R130-V136 HydrophobicContact CG-CG2 4.08Å
131	N	97.9	Very high	97.8	Very high	138 Å²	138	55 Å²	55	74%	0.738	28%	0.277	S	S	*	.	H	α-helix	trans	-62.2	-25.8	175.7	-71.4	-17.8	0	0	0	112.6	D127 L129 G133	D127-N131 VanDerWaalsContact O-CB 3.3Å; D127-N131 WeakPolarHBondContact O-CB 3.32Å; D127-N131 PolarHBondContact O-N 2.99Å; D127-N131 PolarHBondContact O-ND2 2.94Å; D127-N131 PolarHBondContact O-OD1 3.47Å; L129-N131 VanDerWaalsContact C-N 3.33Å; L129-N131 PolarHBondContact O-N 3.12Å; N131-G133 VanDerWaalsContact C-N 3.3Å
132	E	97	Very high	97.3	Very high	86 Å²	86	62 Å²	62	40%	0.402	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	9	174	-62.7	-69.6	159.5	0	0	112.7	S128 L129 R130 I134 L206 Q207 Y210	S128-E132 WeakPolarHBondContact O-CG 3.36Å; L129-E132 PolarHBondContact O-N 2.96Å; L129-E132 VanDerWaalsContact O-N 3.12Å; R130-E132 PolarHBondContact O-N 3.45Å; E132-I134 VanDerWaalsContact C-N 3.34Å; E132-I134 HydrophobicContact CB-CD1 4.39Å; E132-I134 HydrophobicContact CB-CG1 4.37Å; E132-L206 HydrophobicContact CG-CD1 4.25Å; E132-Q207 PolarHBondContact OE1-NE2 3.31Å; E132-Y210 WeakPolarHBondContact CB-OH 3.37Å; E132-Y210 HydrophobicContact CG-CE2 4.19Å; E132-Y210 WeakPolarHBondContact OE2-CE2 3.37Å
133	G	97.6	Very high	97.1	Very high	71 Å²	71	67 Å²	67	73%	0.732	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.3	16.5	179.2	0	0	0	0	0	114.8	R130 N131	R130-G133 WeakPolarHBondContact O-CA 3.34Å; R130-G133 PolarHBondContact O-N 3.42Å; N131-G133 VanDerWaalsContact C-N 3.3Å
134	I	98.5	Very high	97	Very high	9 Å²	9	62.5 Å²	62.5	5%	0.046	30%	0.303	C	S	.	.			trans	-81.5	132.9	178.6	-57.7	174.3	0	0	0	109.7	P68 V71 L129 E132 V136 Y210	P68-I134 HydrophobicContact CG-CD1 4.27Å; V71-I134 HydrophobicContact CB-CG2 4.04Å; V71-I134 HydrophobicContact CG2-CG2 3.68Å; L129-I134 HydrophobicContact CB-CB 4.22Å; L129-I134 HydrophobicContact CB-CD1 4.41Å; L129-I134 HydrophobicContact CD2-CD1 3.66Å; L129-I134 VanDerWaalsContact O-CB 3.3Å; L129-I134 WeakPolarHBondContact O-CB 3.26Å; L129-I134 PolarHBondContact O-N 2.89Å; L129-I134 VanDerWaalsContact O-N 3.14Å; E132-I134 VanDerWaalsContact C-N 3.34Å; E132-I134 HydrophobicContact CB-CD1 4.39Å; E132-I134 HydrophobicContact CB-CG1 4.37Å; I134-V136 HydrophobicContact CG2-CG2 4.32Å; I134-Y210 WeakPolarHBondContact CD1-OH 3.46Å
135	E	98.6	Very high	96.8	Very high	107 Å²	107	63.2 Å²	63.2	50%	0.5	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	125.1	171.6	-167.5	-173.4	165	0	0	109.6	S69 R70 V71 W151	S69-E135 PolarHBondContact O-N 3.34Å; R70-E135 CarbonylContact C-O 3.56Å; R70-E135 WeakPolarHBondContact CA-O 3.39Å; R70-E135 HydrophobicContact CG-CB 4.11Å; V71-E135 PolarHBondContact N-O 2.81Å; E135-W151 HydrophobicContact CB-CZ2 4.36Å; E135-W151 HydrophobicContact CG-CH2 4.23Å; E135-W151 HydrophobicContact CG-CZ2 3.85Å; E135-W151 WeakPolarHBondContact OE1-CZ2 3.35Å
136	V	98.7	Very high	96.6	Very high	18 Å²	18	67.9 Å²	67.9	11%	0.109	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	128.5	-172.7	-176.2	0	0	0	0	111.7	V71 V73 I126 L129 R130 I134	V71-V136 WeakPolarHBondContact O-CA 3.37Å; V73-V136 HydrophobicContact CG2-CG1 3.74Å; I126-V136 HydrophobicContact CG1-CG1 4.23Å; I126-V136 HydrophobicContact CG2-CG1 4.3Å; L129-V136 HydrophobicContact CB-CG2 3.55Å; L129-V136 HydrophobicContact CD1-CG1 4.42Å; L129-V136 HydrophobicContact CD1-CG2 3.92Å; L129-V136 HydrophobicContact CG-CG2 4.37Å; R130-V136 HydrophobicContact CG-CB 4.5Å; R130-V136 HydrophobicContact CG-CG2 4.08Å; I134-V136 HydrophobicContact CG2-CG2 4.32Å
137	R	98.5	Very high	96.5	Very high	93 Å²	93	73.1 Å²	73.1	35%	0.351	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	117.1	166	-73.2	-179.5	-172.7	-173.6	-2.4	110	V71 V72 V73 W151	V71-R137 PolarHBondContact O-N 2.87Å; V72-R137 CarbonylContact C-O 3.5Å; V72-R137 WeakPolarHBondContact CA-O 3.39Å; V72-R137 HydrophobicContact CG2-CB 4.04Å; V73-R137 PolarHBondContact N-O 3.5Å; R137-W151 HydrophobicContact CB-CE3 4.49Å; R137-W151 HydrophobicContact CB-CH2 4.11Å; R137-W151 HydrophobicContact CB-CZ3 3.86Å; R137-W151 HydrophobicContact CG-CE3 4.18Å; R137-W151 HydrophobicContact CG-CH2 3.57Å; R137-W151 HydrophobicContact CG-CZ2 3.96Å; R137-W151 HydrophobicContact CG-CZ3 3.69Å; R137-W151 VanDerWaalsContact CZ-CD1 3.42Å; R137-W151 VanDerWaalsContact CZ-CE2 3.45Å; R137-W151 VanDerWaalsContact NH2-CD1 3.29Å; R137-W151 VanDerWaalsContact NH2-NE1 3.15Å
138	L	98.4	Very high	96.5	Very high	83 Å²	83	69.9 Å²	69.9	44%	0.435	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	125	170.2	174.7	62.3	0	0	0	108.6	V73 A75 V122 I126	V73-L138 HydrophobicContact CB-CD1 4.28Å; V73-L138 HydrophobicContact CG1-CD1 4.09Å; V73-L138 WeakPolarHBondContact O-CA 3.28Å; A75-L138 HydrophobicContact CB-CD1 3.65Å; V122-L138 HydrophobicContact CG1-CD1 3.94Å; V122-L138 HydrophobicContact CG1-CD2 4.49Å; I126-L138 HydrophobicContact CD1-CB 4.09Å; I126-L138 HydrophobicContact CD1-CD1 4.12Å; I126-L138 HydrophobicContact CD1-CD2 3.83Å; I126-L138 HydrophobicContact CD1-CG 4.23Å
139	V	97.9	Very high	96.4	Very high	12 Å²	12	70 Å²	70	7%	0.073	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	154	178.4	-58.8	0	0	0	0	110.7	V72 V73 V74 A75 E143 Y144 T148	V72-V139 HydrophobicContact CG1-CG2 3.55Å; V73-V139 PolarHBondContact O-N 2.66Å; V74-V139 WeakPolarHBondContact CA-O 3.23Å; V74-V139 HydrophobicContact CG2-CG2 4.06Å; A75-V139 PolarHBondContact N-O 3.25Å; V139-E143 HydrophobicContact CB-CB 4.14Å; V139-E143 HydrophobicContact CG1-CB 4.46Å; V139-Y144 HydrophobicContact CG2-CD2 3.87Å; V139-Y144 HydrophobicContact CG2-CG 4.4Å; V139-T148 HydrophobicContact CG1-CG2 4.27Å
140	K	94.6	Very high	96.4	Very high	59 Å²	59	77.2 Å²	77.2	26%	0.257	37%	0.366	S	S	.	.			trans	-109.9	176.3	169	-65.8	-173.5	179	-173.5	0	110.7	E81 R142 E143 Y144	E81-K140 IonicContact OE1-NZ 2.9Å; E81-K140 PolarHBondContact OE1-NZ 3.14Å; E81-K140 IonicContact OE2-NZ 2.83Å; E81-K140 PolarHBondContact OE2-NZ 3.19Å; K140-R142 VanDerWaalsContact C-N 3.29Å; K140-R142 PolarHBondContact O-N 3.34Å; K140-R142 VanDerWaalsContact O-N 3.12Å; K140-E143 PolarHBondContact N-OE2 2.7Å; K140-E143 VanDerWaalsContact N-OE2 3.15Å; K140-E143 CarbonylContact O-C 3.55Å; K140-E143 PolarHBondContact O-N 3.36Å; K140-Y144 WeakPolarHBondContact O-CB 3.44Å; K140-Y144 PolarHBondContact O-N 3.26Å
141	R	91.7	Very high	96.3	Very high	50 Å²	50	72.1 Å²	72.1	19%	0.189	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-44.4	-48.6	-177.1	176.9	177.2	-74	-92.7	-2.4	113.9	E143 Y144 L166 D237 H239	R141-E143 VanDerWaalsContact C-N 3.25Å; R141-E143 PolarHBondContact O-N 2.84Å; R141-Y144 PolarHBondContact O-N 2.88Å; R141-L166 HydrophobicContact CB-CD2 3.84Å; R141-L166 HydrophobicContact CG-CD1 4.25Å; R141-L166 HydrophobicContact CG-CD2 4.15Å; R141-D237 IonicContact CZ-OD2 3.89Å; R141-D237 IonicContact NH1-OD1 3.31Å; R141-D237 PolarHBondContact NH1-OD1 2.69Å; R141-D237 IonicContact NH1-OD2 3.6Å; R141-D237 PolarHBondContact NH1-OD2 2.8Å; R141-H239 VanDerWaalsContact CZ-CD2 3.49Å; R141-H239 PolarHBondContact NH2-CD2 2.96Å
142	R	89	Confident	96.4	Very high	161 Å²	161	65.5 Å²	65.5	61%	0.608	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-67.1	-24.2	-176.8	-69.6	-176	179.2	-177.9	0.4	114.2	K140	K140-R142 VanDerWaalsContact C-N 3.29Å; K140-R142 PolarHBondContact O-N 3.34Å; K140-R142 VanDerWaalsContact O-N 3.12Å
143	E	93.8	Very high	96.4	Very high	118 Å²	118	63.7 Å²	63.7	55%	0.551	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-102.6	-4.9	-177.1	-60.7	160.7	158.9	0	0	111.3	V139 K140 R141 D145 T148	V139-E143 HydrophobicContact CB-CB 4.14Å; V139-E143 HydrophobicContact CG1-CB 4.46Å; K140-E143 PolarHBondContact N-OE2 2.7Å; K140-E143 VanDerWaalsContact N-OE2 3.15Å; K140-E143 CarbonylContact O-C 3.55Å; K140-E143 PolarHBondContact O-N 3.36Å; R141-E143 VanDerWaalsContact C-N 3.25Å; R141-E143 PolarHBondContact O-N 2.84Å; E143-D145 PolarHBondContact O-N 2.89Å; E143-T148 WeakPolarHBondContact O-CG2 3.38Å
144	Y	95.9	Very high	96.4	Very high	8 Å²	8	60.3 Å²	60.3	3%	0.031	27%	0.27	C	S	.	.			trans	-92.8	104	-175.3	-177.3	-116.4	0	0	0	111.2	V72 V74 V139 K140 R141 T148 V149 V155 L166 A167 K170	V72-Y144 HydrophobicContact CG1-CD2 4.37Å; V72-Y144 HydrophobicContact CG1-CE2 4.3Å; V74-Y144 HydrophobicContact CG1-CD1 4.48Å; V74-Y144 HydrophobicContact CG1-CG 4.3Å; V74-Y144 HydrophobicContact CG2-CD1 4.46Å; V74-Y144 HydrophobicContact CG2-CD2 3.56Å; V74-Y144 HydrophobicContact CG2-CE1 4.42Å; V74-Y144 HydrophobicContact CG2-CE2 3.52Å; V74-Y144 HydrophobicContact CG2-CG 4.05Å; V139-Y144 HydrophobicContact CG2-CD2 3.87Å; V139-Y144 HydrophobicContact CG2-CG 4.4Å; K140-Y144 WeakPolarHBondContact O-CB 3.44Å; K140-Y144 PolarHBondContact O-N 3.26Å; R141-Y144 PolarHBondContact O-N 2.88Å; Y144-T148 VanDerWaalsContact CD2-OG1 3.29Å; Y144-T148 WeakPolarHBondContact CD2-OG1 3.46Å; Y144-V149 HydrophobicContact CE2-CG2 3.59Å; Y144-V149 WeakPolarHBondContact OH-CG2 3.35Å; Y144-V155 HydrophobicContact CE2-CG1 4.37Å; Y144-L166 HydrophobicContact CD1-CD1 4.22Å; Y144-L166 HydrophobicContact CD1-CG 4.23Å; Y144-L166 WeakPolarHBondContact CE1-O 3.29Å; Y144-A167 PolarHBondContact OH-O 2.62Å; Y144-K170 HydrophobicContact CD1-CB 4.44Å; Y144-K170 HydrophobicContact CD1-CG 3.84Å; Y144-K170 HydrophobicContact CE1-CB 3.66Å; Y144-K170 HydrophobicContact CE1-CG 3.48Å; Y144-K170 VanDerWaalsContact CE1-CG 3.48Å
145	D	94.8	Very high	96.5	Very high	73 Å²	73	59.9 Å²	59.9	39%	0.39	27%	0.268	S	S	.	.			trans	-132.1	-177.1	-177.3	65.3	25.6	0	0	0	112.6	E143 E147 T148 V149	E143-D145 PolarHBondContact O-N 2.89Å; D145-E147 VanDerWaalsContact C-N 3.26Å; D145-E147 PolarHBondContact O-N 3.21Å; D145-E147 WeakPolarHBondContact OD1-CA 3.5Å; D145-E147 WeakPolarHBondContact OD1-CB 3.35Å; D145-E147 PolarHBondContact OD1-N 2.86Å; D145-T148 PolarHBondContact N-OG1 3.34Å; D145-T148 PolarHBondContact O-N 3.14Å; D145-T148 PolarHBondContact O-OG1 3.09Å; D145-T148 WeakPolarHBondContact OD1-CG2 3.29Å; D145-T148 PolarHBondContact OD1-N 3.3Å; D145-V149 PolarHBondContact O-N 3.46Å
146	E	94.4	Very high	96.5	Very high	98 Å²	98	55 Å²	55	46%	0.458	25%	0.245	S	C	.	.	H	α-helix	trans	-64.8	-27.9	179	-57.9	-179.7	-177.4	0	0	113.6	V149 R150	E146-V149 PolarHBondContact O-N 3.23Å; E146-R150 VanDerWaalsContact CB-NH1 3.33Å; E146-R150 WeakPolarHBondContact O-CB 3.5Å; E146-R150 WeakPolarHBondContact O-CG 3.45Å; E146-R150 PolarHBondContact O-N 2.82Å; E146-R150 IonicContact OE2-NH1 3.58Å; E146-R150 PolarHBondContact OE2-NH1 2.78Å; E146-R150 VanDerWaalsContact OE2-NH1 3.12Å
147	E	96.3	Very high	96.5	Very high	123 Å²	123	54.2 Å²	54.2	58%	0.575	24%	0.24	S	C	*	.	H	α-helix	trans	-69.2	-43.4	178.4	-169	-176	154.6	0	0	110.4	D145 V149 R150 W151	D145-E147 VanDerWaalsContact C-N 3.26Å; D145-E147 PolarHBondContact O-N 3.21Å; D145-E147 WeakPolarHBondContact OD1-CA 3.5Å; D145-E147 WeakPolarHBondContact OD1-CB 3.35Å; D145-E147 PolarHBondContact OD1-N 2.86Å; E147-V149 VanDerWaalsContact C-N 3.28Å; E147-V149 PolarHBondContact O-N 3.48Å; E147-R150 PolarHBondContact O-N 2.84Å; E147-W151 PolarHBondContact O-N 2.96Å
148	T	96.6	Very high	96.4	Very high	14 Å²	14	49.8 Å²	49.8	9%	0.086	22%	0.223	C	C	.	.	H	α-helix	trans	-58.8	-41.8	174	66.6	0	0	0	0	111.6	V72 V139 E143 Y144 D145 W151 A152	V72-T148 WeakPolarHBondContact CG2-O 3.02Å; V139-T148 HydrophobicContact CG1-CG2 4.27Å; E143-T148 WeakPolarHBondContact O-CG2 3.38Å; Y144-T148 VanDerWaalsContact CD2-OG1 3.29Å; Y144-T148 WeakPolarHBondContact CD2-OG1 3.46Å; D145-T148 PolarHBondContact N-OG1 3.34Å; D145-T148 PolarHBondContact O-N 3.14Å; D145-T148 PolarHBondContact O-OG1 3.09Å; D145-T148 WeakPolarHBondContact OD1-CG2 3.29Å; D145-T148 PolarHBondContact OD1-N 3.3Å; T148-W151 PolarHBondContact O-N 2.93Å; T148-A152 PolarHBondContact O-N 3.13Å
149	V	97.4	Very high	96.3	Very high	10 Å²	10	45.8 Å²	45.8	6%	0.061	20%	0.203	C	C	.	.	H	α-helix	trans	-66.4	-42.1	177.1	175.1	0	0	0	0	112.2	Y144 D145 E146 E147 W151 A152 K170 V171 K176	Y144-V149 HydrophobicContact CE2-CG2 3.59Å; Y144-V149 WeakPolarHBondContact OH-CG2 3.35Å; D145-V149 PolarHBondContact O-N 3.46Å; E146-V149 PolarHBondContact O-N 3.23Å; E147-V149 VanDerWaalsContact C-N 3.28Å; E147-V149 PolarHBondContact O-N 3.48Å; V149-W151 VanDerWaalsContact C-N 3.31Å; V149-W151 PolarHBondContact O-N 2.89Å; V149-A152 PolarHBondContact O-N 2.96Å; V149-K170 HydrophobicContact CG2-CB 3.89Å; V149-V171 HydrophobicContact CG1-CG2 3.87Å; V149-V171 HydrophobicContact CG2-CG2 4.23Å; V149-K176 HydrophobicContact CG1-CG 4.39Å; V149-K176 PolarHBondContact O-NZ 2.66Å
150	R	97.4	Very high	96.2	Very high	152 Å²	152	45.8 Å²	45.8	57%	0.574	21%	0.205	S	C	*	.	H	α-helix	trans	-63.3	-38.1	177.8	-78.9	-172.5	-63.7	-95.2	0.4	111.9	E146 E147	E146-R150 VanDerWaalsContact CB-NH1 3.33Å; E146-R150 WeakPolarHBondContact O-CB 3.5Å; E146-R150 WeakPolarHBondContact O-CG 3.45Å; E146-R150 PolarHBondContact O-N 2.82Å; E146-R150 IonicContact OE2-NH1 3.58Å; E146-R150 PolarHBondContact OE2-NH1 2.78Å; E146-R150 VanDerWaalsContact OE2-NH1 3.12Å; E147-R150 PolarHBondContact O-N 2.84Å
151	W	98.1	Very high	96.2	Very high	31 Å²	31	44.6 Å²	44.6	12%	0.117	20%	0.201	C	C	.	.	H	α-helix	trans	-66.6	-37.4	-179.9	170.8	88.1	0	0	0	113.6	R70 V72 E135 R137 E147 T148 V149	R70-W151 HydrophobicContact CB-CD2 4.45Å; R70-W151 HydrophobicContact CB-CE3 4.36Å; R70-W151 HydrophobicContact CB-CH2 3.75Å; R70-W151 HydrophobicContact CB-CZ2 3.85Å; R70-W151 HydrophobicContact CB-CZ3 4.02Å; R70-W151 HydrophobicContact CG-CH2 4.15Å; R70-W151 HydrophobicContact CG-CZ2 3.78Å; R70-W151 PolarHBondContact NE-O 3.24Å; R70-W151 PolarHBondContact NH1-O 3.08Å; R70-W151 PolarHBondContact NH2-O 3.04Å; V72-W151 HydrophobicContact CG2-CE3 3.67Å; V72-W151 HydrophobicContact CG2-CZ3 3.72Å; E135-W151 HydrophobicContact CB-CZ2 4.36Å; E135-W151 HydrophobicContact CG-CH2 4.23Å; E135-W151 HydrophobicContact CG-CZ2 3.85Å; E135-W151 WeakPolarHBondContact OE1-CZ2 3.35Å; R137-W151 HydrophobicContact CB-CE3 4.49Å; R137-W151 HydrophobicContact CB-CH2 4.11Å; R137-W151 HydrophobicContact CB-CZ3 3.86Å; R137-W151 HydrophobicContact CG-CE3 4.18Å; R137-W151 HydrophobicContact CG-CH2 3.57Å; R137-W151 HydrophobicContact CG-CZ2 3.96Å; R137-W151 HydrophobicContact CG-CZ3 3.69Å; R137-W151 VanDerWaalsContact CZ-CD1 3.42Å; R137-W151 VanDerWaalsContact CZ-CE2 3.45Å; R137-W151 VanDerWaalsContact NH2-CD1 3.29Å; R137-W151 VanDerWaalsContact NH2-NE1 3.15Å; E147-W151 PolarHBondContact O-N 2.96Å; T148-W151 PolarHBondContact O-N 2.93Å; V149-W151 VanDerWaalsContact C-N 3.31Å; V149-W151 PolarHBondContact O-N 2.89Å
152	A	98.1	Very high	96.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.215	C	C	.	.			trans	-83.4	151.8	-172.8	0	0	0	0	0	113.4	V72 T148 V149 A154 K176	V72-A152 HydrophobicContact CB-CB 4.06Å; V72-A152 HydrophobicContact CG2-CB 3.83Å; T148-A152 PolarHBondContact O-N 3.13Å; V149-A152 PolarHBondContact O-N 2.96Å; A152-A154 VanDerWaalsContact CB-O 3.31Å; A152-A154 WeakPolarHBondContact CB-O 3.35Å; A152-K176 WeakPolarHBondContact O-CD 3.41Å; A152-K176 PolarHBondContact O-NZ 3.23Å
153	D	98.3	Very high	96.6	Very high	47 Å²	47	37.4 Å²	37.4	25%	0.251	19%	0.19	S	C	.	.	S	Bend	trans	-84.7	-23.2	168.2	-50.6	-39.9	0	0	0	111.4	P68 S69 R70 P177	P68-D153 HydrophobicContact CB-CB 3.96Å; S69-D153 WeakPolarHBondContact CA-OD2 3.36Å; S69-D153 PolarHBondContact N-OD2 3.47Å; R70-D153 PolarHBondContact N-OD2 3.44Å; R70-D153 IonicContact NH2-OD1 2.67Å; R70-D153 PolarHBondContact O-N 3.3Å; D153-P177 VanDerWaalsContact O-CD 3.28Å; D153-P177 WeakPolarHBondContact O-CD 3.45Å
154	A	98.4	Very high	96.7	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.008	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	152.1	176	0	0	0	0	0	111.3	F66 P68 R70 V71 V72 A152	F66-A154 HydrophobicContact CE1-CB 4.12Å; F66-A154 HydrophobicContact CZ-CB 3.69Å; P68-A154 HydrophobicContact CB-CB 4.24Å; R70-A154 PolarHBondContact O-N 2.78Å; V71-A154 WeakPolarHBondContact CA-O 3.23Å; V71-A154 HydrophobicContact CG2-CB 4.18Å; V72-A154 PolarHBondContact N-O 2.82Å; A152-A154 VanDerWaalsContact CB-O 3.31Å; A152-A154 WeakPolarHBondContact CB-O 3.35Å
155	V	98.8	Very high	96.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	127.6	171	-176	0	0	0	0	109.3	V74 Y144 A167 V171 P177 V178 I179	V74-V155 HydrophobicContact CG2-CG1 3.75Å; Y144-V155 HydrophobicContact CE2-CG1 4.37Å; V155-A167 HydrophobicContact CG1-CB 3.94Å; V155-V171 HydrophobicContact CG2-CG2 4.11Å; V155-P177 PolarHBondContact N-O 2.98Å; V155-V178 HydrophobicContact CB-CG1 4.32Å; V155-V178 HydrophobicContact CB-CG2 4.38Å; V155-V178 HydrophobicContact CG1-CG1 4.44Å; V155-V178 CarbonylContact O-C 3.54Å; V155-V178 VanDerWaalsContact O-CA 3.32Å; V155-V178 WeakPolarHBondContact O-CA 3.48Å; V155-I179 PolarHBondContact O-N 3.03Å
156	I	98.7	Very high	96.8	Very high	4 Å²	4	30 Å²	30	2%	0.021	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	119.2	172.4	-64.6	178.1	0	0	0	109	V71 V72 V73 V74 I125 L129 I179 V181 F202	V71-I156 HydrophobicContact CG1-CB 4.34Å; V71-I156 HydrophobicContact CG1-CD1 3.63Å; V71-I156 HydrophobicContact CG1-CG1 3.75Å; V72-I156 PolarHBondContact O-N 2.87Å; V73-I156 CarbonylContact C-O 3.59Å; V73-I156 WeakPolarHBondContact CA-O 3.3Å; V73-I156 HydrophobicContact CG2-CB 4.31Å; V74-I156 PolarHBondContact N-O 3.48Å; I125-I156 HydrophobicContact CG2-CD1 4.38Å; I125-I156 HydrophobicContact CG2-CG2 4.3Å; L129-I156 HydrophobicContact CD1-CD1 3.84Å; L129-I156 HydrophobicContact CD2-CD1 4.15Å; I156-I179 CarbonylContact C-O 3.49Å; I156-I179 VanDerWaalsContact CA-O 3.26Å; I156-I179 WeakPolarHBondContact CA-O 3.29Å; I156-I179 HydrophobicContact CG1-CB 4.28Å; I156-V181 HydrophobicContact CG2-CG2 3.96Å; I156-F202 HydrophobicContact CD1-CE1 4.49Å; I156-F202 HydrophobicContact CD1-CZ 3.79Å
157	A	98.4	Very high	96.9	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.008	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	105.5	170.4	0	0	0	0	0	109.5	G159 T163 M164 A167 I179 V181	A157-G159 PolarHBondContact O-N 3.41Å; A157-T163 HydrophobicContact CB-CG2 4.08Å; A157-M164 HydrophobicContact CB-CB 4.19Å; A157-M164 HydrophobicContact CB-SD 4.08Å; A157-A167 HydrophobicContact CB-CB 3.84Å; A157-I179 PolarHBondContact N-O 3.35Å; A157-V181 PolarHBondContact O-N 2.82Å
158	A	98.2	Very high	97	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	89.2	179.8	0	0	0	0	0	110.4	V73 V74 K76 V122 I125 T183	V73-A158 HydrophobicContact CG1-CB 3.74Å; V74-A158 PolarHBondContact O-N 3.31Å; K76-A158 PolarHBondContact N-O 3.43Å; V122-A158 HydrophobicContact CG2-CB 3.96Å; I125-A158 HydrophobicContact CD1-CB 4.02Å; A158-T183 HydrophobicContact CB-CG2 3.86Å
159	G	96.4	Very high	96.9	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.109	C	C	.	.	S	Bend	trans	167.7	-165.6	-169.1	0	0	0	0	0	111.7	A157 V181 N182 T183	A157-G159 PolarHBondContact O-N 3.41Å; G159-V181 PolarHBondContact N-O 3.5Å; G159-V181 CarbonylContact O-C 3.45Å; G159-N182 VanDerWaalsContact O-CA 3.26Å; G159-N182 WeakPolarHBondContact O-CA 3.47Å; G159-T183 WeakPolarHBondContact CA-OG1 3.49Å; G159-T183 PolarHBondContact N-OG1 3.08Å
160	G	94.6	Very high	96.8	Very high	11 Å²	11	23.5 Å²	23.5	11%	0.113	12%	0.124	C	C	.	.	S	Bend	trans	-85.1	-166.6	173.2	0	0	0	0	0	112.4	G162 T163 M164	G160-G162 PolarHBondContact O-N 3.35Å; G160-T163 WeakPolarHBondContact O-CB 3.35Å; G160-T163 PolarHBondContact O-N 3.25Å; G160-M164 PolarHBondContact O-N 3.48Å
161	D	94.3	Very high	96.8	Very high	35 Å²	35	16.2 Å²	16.2	19%	0.187	10%	0.096	C	C	.	.	H	α-helix	trans	-56	-36.3	179.8	-70.2	-15.7	0	0	0	113	T163 M164 L165 G190 H191 L192	D161-T163 VanDerWaalsContact C-N 3.3Å; D161-T163 PolarHBondContact O-N 3.16Å; D161-M164 CarbonylContact O-C 3.57Å; D161-M164 WeakPolarHBondContact O-CA 3.34Å; D161-M164 WeakPolarHBondContact O-CB 3.15Å; D161-M164 PolarHBondContact O-N 2.91Å; D161-L165 WeakPolarHBondContact O-CG 3.29Å; D161-L165 PolarHBondContact O-N 3.31Å; D161-G190 VanDerWaalsContact OD1-C 3.24Å; D161-G190 VanDerWaalsContact OD1-CA 3.29Å; D161-G190 WeakPolarHBondContact OD1-CA 3.46Å; D161-H191 PolarHBondContact OD1-N 3.41Å; D161-H191 IonicContact OD2-CD2 3.65Å; D161-H191 PolarHBondContact OD2-N 3.11Å; D161-H191 VanDerWaalsContact OD2-N 3.08Å; D161-L192 HydrophobicContact CB-CD1 4.15Å; D161-L192 HydrophobicContact CB-CG 4.26Å; D161-L192 WeakPolarHBondContact OD1-CB 3.37Å; D161-L192 PolarHBondContact OD1-N 3.12Å
162	G	93.7	Very high	96.7	Very high	47 Å²	47	18.3 Å²	18.3	49%	0.485	11%	0.109	S	C	.	.	H	α-helix	trans	-63.2	-32	176.1	0	0	0	0	0	114.1	G160 M164 L166	G160-G162 PolarHBondContact O-N 3.35Å; G162-M164 VanDerWaalsContact C-N 3.35Å; G162-L166 PolarHBondContact O-N 2.75Å; G162-L166 VanDerWaalsContact O-N 3.11Å
163	T	95.8	Very high	96.5	Very high	12 Å²	12	22.3 Å²	22.3	7%	0.074	13%	0.131	C	C	.	.	H	α-helix	trans	-72.7	-33.9	173.1	-55.5	0	0	0	0	110.7	V74 K76 A157 G160 D161 L166 A167	V74-T163 HydrophobicContact CG1-CG2 4.42Å; V74-T163 VanDerWaalsContact O-CG2 3.31Å; V74-T163 WeakPolarHBondContact O-CG2 3.07Å; K76-T163 VanDerWaalsContact CB-OG1 3.31Å; K76-T163 WeakPolarHBondContact CB-OG1 3.15Å; A157-T163 HydrophobicContact CB-CG2 4.08Å; G160-T163 WeakPolarHBondContact O-CB 3.35Å; G160-T163 PolarHBondContact O-N 3.25Å; D161-T163 VanDerWaalsContact C-N 3.3Å; D161-T163 PolarHBondContact O-N 3.16Å; T163-L166 PolarHBondContact O-N 3.15Å; T163-A167 WeakPolarHBondContact O-CB 3.47Å; T163-A167 PolarHBondContact O-N 2.69Å
164	M	96.9	Very high	96.4	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-66.6	-40.5	174.2	-179.6	55.4	-138	0	0	112	A157 G160 D161 G162 A167 A168 V178 L192 L275 L435 T437	A157-M164 HydrophobicContact CB-CB 4.19Å; A157-M164 HydrophobicContact CB-SD 4.08Å; G160-M164 PolarHBondContact O-N 3.48Å; D161-M164 CarbonylContact O-C 3.57Å; D161-M164 WeakPolarHBondContact O-CA 3.34Å; D161-M164 WeakPolarHBondContact O-CB 3.15Å; D161-M164 PolarHBondContact O-N 2.91Å; G162-M164 VanDerWaalsContact C-N 3.35Å; M164-A167 PolarHBondContact O-N 2.88Å; M164-A168 HydrophobicContact CE-CB 4.07Å; M164-A168 WeakPolarHBondContact O-CB 3.38Å; M164-A168 PolarHBondContact O-N 2.81Å; M164-V178 HydrophobicContact CE-CB 3.74Å; M164-V178 HydrophobicContact CE-CG1 3.32Å; M164-V178 HydrophobicContact SD-CB 4.39Å; M164-V178 HydrophobicContact SD-CG1 3.51Å; M164-V178 VanDerWaalsContact SD-CG1 3.51Å; M164-L192 HydrophobicContact CB-CB 4.18Å; M164-L192 HydrophobicContact CB-CD1 4.26Å; M164-L192 HydrophobicContact CG-CB 3.66Å; M164-L192 HydrophobicContact CG-CD1 3.93Å; M164-L192 HydrophobicContact CG-CG 4.46Å; M164-L275 HydrophobicContact CE-CD2 4.27Å; M164-L435 HydrophobicContact CE-CD2 3.7Å; M164-T437 HydrophobicContact CE-CG2 4.18Å
165	L	96.9	Very high	96.3	Very high	25 Å²	25	29.4 Å²	29.4	13%	0.131	16%	0.16	C	C	.	.	H	α-helix	trans	-62	-44.1	172.3	-64.5	176.1	0	0	0	111.8	D161 A167 A168 S169 L192 L275 N276 D412	D161-L165 WeakPolarHBondContact O-CG 3.29Å; D161-L165 PolarHBondContact O-N 3.31Å; L165-A167 PolarHBondContact O-N 2.93Å; L165-A168 PolarHBondContact O-N 3.49Å; L165-S169 WeakPolarHBondContact O-CB 3Å; L165-S169 PolarHBondContact O-N 3.07Å; L165-L192 HydrophobicContact CD2-CD1 4.18Å; L165-L275 HydrophobicContact CD2-CB 4.04Å; L165-L275 HydrophobicContact CD2-CD2 4.07Å; L165-L275 HydrophobicContact CD2-CG 4.28Å; L165-N276 HydrophobicContact CD2-CB 4.35Å; L165-D412 HydrophobicContact CD1-CB 4.27Å; L165-D412 HydrophobicContact CD2-CB 4.31Å
166	L	95.4	Very high	96.2	Very high	18 Å²	18	30.7 Å²	30.7	9%	0.094	17%	0.165	C	C	.	.	H	α-helix	trans	-57.2	-50.1	173.9	172.4	61.9	0	0	0	111.3	V74 R141 Y144 G162 T163 A168 S169	V74-L166 HydrophobicContact CG1-CD2 4.04Å; V74-L166 HydrophobicContact CG1-CG 4.43Å; R141-L166 HydrophobicContact CB-CD2 3.84Å; R141-L166 HydrophobicContact CG-CD1 4.25Å; R141-L166 HydrophobicContact CG-CD2 4.15Å; Y144-L166 HydrophobicContact CD1-CD1 4.22Å; Y144-L166 HydrophobicContact CD1-CG 4.23Å; Y144-L166 WeakPolarHBondContact CE1-O 3.29Å; G162-L166 PolarHBondContact O-N 2.75Å; G162-L166 VanDerWaalsContact O-N 3.11Å; T163-L166 PolarHBondContact O-N 3.15Å; L166-A168 PolarHBondContact O-N 2.76Å; L166-S169 WeakPolarHBondContact O-CB 3.18Å; L166-S169 PolarHBondContact O-N 3.03Å; L166-S169 PolarHBondContact O-OG 3.32Å
167	A	97.2	Very high	96.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.3	-42.6	178	0	0	0	0	0	112.2	V74 Y144 V155 A157 T163 M164 L165 S169 V171 V178	V74-A167 HydrophobicContact CG2-CB 4.41Å; Y144-A167 PolarHBondContact OH-O 2.62Å; V155-A167 HydrophobicContact CG1-CB 3.94Å; A157-A167 HydrophobicContact CB-CB 3.84Å; T163-A167 WeakPolarHBondContact O-CB 3.47Å; T163-A167 PolarHBondContact O-N 2.69Å; M164-A167 PolarHBondContact O-N 2.88Å; L165-A167 PolarHBondContact O-N 2.93Å; A167-S169 VanDerWaalsContact C-N 3.28Å; A167-S169 PolarHBondContact O-N 2.85Å; A167-V171 WeakPolarHBondContact O-CG2 3.4Å; A167-V178 HydrophobicContact CB-CG1 3.84Å
168	A	97.4	Very high	96.2	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.008	16%	0.164	C	C	.	.	H	α-helix	trans	-62.6	-33.8	176.9	0	0	0	0	0	113.2	M164 L165 L166 K170 V171 R221 L275 L435	M164-A168 HydrophobicContact CE-CB 4.07Å; M164-A168 WeakPolarHBondContact O-CB 3.38Å; M164-A168 PolarHBondContact O-N 2.81Å; L165-A168 PolarHBondContact O-N 3.49Å; L166-A168 PolarHBondContact O-N 2.76Å; A168-K170 PolarHBondContact O-N 2.84Å; A168-V171 PolarHBondContact O-N 3.01Å; A168-V171 VanDerWaalsContact O-N 3.14Å; A168-R221 PolarHBondContact O-NH1 3.43Å; A168-L275 HydrophobicContact CB-CD2 3.87Å; A168-L435 HydrophobicContact CB-CD1 4.45Å; A168-L435 HydrophobicContact CB-CD2 3.6Å
169	S	94.9	Very high	96.2	Very high	21 Å²	21	30.7 Å²	30.7	15%	0.147	17%	0.165	C	C	.	.	H	α-helix	trans	-62.4	-26.4	-170.9	74.1	0	0	0	0	114.5	L165 L166 A167	L165-S169 WeakPolarHBondContact O-CB 3Å; L165-S169 PolarHBondContact O-N 3.07Å; L166-S169 WeakPolarHBondContact O-CB 3.18Å; L166-S169 PolarHBondContact O-N 3.03Å; L166-S169 PolarHBondContact O-OG 3.32Å; A167-S169 VanDerWaalsContact C-N 3.28Å; A167-S169 PolarHBondContact O-N 2.85Å
170	K	95.1	Very high	96.3	Very high	86 Å²	86	30.9 Å²	30.9	37%	0.374	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-2.6	-179.5	-55.8	-59	-176.5	177.2	0	113.3	Y144 V149 A168 L172	Y144-K170 HydrophobicContact CD1-CB 4.44Å; Y144-K170 HydrophobicContact CD1-CG 3.84Å; Y144-K170 HydrophobicContact CE1-CB 3.66Å; Y144-K170 HydrophobicContact CE1-CG 3.48Å; Y144-K170 VanDerWaalsContact CE1-CG 3.48Å; V149-K170 HydrophobicContact CG2-CB 3.89Å; A168-K170 PolarHBondContact O-N 2.84Å; K170-L172 PolarHBondContact O-N 2.75Å
171	V	97.3	Very high	96.4	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.162	C	C	.	.			trans	-95.4	93.6	-177.4	176.4	0	0	0	0	110	V149 V155 A167 A168 K176 V178 R221 L435	V149-V171 HydrophobicContact CG1-CG2 3.87Å; V149-V171 HydrophobicContact CG2-CG2 4.23Å; V155-V171 HydrophobicContact CG2-CG2 4.11Å; A167-V171 WeakPolarHBondContact O-CG2 3.4Å; A168-V171 PolarHBondContact O-N 3.01Å; A168-V171 VanDerWaalsContact O-N 3.14Å; V171-K176 HydrophobicContact CG1-CB 3.63Å; V171-K176 HydrophobicContact CG1-CG 3.97Å; V171-V178 HydrophobicContact CB-CG2 4.11Å; V171-V178 HydrophobicContact CG1-CG2 4.03Å; V171-V178 HydrophobicContact CG2-CG2 3.75Å; V171-R221 PolarHBondContact O-NH1 2.85Å; V171-R221 PolarHBondContact O-NH2 3.08Å; V171-R221 VanDerWaalsContact O-NH2 3.13Å; V171-L435 HydrophobicContact CB-CD1 4.18Å; V171-L435 HydrophobicContact CG1-CD1 3.95Å
172	L	95.4	Very high	96.6	Very high	75 Å²	75	28.9 Å²	28.9	39%	0.393	15%	0.154	S	C	.	.			trans	-91.9	-23.6	179.5	-59.8	-178.2	0	0	0	113.4	K170 R174 R273	K170-L172 PolarHBondContact O-N 2.75Å; L172-R174 PolarHBondContact O-N 2.78Å; L172-R273 HydrophobicContact CD2-CG 4.34Å
173	D	95.3	Very high	96.7	Very high	84 Å²	84	26.6 Å²	26.6	45%	0.449	13%	0.131	S	C	.	.			trans	-75.1	113.5	172.9	174.6	11.2	0	0	0	110.3	L175 K176	D173-L175 PolarHBondContact O-N 3.44Å; D173-L175 VanDerWaalsContact O-N 3.11Å; D173-L175 WeakPolarHBondContact OD1-CB 3.33Å; D173-L175 PolarHBondContact OD1-N 2.87Å; D173-K176 HydrophobicContact CB-CB 4.24Å; D173-K176 WeakPolarHBondContact O-CB 3.49Å; D173-K176 PolarHBondContact O-N 3.16Å
174	R	95.5	Very high	96.6	Very high	110 Å²	110	26.3 Å²	26.3	42%	0.415	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-26.3	178.5	78.4	176.7	-157.4	-120.3	-1.1	113.4	L172 K176 W218 E434 R436	L172-R174 PolarHBondContact O-N 2.78Å; R174-K176 VanDerWaalsContact C-N 3.32Å; R174-W218 WeakPolarHBondContact O-CZ3 3.38Å; R174-E434 WeakPolarHBondContact CA-O 3.41Å; R174-E434 VanDerWaalsContact CB-O 3.27Å; R174-E434 WeakPolarHBondContact CB-O 3.39Å; R174-R436 VanDerWaalsContact O-CB 3.28Å; R174-R436 WeakPolarHBondContact O-CB 3.41Å
175	L	96.1	Very high	96.4	Very high	87 Å²	87	27.6 Å²	27.6	46%	0.455	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-3.3	179.1	-58.5	-176.7	0	0	0	112.2	D173 P177 W218 R436	D173-L175 PolarHBondContact O-N 3.44Å; D173-L175 VanDerWaalsContact O-N 3.11Å; D173-L175 WeakPolarHBondContact OD1-CB 3.33Å; D173-L175 PolarHBondContact OD1-N 2.87Å; L175-P177 VanDerWaalsContact O-CD 3.27Å; L175-P177 WeakPolarHBondContact O-CD 3.44Å; L175-W218 HydrophobicContact CD2-CH2 4.04Å; L175-R436 PolarHBondContact O-NE 2.96Å; L175-R436 VanDerWaalsContact O-NE 3.13Å; L175-R436 PolarHBondContact O-NH2 2.74Å
176	K	97.5	Very high	96	Very high	26 Å²	26	33.7 Å²	33.7	11%	0.113	17%	0.165	C	C	.	.	S	Bend	trans	-83.4	114.6	175.1	-170.3	73.8	52.5	140.3	0	110	V149 A152 V171 D173 R174	V149-K176 HydrophobicContact CG1-CG 4.39Å; V149-K176 PolarHBondContact O-NZ 2.66Å; A152-K176 WeakPolarHBondContact O-CD 3.41Å; A152-K176 PolarHBondContact O-NZ 3.23Å; V171-K176 HydrophobicContact CG1-CB 3.63Å; V171-K176 HydrophobicContact CG1-CG 3.97Å; D173-K176 HydrophobicContact CB-CB 4.24Å; D173-K176 WeakPolarHBondContact O-CB 3.49Å; D173-K176 PolarHBondContact O-N 3.16Å; R174-K176 VanDerWaalsContact C-N 3.32Å
177	P	97.8	Very high	95.5	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	19%	0.194	C	C	.	.			trans	-66.7	140.4	176.8	-17.7	32.4	0	0	0	112.1	F66 D153 V155 L175 W216 R436	F66-P177 HydrophobicContact CE1-CG 4.49Å; F66-P177 HydrophobicContact CE2-CG 3.82Å; F66-P177 HydrophobicContact CZ-CB 4.28Å; F66-P177 HydrophobicContact CZ-CG 3.72Å; D153-P177 VanDerWaalsContact O-CD 3.28Å; D153-P177 WeakPolarHBondContact O-CD 3.45Å; V155-P177 PolarHBondContact N-O 2.98Å; L175-P177 VanDerWaalsContact O-CD 3.27Å; L175-P177 WeakPolarHBondContact O-CD 3.44Å; P177-W216 HydrophobicContact CB-CH2 4.07Å; P177-W216 HydrophobicContact CB-CZ3 3.85Å; P177-W216 HydrophobicContact CG-CH2 3.87Å; P177-W216 HydrophobicContact CG-CZ3 4.08Å; P177-R436 WeakPolarHBondContact CA-O 3.31Å
178	V	98.5	Very high	94.8	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	127.3	166.2	-167.4	0	0	0	0	109.6	V155 M164 A167 V171 L435 R436 T437	V155-V178 HydrophobicContact CB-CG1 4.32Å; V155-V178 HydrophobicContact CB-CG2 4.38Å; V155-V178 HydrophobicContact CG1-CG1 4.44Å; V155-V178 CarbonylContact O-C 3.54Å; V155-V178 VanDerWaalsContact O-CA 3.32Å; V155-V178 WeakPolarHBondContact O-CA 3.48Å; M164-V178 HydrophobicContact CE-CB 3.74Å; M164-V178 HydrophobicContact CE-CG1 3.32Å; M164-V178 HydrophobicContact SD-CB 4.39Å; M164-V178 HydrophobicContact SD-CG1 3.51Å; M164-V178 VanDerWaalsContact SD-CG1 3.51Å; A167-V178 HydrophobicContact CB-CG1 3.84Å; V171-V178 HydrophobicContact CB-CG2 4.11Å; V171-V178 HydrophobicContact CG1-CG2 4.03Å; V171-V178 HydrophobicContact CG2-CG2 3.75Å; V178-L435 HydrophobicContact CG2-CD1 3.8Å; V178-L435 HydrophobicContact CG2-CG 4.47Å; V178-R436 PolarHBondContact N-O 2.9Å; V178-T437 WeakPolarHBondContact O-CA 3.44Å; V178-T437 WeakPolarHBondContact O-CG2 3.45Å
179	I	98.4	Very high	94	Very high	6 Å²	6	50.4 Å²	50.4	3%	0.031	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	117.7	-174	-56.8	170.9	0	0	0	108.3	F66 V155 I156 A157 V181 L194 F209 V438	F66-I179 HydrophobicContact CE1-CD1 4.23Å; V155-I179 PolarHBondContact O-N 3.03Å; I156-I179 CarbonylContact C-O 3.49Å; I156-I179 VanDerWaalsContact CA-O 3.26Å; I156-I179 WeakPolarHBondContact CA-O 3.29Å; I156-I179 HydrophobicContact CG1-CB 4.28Å; A157-I179 PolarHBondContact N-O 3.35Å; I179-V181 HydrophobicContact CG2-CG2 4.49Å; I179-L194 HydrophobicContact CG2-CD1 3.87Å; I179-L194 HydrophobicContact CG2-CD2 4.27Å; I179-L194 HydrophobicContact CG2-CG 4.05Å; I179-F209 HydrophobicContact CD1-CE2 4.03Å; I179-F209 HydrophobicContact CD1-CZ 4.44Å; I179-F209 HydrophobicContact CG2-CZ 4.38Å; I179-V438 HydrophobicContact CD1-CG2 4.18Å; I179-V438 HydrophobicContact CG1-CG2 3.9Å
180	G	97.8	Very high	93.5	Very high	3 Å²	3	50.3 Å²	50.3	3%	0.031	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	131	175.8	0	0	0	0	0	111.9	C193 L194	G180-C193 CarbonylContact O-C 3.54Å; G180-C193 VanDerWaalsContact O-CA 3.28Å; G180-C193 WeakPolarHBondContact O-CA 3.26Å; G180-L194 WeakPolarHBondContact O-CG 3.41Å; G180-L194 PolarHBondContact O-N 3.15Å
181	V	97.9	Very high	93.2	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.006	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	117.3	171.7	-173.5	0	0	0	0	108.7	I125 I156 A157 G159 I179 T183 L194 F202	I125-V181 HydrophobicContact CD1-CB 3.84Å; I125-V181 HydrophobicContact CD1-CG1 3.62Å; I125-V181 HydrophobicContact CD1-CG2 4.37Å; I125-V181 HydrophobicContact CG1-CG1 4.23Å; I156-V181 HydrophobicContact CG2-CG2 3.96Å; A157-V181 PolarHBondContact O-N 2.82Å; G159-V181 PolarHBondContact N-O 3.5Å; G159-V181 CarbonylContact O-C 3.45Å; I179-V181 HydrophobicContact CG2-CG2 4.49Å; V181-T183 PolarHBondContact O-N 3.3Å; V181-L194 HydrophobicContact CG2-CD1 4.18Å; V181-F202 HydrophobicContact CG1-CD2 4.44Å; V181-F202 HydrophobicContact CG2-CD2 4.03Å; V181-F202 HydrophobicContact CG2-CE2 3.63Å
182	N	96.8	Very high	93.1	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.016	25%	0.247	C	C	.	.			trans	-71	118	179	-168.8	-14.8	0	0	0	110.6	G159 D184 P185 S188 C193 T199	G159-N182 VanDerWaalsContact O-CA 3.26Å; G159-N182 WeakPolarHBondContact O-CA 3.47Å; N182-D184 VanDerWaalsContact OD1-C 3.3Å; N182-D184 PolarHBondContact OD1-N 2.95Å; N182-D184 PolarHBondContact OD1-O 3.28Å; N182-P185 WeakPolarHBondContact ND2-CA 3.35Å; N182-S188 PolarHBondContact ND2-O 3.03Å; N182-C193 HydrophobicContact CB-CB 4.11Å; N182-T199 WeakPolarHBondContact O-CB 3.33Å; N182-T199 WeakPolarHBondContact O-CG2 3.29Å; N182-T199 PolarHBondContact O-OG1 3.05Å
183	T	96.7	Very high	93.1	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.235	C	C	.	.	S	Bend	trans	-93.3	-3.3	-177.7	51.3	0	0	0	0	114.3	H118 N121 V122 I125 A158 G159 V181	H118-T183 PolarHBondContact CE1-OG1 2.6Å; H118-T183 WeakPolarHBondContact ND1-CB 3.29Å; H118-T183 PolarHBondContact ND1-O 3.17Å; H118-T183 PolarHBondContact ND1-OG1 3.06Å; N121-T183 HydrophobicContact CB-CG2 4.2Å; N121-T183 PolarHBondContact ND2-O 3.21Å; V122-T183 HydrophobicContact CG2-CG2 3.92Å; I125-T183 HydrophobicContact CD1-CG2 4.18Å; A158-T183 HydrophobicContact CB-CG2 3.86Å; G159-T183 WeakPolarHBondContact CA-OG1 3.49Å; G159-T183 PolarHBondContact N-OG1 3.08Å; V181-T183 PolarHBondContact O-N 3.3Å
184	D	94.8	Very high	93.1	Very high	5 Å²	5	45.3 Å²	45.3	3%	0.027	22%	0.216	C	C	.	.			trans	-149.7	75.1	167.7	-173.9	3.4	0	0	0	110.3	R114 I117 H118 N182 E186 R187 S188	R114-D184 WeakPolarHBondContact CD-OD2 3.24Å; R114-D184 IonicContact NH1-OD1 3.81Å; R114-D184 PolarHBondContact NH1-OD1 2.88Å; R114-D184 IonicContact NH1-OD2 3.5Å; R114-D184 PolarHBondContact NH1-OD2 3.07Å; I117-D184 HydrophobicContact CG2-CB 4.3Å; H118-D184 WeakPolarHBondContact CE1-CB 3.41Å; H118-D184 WeakPolarHBondContact NE2-CB 3.49Å; H118-D184 IonicContact NE2-OD2 3.6Å; N182-D184 VanDerWaalsContact OD1-C 3.3Å; N182-D184 PolarHBondContact OD1-N 2.95Å; N182-D184 PolarHBondContact OD1-O 3.28Å; D184-E186 PolarHBondContact O-N 2.91Å; D184-R187 PolarHBondContact O-N 2.76Å; D184-S188 PolarHBondContact O-N 3.48Å; D184-S188 PolarHBondContact O-OG 2.95Å; D184-S188 VanDerWaalsContact O-OG 3.04Å
185	P	91	Very high	93.1	Very high	28 Å²	28	41.4 Å²	41.4	18%	0.182	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-16.8	-175.7	27.8	-35	0	0	0	114.1	N182 R187 V196 T199	N182-P185 WeakPolarHBondContact ND2-CA 3.35Å; P185-R187 VanDerWaalsContact C-N 3.32Å; P185-V196 HydrophobicContact CB-CB 4.28Å; P185-V196 HydrophobicContact CB-CG1 3.52Å; P185-V196 HydrophobicContact CB-CG2 3.91Å; P185-V196 HydrophobicContact CG-CG1 3.78Å; P185-T199 HydrophobicContact CG-CG2 4.23Å
186	E	89.5	Confident	93	Very high	153 Å²	153	41.4 Å²	41.4	72%	0.715	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-27.9	176.6	-63.5	-178	171.6	0	0	112.9	R114 D184	R114-E186 IonicContact NH1-OE2 3.12Å; R114-E186 PolarHBondContact NH1-OE2 2.81Å; R114-E186 IonicContact NH2-OE2 2.74Å; D184-E186 PolarHBondContact O-N 2.91Å
187	R	84.9	Confident	92.8	Very high	187 Å²	187	44.4 Å²	44.4	71%	0.706	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.1	-17.9	-175.5	-87.7	-79.2	-171	-174.2	-1	114	D184 P185	D184-R187 PolarHBondContact O-N 2.76Å; P185-R187 VanDerWaalsContact C-N 3.32Å
188	S	82	Confident	92.7	Very high	36 Å²	36	44.4 Å²	44.4	25%	0.252	22%	0.219	S	C	.	.			trans	-142	133.9	-176.3	58	0	0	0	0	111.6	N182 D184	N182-S188 PolarHBondContact ND2-O 3.03Å; D184-S188 PolarHBondContact O-N 3.48Å; D184-S188 PolarHBondContact O-OG 2.95Å; D184-S188 VanDerWaalsContact O-OG 3.04Å
189	E	81.7	Confident	92.5	Very high	148 Å²	148	44.6 Å²	44.6	69%	0.692	22%	0.22	S	C	*	.			trans	-69.9	143.6	164.2	-63.8	-178.2	-162.2	0	0	109.1	H191	E189-H191 IonicContact OE2-CE1 2.67Å; E189-H191 PolarHBondContact OE2-CE1 3.33Å; E189-H191 IonicContact OE2-NE2 3.11Å; E189-H191 PolarHBondContact OE2-NE2 2.95Å
190	G	82.6	Confident	92.3	Very high	19 Å²	19	49.8 Å²	49.8	20%	0.196	24%	0.244	C	C	.	.			trans	-126.4	78.6	175.9	0	0	0	0	0	109.7	D161 L192 C193	D161-G190 VanDerWaalsContact OD1-C 3.24Å; D161-G190 VanDerWaalsContact OD1-CA 3.29Å; D161-G190 WeakPolarHBondContact OD1-CA 3.46Å; G190-L192 PolarHBondContact O-N 3.15Å; G190-C193 PolarHBondContact O-N 3.18Å; G190-C193 VanDerWaalsContact O-N 3.13Å
191	H	89.9	Confident	92.2	Very high	94 Å²	94	52 Å²	52	44%	0.435	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-20.7	-177.8	-65.6	-56.6	0	0	0	112.8	D161 E189	D161-H191 PolarHBondContact OD1-N 3.41Å; D161-H191 IonicContact OD2-CD2 3.65Å; D161-H191 PolarHBondContact OD2-N 3.11Å; D161-H191 VanDerWaalsContact OD2-N 3.08Å; E189-H191 IonicContact OE2-CE1 2.67Å; E189-H191 PolarHBondContact OE2-CE1 3.33Å; E189-H191 IonicContact OE2-NE2 3.11Å; E189-H191 PolarHBondContact OE2-NE2 2.95Å
192	L	94.3	Very high	92.2	Very high	16 Å²	16	52 Å²	52	8%	0.084	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-8	177.6	-50.4	-176.8	0	0	0	112.8	D161 M164 L165 G190 L275 T314	D161-L192 HydrophobicContact CB-CD1 4.15Å; D161-L192 HydrophobicContact CB-CG 4.26Å; D161-L192 WeakPolarHBondContact OD1-CB 3.37Å; D161-L192 PolarHBondContact OD1-N 3.12Å; M164-L192 HydrophobicContact CB-CB 4.18Å; M164-L192 HydrophobicContact CB-CD1 4.26Å; M164-L192 HydrophobicContact CG-CB 3.66Å; M164-L192 HydrophobicContact CG-CD1 3.93Å; M164-L192 HydrophobicContact CG-CG 4.46Å; L165-L192 HydrophobicContact CD2-CD1 4.18Å; G190-L192 PolarHBondContact O-N 3.15Å; L192-L275 HydrophobicContact CD1-CD2 4.4Å; L192-T314 HydrophobicContact CD1-CG2 4.47Å; L192-T314 HydrophobicContact CD2-CG2 3.28Å
193	C	95.9	Very high	92.2	Very high	20 Å²	20	54.3 Å²	54.3	14%	0.135	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-90.2	164.7	-178.4	-60.9	0	0	0	0	112	G180 N182 G190	G180-C193 CarbonylContact O-C 3.54Å; G180-C193 VanDerWaalsContact O-CA 3.28Å; G180-C193 WeakPolarHBondContact O-CA 3.26Å; N182-C193 HydrophobicContact CB-CB 4.11Å; G190-C193 PolarHBondContact O-N 3.18Å; G190-C193 VanDerWaalsContact O-N 3.13Å
194	L	96.4	Very high	92.2	Very high	10 Å²	10	58.2 Å²	58.2	5%	0.052	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-56.5	156	167.3	-62.2	179.8	0	0	0	111	I179 G180 V181 V196 Y198 F202 A205 F209 V438 L440	I179-L194 HydrophobicContact CG2-CD1 3.87Å; I179-L194 HydrophobicContact CG2-CD2 4.27Å; I179-L194 HydrophobicContact CG2-CG 4.05Å; G180-L194 WeakPolarHBondContact O-CG 3.41Å; G180-L194 PolarHBondContact O-N 3.15Å; V181-L194 HydrophobicContact CG2-CD1 4.18Å; L194-V196 PolarHBondContact O-N 3.06Å; L194-Y198 HydrophobicContact CB-CD2 4.3Å; L194-F202 HydrophobicContact CD1-CE2 4.45Å; L194-A205 HydrophobicContact CD1-CB 4.24Å; L194-F209 HydrophobicContact CD1-CZ 3.96Å; L194-F209 HydrophobicContact CD2-CZ 4.38Å; L194-V438 HydrophobicContact CD2-CB 4.48Å; L194-V438 HydrophobicContact CD2-CG1 4.39Å; L194-L440 HydrophobicContact CD1-CD1 4.32Å; L194-L440 HydrophobicContact CD2-CD1 3.98Å; L194-L440 HydrophobicContact CD2-CG 4.24Å
195	P	95.1	Very high	92.3	Very high	28 Å²	28	58 Å²	58	18%	0.182	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-48	139.8	172.9	-28.8	33.5	0	0	0	112.8	R197 Y198 L440 Q442	P195-R197 HydrophobicContact CB-CG 4.38Å; P195-R197 PolarHBondContact O-N 2.98Å; P195-Y198 HydrophobicContact CB-CD2 3.87Å; P195-Y198 HydrophobicContact CB-CE2 4.1Å; P195-Y198 HydrophobicContact CG-CD2 4.05Å; P195-Y198 HydrophobicContact CG-CE2 4.03Å; P195-Y198 WeakPolarHBondContact O-CB 3.45Å; P195-Y198 PolarHBondContact O-N 2.67Å; P195-L440 HydrophobicContact CG-CB 4.49Å; P195-Q442 HydrophobicContact CG-CG 4.43Å
196	V	93.8	Very high	92.6	Very high	86 Å²	86	56.9 Å²	56.9	52%	0.521	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-34.1	-171.6	169.7	0	0	0	0	113.7	P185 L194 Y198 T199	P185-V196 HydrophobicContact CB-CB 4.28Å; P185-V196 HydrophobicContact CB-CG1 3.52Å; P185-V196 HydrophobicContact CB-CG2 3.91Å; P185-V196 HydrophobicContact CG-CG1 3.78Å; L194-V196 PolarHBondContact O-N 3.06Å; V196-Y198 PolarHBondContact O-N 3.05Å; V196-Y198 VanDerWaalsContact O-N 3.14Å; V196-T199 VanDerWaalsContact O-CB 3.29Å; V196-T199 WeakPolarHBondContact O-CB 3.5Å; V196-T199 PolarHBondContact O-N 3.33Å; V196-T199 VanDerWaalsContact O-N 3.08Å; V196-T199 PolarHBondContact O-OG1 3.05Å
197	R	93.8	Very high	92.9	Very high	90 Å²	90	52.7 Å²	52.7	34%	0.34	26%	0.264	S	S	.	.	H	α-helix	trans	-56.4	-31.1	177.3	63.4	160.4	177.6	-100.6	3.1	113.7	P195 T199 H200 S201 E441 Q442	P195-R197 HydrophobicContact CB-CG 4.38Å; P195-R197 PolarHBondContact O-N 2.98Å; R197-T199 PolarHBondContact O-N 3.22Å; R197-H200 PolarHBondContact O-N 3.3Å; R197-S201 PolarHBondContact O-N 3.43Å; R197-E441 PolarHBondContact NH2-O 3.04Å; R197-Q442 PolarHBondContact NH1-OXT 3.32Å; R197-Q442 PolarHBondContact NH2-OXT 3.18Å
198	Y	95.4	Very high	93.4	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-78.3	-8	-177.2	-65.1	-59.5	0	0	0	113.3	L194 P195 V196 H200 F202 E204 A205 K208 L440	L194-Y198 HydrophobicContact CB-CD2 4.3Å; P195-Y198 HydrophobicContact CB-CD2 3.87Å; P195-Y198 HydrophobicContact CB-CE2 4.1Å; P195-Y198 HydrophobicContact CG-CD2 4.05Å; P195-Y198 HydrophobicContact CG-CE2 4.03Å; P195-Y198 WeakPolarHBondContact O-CB 3.45Å; P195-Y198 PolarHBondContact O-N 2.67Å; V196-Y198 PolarHBondContact O-N 3.05Å; V196-Y198 VanDerWaalsContact O-N 3.14Å; Y198-H200 VanDerWaalsContact C-N 3.28Å; Y198-F202 WeakPolarHBondContact O-CA 3.38Å; Y198-F202 PolarHBondContact O-N 2.78Å; Y198-E204 HydrophobicContact CE1-CB 4.19Å; Y198-E204 HydrophobicContact CE1-CG 4.24Å; Y198-E204 PolarHBondContact OH-OE1 2.62Å; Y198-A205 HydrophobicContact CD1-CB 3.6Å; Y198-A205 HydrophobicContact CE1-CB 4.12Å; Y198-A205 HydrophobicContact CG-CB 3.96Å; Y198-K208 WeakPolarHBondContact OH-CD 3.49Å; Y198-K208 VanDerWaalsContact OH-CE 3.27Å; Y198-K208 WeakPolarHBondContact OH-CE 3.43Å; Y198-L440 HydrophobicContact CD1-CD1 4.47Å; Y198-L440 HydrophobicContact CD2-CD1 3.68Å; Y198-L440 HydrophobicContact CE1-CD1 4.26Å; Y198-L440 HydrophobicContact CE2-CB 3.82Å; Y198-L440 HydrophobicContact CE2-CD1 3.4Å; Y198-L440 VanDerWaalsContact CE2-CD1 3.4Å; Y198-L440 HydrophobicContact CE2-CG 4.23Å; Y198-L440 HydrophobicContact CG-CD1 4.2Å
199	T	94.2	Very high	94.1	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.018	23%	0.229	C	C	.	.	H	α-helix	trans	-61.4	-39.7	165.4	-60.3	0	0	0	0	111.3	N121 H124 N182 P185 V196 R197	N121-T199 HydrophobicContact CB-CG2 4.4Å; H124-T199 PolarHBondContact CD2-O 2.96Å; N182-T199 WeakPolarHBondContact O-CB 3.33Å; N182-T199 WeakPolarHBondContact O-CG2 3.29Å; N182-T199 PolarHBondContact O-OG1 3.05Å; P185-T199 HydrophobicContact CG-CG2 4.23Å; V196-T199 VanDerWaalsContact O-CB 3.29Å; V196-T199 WeakPolarHBondContact O-CB 3.5Å; V196-T199 PolarHBondContact O-N 3.33Å; V196-T199 VanDerWaalsContact O-N 3.08Å; V196-T199 PolarHBondContact O-OG1 3.05Å; R197-T199 PolarHBondContact O-N 3.22Å
200	H	93.8	Very high	94.8	Very high	115 Å²	115	38.5 Å²	38.5	53%	0.532	20%	0.2	S	C	.	.	H	α-helix	trans	-101.6	-19.4	-177.1	-57	-52.7	0	0	0	113.4	H124 R197 Y198	H124-H200 PolarHBondContact NE2-O 3.36Å; R197-H200 PolarHBondContact O-N 3.3Å; Y198-H200 VanDerWaalsContact C-N 3.28Å
201	S	95.4	Very high	95.4	Very high	51 Å²	51	45.4 Å²	45.4	36%	0.357	22%	0.221	S	C	.	.			trans	-119.1	44.6	179.7	-54.4	0	0	0	0	110.9	R197 P203 E204 A205	R197-S201 PolarHBondContact O-N 3.43Å; S201-P203 VanDerWaalsContact C-CD 3.43Å; S201-P203 VanDerWaalsContact C-N 3.33Å; S201-E204 VanDerWaalsContact O-CB 3.27Å; S201-E204 WeakPolarHBondContact O-CB 3.48Å; S201-E204 PolarHBondContact O-N 3.27Å; S201-A205 PolarHBondContact O-N 2.85Å
202	F	97.3	Very high	95.6	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-58.3	-36.1	-177.9	-169.7	-104.3	0	0	0	114	H124 I125 L129 I156 V181 L194 Y198 E204 A205 L206	H124-F202 PolarHBondContact NE2-N 3.23Å; I125-F202 HydrophobicContact CB-CD1 4.43Å; I125-F202 HydrophobicContact CG1-CD1 4.43Å; I125-F202 HydrophobicContact CG1-CD2 4.36Å; I125-F202 HydrophobicContact CG1-CG 4.19Å; I125-F202 HydrophobicContact CG2-CD1 4.21Å; I125-F202 HydrophobicContact CG2-CE1 3.91Å; I125-F202 HydrophobicContact CG2-CZ 4.14Å; L129-F202 HydrophobicContact CD2-CE1 4.04Å; L129-F202 HydrophobicContact CG-CE1 4.04Å; I156-F202 HydrophobicContact CD1-CE1 4.49Å; I156-F202 HydrophobicContact CD1-CZ 3.79Å; V181-F202 HydrophobicContact CG1-CD2 4.44Å; V181-F202 HydrophobicContact CG2-CD2 4.03Å; V181-F202 HydrophobicContact CG2-CE2 3.63Å; L194-F202 HydrophobicContact CD1-CE2 4.45Å; Y198-F202 WeakPolarHBondContact O-CA 3.38Å; Y198-F202 PolarHBondContact O-N 2.78Å; F202-E204 PolarHBondContact O-N 3.45Å; F202-A205 HydrophobicContact CD2-CB 4.43Å; F202-A205 WeakPolarHBondContact O-CB 3.49Å; F202-A205 PolarHBondContact O-N 3.14Å; F202-L206 HydrophobicContact CD1-CD1 4.11Å; F202-L206 HydrophobicContact CD1-CG 4.11Å; F202-L206 HydrophobicContact CE1-CD1 3.84Å; F202-L206 HydrophobicContact CE1-CD2 3.75Å; F202-L206 HydrophobicContact CE1-CG 3.72Å; F202-L206 HydrophobicContact CZ-CD2 3.94Å; F202-L206 HydrophobicContact CZ-CG 4.26Å; F202-L206 PolarHBondContact O-N 3.43Å; F202-L206 VanDerWaalsContact O-N 3.08Å
203	P	97.6	Very high	95.7	Very high	52 Å²	52	45.3 Å²	45.3	34%	0.338	23%	0.227	S	C	.	.	H	α-helix	trans	-55.8	-35.7	171.8	-27.6	35.5	0	0	0	113.8	S128 S201 A205 L206 Q207	S128-P203 WeakPolarHBondContact OG-CD 3.48Å; S128-P203 WeakPolarHBondContact OG-CG 3.33Å; S201-P203 VanDerWaalsContact C-CD 3.43Å; S201-P203 VanDerWaalsContact C-N 3.33Å; P203-A205 VanDerWaalsContact C-N 3.34Å; P203-A205 PolarHBondContact O-N 2.87Å; P203-L206 WeakPolarHBondContact O-CB 3.28Å; P203-L206 PolarHBondContact O-N 3.28Å; P203-Q207 WeakPolarHBondContact O-CG 3.49Å; P203-Q207 PolarHBondContact O-N 3.26Å
204	E	96.9	Very high	95.7	Very high	82 Å²	82	45.9 Å²	45.9	38%	0.383	23%	0.227	S	C	.	.	H	α-helix	trans	-64.5	-40.7	176.3	-166	-155.8	135	0	0	111.1	Y198 S201 F202 L206 Q207 K208	Y198-E204 HydrophobicContact CE1-CB 4.19Å; Y198-E204 HydrophobicContact CE1-CG 4.24Å; Y198-E204 PolarHBondContact OH-OE1 2.62Å; S201-E204 VanDerWaalsContact O-CB 3.27Å; S201-E204 WeakPolarHBondContact O-CB 3.48Å; S201-E204 PolarHBondContact O-N 3.27Å; F202-E204 PolarHBondContact O-N 3.45Å; E204-L206 VanDerWaalsContact C-N 3.34Å; E204-L206 PolarHBondContact O-N 3.15Å; E204-Q207 PolarHBondContact O-N 3.04Å; E204-K208 WeakPolarHBondContact O-CG 3.46Å; E204-K208 PolarHBondContact O-N 3.14Å
205	A	96.8	Very high	95.6	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.4	-43.9	173.9	0	0	0	0	0	111.4	L194 Y198 S201 F202 P203 Q207 K208 F209 L440	L194-A205 HydrophobicContact CD1-CB 4.24Å; Y198-A205 HydrophobicContact CD1-CB 3.6Å; Y198-A205 HydrophobicContact CE1-CB 4.12Å; Y198-A205 HydrophobicContact CG-CB 3.96Å; S201-A205 PolarHBondContact O-N 2.85Å; F202-A205 HydrophobicContact CD2-CB 4.43Å; F202-A205 WeakPolarHBondContact O-CB 3.49Å; F202-A205 PolarHBondContact O-N 3.14Å; P203-A205 VanDerWaalsContact C-N 3.34Å; P203-A205 PolarHBondContact O-N 2.87Å; A205-Q207 PolarHBondContact O-N 3.34Å; A205-K208 WeakPolarHBondContact O-CB 3.26Å; A205-K208 PolarHBondContact O-N 3.03Å; A205-F209 HydrophobicContact CB-CE2 4.32Å; A205-F209 HydrophobicContact CB-CZ 4.07Å; A205-F209 VanDerWaalsContact O-CD1 3.28Å; A205-F209 WeakPolarHBondContact O-CD1 3.24Å; A205-F209 WeakPolarHBondContact O-CD2 3.14Å; A205-F209 WeakPolarHBondContact O-CG 3.44Å; A205-F209 PolarHBondContact O-N 3.27Å; A205-L440 HydrophobicContact CB-CD1 3.93Å
206	L	96.8	Very high	95.7	Very high	4 Å²	4	52.4 Å²	52.4	2%	0.021	25%	0.247	C	C	.	.	H	α-helix	trans	-59.9	-45.1	175.9	-67.5	179.3	0	0	0	111.8	L129 E132 F202 P203 E204 K208 F209 Y210	L129-L206 HydrophobicContact CD2-CD1 4.18Å; L129-L206 HydrophobicContact CD2-CD2 3.9Å; E132-L206 HydrophobicContact CG-CD1 4.25Å; F202-L206 HydrophobicContact CD1-CD1 4.11Å; F202-L206 HydrophobicContact CD1-CG 4.11Å; F202-L206 HydrophobicContact CE1-CD1 3.84Å; F202-L206 HydrophobicContact CE1-CD2 3.75Å; F202-L206 HydrophobicContact CE1-CG 3.72Å; F202-L206 HydrophobicContact CZ-CD2 3.94Å; F202-L206 HydrophobicContact CZ-CG 4.26Å; F202-L206 PolarHBondContact O-N 3.43Å; F202-L206 VanDerWaalsContact O-N 3.08Å; P203-L206 WeakPolarHBondContact O-CB 3.28Å; P203-L206 PolarHBondContact O-N 3.28Å; E204-L206 VanDerWaalsContact C-N 3.34Å; E204-L206 PolarHBondContact O-N 3.15Å; L206-K208 VanDerWaalsContact C-N 3.31Å; L206-K208 PolarHBondContact O-N 3.48Å; L206-F209 HydrophobicContact CD2-CD2 4.06Å; L206-F209 HydrophobicContact CD2-CE2 4.4Å; L206-F209 WeakPolarHBondContact O-CB 3.43Å; L206-F209 PolarHBondContact O-N 3.38Å; L206-F209 VanDerWaalsContact O-N 3.11Å; L206-Y210 HydrophobicContact CB-CE2 4.36Å; L206-Y210 VanDerWaalsContact O-CD1 3.23Å; L206-Y210 WeakPolarHBondContact O-CD1 3.44Å; L206-Y210 PolarHBondContact O-N 3Å
207	Q	96.4	Very high	95.9	Very high	66 Å²	66	48.6 Å²	48.6	31%	0.308	22%	0.224	S	C	.	.	H	α-helix	trans	-61.5	-40.2	177	-67.5	-57.9	-39	0	0	111.9	E132 P203 E204 A205 Y210 R211	E132-Q207 PolarHBondContact OE1-NE2 3.31Å; P203-Q207 WeakPolarHBondContact O-CG 3.49Å; P203-Q207 PolarHBondContact O-N 3.26Å; E204-Q207 PolarHBondContact O-N 3.04Å; A205-Q207 PolarHBondContact O-N 3.34Å; Q207-Y210 PolarHBondContact O-N 3.23Å; Q207-R211 WeakPolarHBondContact O-CB 3.26Å; Q207-R211 VanDerWaalsContact O-CG 3.27Å; Q207-R211 WeakPolarHBondContact O-CG 3.4Å; Q207-R211 PolarHBondContact O-N 3.38Å
208	K	96.3	Very high	96.1	Very high	46 Å²	46	47.6 Å²	47.6	20%	0.2	22%	0.22	C	C	.	.	H	α-helix	trans	-61.9	-42.7	172.6	-73.5	-171.8	168.1	-73.7	0	112	Y198 E204 A205 L206 Y210 R211 G212 E213 L440	Y198-K208 WeakPolarHBondContact OH-CD 3.49Å; Y198-K208 VanDerWaalsContact OH-CE 3.27Å; Y198-K208 WeakPolarHBondContact OH-CE 3.43Å; E204-K208 WeakPolarHBondContact O-CG 3.46Å; E204-K208 PolarHBondContact O-N 3.14Å; A205-K208 WeakPolarHBondContact O-CB 3.26Å; A205-K208 PolarHBondContact O-N 3.03Å; L206-K208 VanDerWaalsContact C-N 3.31Å; L206-K208 PolarHBondContact O-N 3.48Å; K208-Y210 VanDerWaalsContact C-N 3.32Å; K208-Y210 PolarHBondContact O-N 2.89Å; K208-R211 PolarHBondContact O-N 3.33Å; K208-G212 PolarHBondContact O-N 3.32Å; K208-E213 HydrophobicContact CB-CB 4.02Å; K208-E213 HydrophobicContact CG-CB 4.08Å; K208-E213 IonicContact NZ-OE2 3.76Å; K208-E213 PolarHBondContact NZ-OE2 3.16Å; K208-E213 PolarHBondContact O-N 3.25Å; K208-L440 HydrophobicContact CB-CD2 3.91Å; K208-L440 HydrophobicContact CD-CD2 3.96Å
209	F	96.3	Very high	96.2	Very high	4 Å²	4	48.6 Å²	48.6	2%	0.018	22%	0.224	C	C	.	.	H	α-helix	trans	-59.4	-44.4	174.2	-56.8	-21.6	0	0	0	111.2	G65 F66 I179 L194 A205 L206 R211 G212 F214 V438 L440	G65-F209 CarbonylContact C-O 3.45Å; G65-F209 VanDerWaalsContact CA-O 3.23Å; G65-F209 WeakPolarHBondContact CA-O 3.46Å; F66-F209 HydrophobicContact CD1-CB 4.48Å; F66-F209 PolarHBondContact N-O 3.48Å; I179-F209 HydrophobicContact CD1-CE2 4.03Å; I179-F209 HydrophobicContact CD1-CZ 4.44Å; I179-F209 HydrophobicContact CG2-CZ 4.38Å; L194-F209 HydrophobicContact CD1-CZ 3.96Å; L194-F209 HydrophobicContact CD2-CZ 4.38Å; A205-F209 HydrophobicContact CB-CE2 4.32Å; A205-F209 HydrophobicContact CB-CZ 4.07Å; A205-F209 VanDerWaalsContact O-CD1 3.28Å; A205-F209 WeakPolarHBondContact O-CD1 3.24Å; A205-F209 WeakPolarHBondContact O-CD2 3.14Å; A205-F209 WeakPolarHBondContact O-CG 3.44Å; A205-F209 PolarHBondContact O-N 3.27Å; L206-F209 HydrophobicContact CD2-CD2 4.06Å; L206-F209 HydrophobicContact CD2-CE2 4.4Å; L206-F209 WeakPolarHBondContact O-CB 3.43Å; L206-F209 PolarHBondContact O-N 3.38Å; L206-F209 VanDerWaalsContact O-N 3.11Å; F209-R211 VanDerWaalsContact C-N 3.29Å; F209-R211 PolarHBondContact O-N 3.46Å; F209-G212 PolarHBondContact O-N 3.07Å; F209-F214 HydrophobicContact CB-CE1 4.46Å; F209-F214 HydrophobicContact CD1-CB 4.46Å; F209-F214 HydrophobicContact CD1-CD1 4.13Å; F209-F214 HydrophobicContact CD1-CG 4.22Å; F209-F214 WeakPolarHBondContact O-CE1 3.42Å; F209-V438 HydrophobicContact CD1-CG1 4.15Å; F209-V438 HydrophobicContact CE1-CB 4.41Å; F209-V438 HydrophobicContact CE1-CG1 3.49Å; F209-V438 VanDerWaalsContact CE1-CG1 3.49Å; F209-V438 HydrophobicContact CZ-CG1 4.18Å; F209-L440 HydrophobicContact CD1-CD2 4.28Å; F209-L440 HydrophobicContact CE1-CD1 3.77Å; F209-L440 HydrophobicContact CE1-CD2 3.88Å; F209-L440 HydrophobicContact CE1-CG 3.95Å; F209-L440 HydrophobicContact CZ-CD1 4.2Å
210	Y	95.8	Very high	96.4	Very high	23 Å²	23	48.7 Å²	48.7	9%	0.09	22%	0.224	C	C	.	.	H	α-helix	trans	-67.1	-30.2	-178	-62.5	-10.9	0	0	0	113.8	F66 R67 E132 I134 L206 Q207 K208	F66-Y210 VanDerWaalsContact O-CD1 3.3Å; F66-Y210 WeakPolarHBondContact O-CD1 3.31Å; R67-Y210 HydrophobicContact CB-CD1 4.36Å; R67-Y210 HydrophobicContact CB-CE1 4.43Å; R67-Y210 HydrophobicContact CG-CD1 3.48Å; R67-Y210 VanDerWaalsContact CG-CD1 3.48Å; R67-Y210 HydrophobicContact CG-CE1 3.96Å; R67-Y210 HydrophobicContact CG-CG 4.02Å; E132-Y210 WeakPolarHBondContact CB-OH 3.37Å; E132-Y210 HydrophobicContact CG-CE2 4.19Å; E132-Y210 WeakPolarHBondContact OE2-CE2 3.37Å; I134-Y210 WeakPolarHBondContact CD1-OH 3.46Å; L206-Y210 HydrophobicContact CB-CE2 4.36Å; L206-Y210 VanDerWaalsContact O-CD1 3.23Å; L206-Y210 WeakPolarHBondContact O-CD1 3.44Å; L206-Y210 PolarHBondContact O-N 3Å; Q207-Y210 PolarHBondContact O-N 3.23Å; K208-Y210 VanDerWaalsContact C-N 3.32Å; K208-Y210 PolarHBondContact O-N 2.89Å
211	R	95.1	Very high	96.6	Very high	164 Å²	164	43.2 Å²	43.2	62%	0.619	20%	0.199	S	C	*	.	H	α-helix	trans	-88.5	-10.2	178.2	-66.2	173.7	-169.9	-178.8	2	113.5	Q207 K208 F209 E213	Q207-R211 WeakPolarHBondContact O-CB 3.26Å; Q207-R211 VanDerWaalsContact O-CG 3.27Å; Q207-R211 WeakPolarHBondContact O-CG 3.4Å; Q207-R211 PolarHBondContact O-N 3.38Å; K208-R211 PolarHBondContact O-N 3.33Å; F209-R211 VanDerWaalsContact C-N 3.29Å; F209-R211 PolarHBondContact O-N 3.46Å; R211-E213 VanDerWaalsContact C-N 3.33Å; R211-E213 HydrophobicContact CB-CG 3.94Å; R211-E213 WeakPolarHBondContact CD-OE1 3.3Å; R211-E213 IonicContact NH1-OE1 3.25Å; R211-E213 PolarHBondContact NH1-OE1 2.99Å
212	G	94.9	Very high	96.7	Very high	26 Å²	26	40.8 Å²	40.8	27%	0.268	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.8	18.6	-173.9	0	0	0	0	0	113.8	G64 K208 F209 F214	G64-G212 WeakPolarHBondContact O-CA 3.43Å; K208-G212 PolarHBondContact O-N 3.32Å; F209-G212 PolarHBondContact O-N 3.07Å; G212-F214 PolarHBondContact O-N 3.44Å
213	E	95.3	Very high	96.8	Very high	82 Å²	82	41.7 Å²	41.7	38%	0.383	19%	0.185	S	C	.	.			trans	-81.2	51.6	178.1	-64.7	176.9	-151.5	0	0	111.6	K208 R211 L440	K208-E213 HydrophobicContact CB-CB 4.02Å; K208-E213 HydrophobicContact CG-CB 4.08Å; K208-E213 IonicContact NZ-OE2 3.76Å; K208-E213 PolarHBondContact NZ-OE2 3.16Å; K208-E213 PolarHBondContact O-N 3.25Å; R211-E213 VanDerWaalsContact C-N 3.33Å; R211-E213 HydrophobicContact CB-CG 3.94Å; R211-E213 WeakPolarHBondContact CD-OE1 3.3Å; R211-E213 IonicContact NH1-OE1 3.25Å; R211-E213 PolarHBondContact NH1-OE1 2.99Å; E213-L440 WeakPolarHBondContact O-CD2 3.33Å
214	F	95.8	Very high	96.8	Very high	31 Å²	31	39.2 Å²	39.2	14%	0.136	17%	0.169	C	C	.	.	S	Bend	trans	-157.3	167.3	-179.1	71.3	-83.1	0	0	0	109.8	F66 F209 G212 W216 V438 L440	F66-F214 HydrophobicContact CB-CE1 4.05Å; F66-F214 HydrophobicContact CB-CZ 3.66Å; F209-F214 HydrophobicContact CB-CE1 4.46Å; F209-F214 HydrophobicContact CD1-CB 4.46Å; F209-F214 HydrophobicContact CD1-CD1 4.13Å; F209-F214 HydrophobicContact CD1-CG 4.22Å; F209-F214 WeakPolarHBondContact O-CE1 3.42Å; G212-F214 PolarHBondContact O-N 3.44Å; F214-W216 AromaticContact CE2-CD2 3.71Å; F214-W216 HydrophobicContact CE2-CD2 3.71Å; F214-W216 AromaticContact CE2-CE2 3.44Å; F214-W216 VanDerWaalsContact CE2-CE2 3.44Å; F214-W216 HydrophobicContact CE2-CE3 4.01Å; F214-W216 HydrophobicContact CE2-CG 4.29Å; F214-W216 AromaticContact CE2-CH2 3.87Å; F214-W216 HydrophobicContact CE2-CH2 3.87Å; F214-W216 AromaticContact CE2-CZ2 3.55Å; F214-W216 HydrophobicContact CE2-CZ2 3.55Å; F214-W216 HydrophobicContact CE2-CZ3 4.09Å; F214-W216 AromaticContact CE2-NE1 3.83Å; F214-W216 AromaticContact CZ-CE2 3.84Å; F214-W216 HydrophobicContact CZ-CH2 4.19Å; F214-W216 AromaticContact CZ-CZ2 3.66Å; F214-W216 HydrophobicContact CZ-CZ2 3.66Å; F214-V438 HydrophobicContact CB-CG1 3.97Å; F214-V438 HydrophobicContact CD2-CG1 3.68Å; F214-V438 HydrophobicContact CD2-CG2 4.33Å; F214-V438 HydrophobicContact CE2-CG2 4.41Å; F214-V438 HydrophobicContact CG-CG1 4.08Å; F214-L440 HydrophobicContact CB-CD2 3.56Å
215	R	95.6	Very high	96.8	Very high	110 Å²	110	38 Å²	38	42%	0.415	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	145.1	168.4	102.4	-174	160.4	85	-9.9	111.3	E369 L439	R215-E369 IonicContact CZ-OE2 3.89Å; R215-E369 IonicContact NH1-OE1 3.24Å; R215-E369 IonicContact NH1-OE2 3.83Å; R215-E369 PolarHBondContact NH1-OE2 2.87Å; R215-E369 IonicContact NH2-OE2 2.8Å; R215-L439 HydrophobicContact CG-CB 4.08Å; R215-L439 HydrophobicContact CG-CD2 4.37Å; R215-L439 PolarHBondContact N-O 2.93Å; R215-L439 PolarHBondContact O-N 2.9Å
216	W	96.6	Very high	96.7	Very high	66 Å²	66	38 Å²	38	25%	0.25	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	130.8	166.2	-65.4	114.1	0	0	0	109.8	F66 P177 F214 R436 V438	F66-W216 HydrophobicContact CB-CH2 4.22Å; F66-W216 HydrophobicContact CB-CZ2 3.99Å; F66-W216 HydrophobicContact CD1-CH2 4.11Å; F66-W216 AromaticContact CD2-CH2 3.94Å; F66-W216 HydrophobicContact CD2-CH2 3.94Å; F66-W216 HydrophobicContact CD2-CZ2 4.02Å; F66-W216 HydrophobicContact CE1-CH2 4.49Å; F66-W216 HydrophobicContact CE2-CH2 4.35Å; F66-W216 AromaticContact CG-CH2 3.82Å; F66-W216 HydrophobicContact CG-CH2 3.82Å; F66-W216 AromaticContact CG-CZ2 3.99Å; F66-W216 HydrophobicContact CG-CZ2 3.99Å; P177-W216 HydrophobicContact CB-CH2 4.07Å; P177-W216 HydrophobicContact CB-CZ3 3.85Å; P177-W216 HydrophobicContact CG-CH2 3.87Å; P177-W216 HydrophobicContact CG-CZ3 4.08Å; F214-W216 AromaticContact CE2-CD2 3.71Å; F214-W216 HydrophobicContact CE2-CD2 3.71Å; F214-W216 AromaticContact CE2-CE2 3.44Å; F214-W216 VanDerWaalsContact CE2-CE2 3.44Å; F214-W216 HydrophobicContact CE2-CE3 4.01Å; F214-W216 HydrophobicContact CE2-CG 4.29Å; F214-W216 AromaticContact CE2-CH2 3.87Å; F214-W216 HydrophobicContact CE2-CH2 3.87Å; F214-W216 AromaticContact CE2-CZ2 3.55Å; F214-W216 HydrophobicContact CE2-CZ2 3.55Å; F214-W216 HydrophobicContact CE2-CZ3 4.09Å; F214-W216 AromaticContact CE2-NE1 3.83Å; F214-W216 AromaticContact CZ-CE2 3.84Å; F214-W216 HydrophobicContact CZ-CH2 4.19Å; F214-W216 AromaticContact CZ-CZ2 3.66Å; F214-W216 HydrophobicContact CZ-CZ2 3.66Å; W216-R436 HydrophobicContact CD2-CG 3.94Å; W216-R436 HydrophobicContact CE3-CG 3.4Å; W216-R436 HydrophobicContact CG-CG 4.47Å; W216-R436 HydrophobicContact CZ3-CG 3.89Å; W216-V438 HydrophobicContact CE3-CG2 3.96Å; W216-V438 HydrophobicContact CH2-CG2 4.17Å; W216-V438 HydrophobicContact CZ3-CG2 3.42Å; W216-V438 VanDerWaalsContact CZ3-CG2 3.42Å
217	L	97.2	Very high	96.6	Very high	6 Å²	6	40.5 Å²	40.5	3%	0.031	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	115.9	174.4	179.3	71.5	0	0	0	108.7	R219 P368 E369 T437	L217-R219 HydrophobicContact CD2-CG 4.15Å; L217-R219 VanDerWaalsContact CD2-CZ 3.41Å; L217-R219 HydrophobicContact CG-CG 4.1Å; L217-R219 PolarHBondContact O-N 3.3Å; L217-P368 HydrophobicContact CD1-CG 3.95Å; L217-P368 HydrophobicContact CD2-CG 4.25Å; L217-P368 HydrophobicContact CG-CG 4.4Å; L217-E369 HydrophobicContact CD1-CG 3.66Å; L217-E369 WeakPolarHBondContact CD1-OE2 3.43Å; L217-T437 PolarHBondContact N-O 3.48Å; L217-T437 PolarHBondContact O-N 3.45Å; L217-T437 PolarHBondContact O-OG1 3.02Å; L217-T437 VanDerWaalsContact O-OG1 3.13Å
218	W	97.9	Very high	96.3	Very high	68 Å²	68	39.2 Å²	39.2	26%	0.258	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	92	-176.9	-64.7	95.3	0	0	0	110.6	R174 L175 Q220 E369 E434 R436	R174-W218 WeakPolarHBondContact O-CZ3 3.38Å; L175-W218 HydrophobicContact CD2-CH2 4.04Å; W218-Q220 PolarHBondContact O-N 2.67Å; W218-E369 PolarHBondContact N-OE1 3.39Å; W218-E369 WeakPolarHBondContact O-CA 3.28Å; W218-E369 WeakPolarHBondContact O-CG 3.3Å; W218-E434 HydrophobicContact CE3-CB 4.02Å; W218-R436 HydrophobicContact CE3-CB 4.1Å; W218-R436 HydrophobicContact CH2-CB 4.17Å; W218-R436 HydrophobicContact CH2-CG 4.16Å; W218-R436 HydrophobicContact CZ2-CG 4.37Å; W218-R436 HydrophobicContact CZ3-CB 3.8Å; W218-R436 HydrophobicContact CZ3-CG 4.26Å
219	R	98.3	Very high	95.6	Very high	22 Å²	22	42 Å²	42	8%	0.083	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	125.3	-175.4	-58.8	-179.9	176.6	-94.1	7.2	110.1	L217 L275 T314 P368 E434 L435 T437	L217-R219 HydrophobicContact CD2-CG 4.15Å; L217-R219 VanDerWaalsContact CD2-CZ 3.41Å; L217-R219 HydrophobicContact CG-CG 4.1Å; L217-R219 PolarHBondContact O-N 3.3Å; R219-L275 HydrophobicContact CB-CD1 3.75Å; R219-T314 VanDerWaalsContact NH1-CG2 3.34Å; R219-T314 PolarHBondContact NH1-OG1 2.85Å; R219-P368 WeakPolarHBondContact CA-O 3.49Å; R219-P368 HydrophobicContact CG-CB 4.24Å; R219-E434 CarbonylContact O-C 3.6Å; R219-E434 WeakPolarHBondContact O-CA 3.24Å; R219-L435 HydrophobicContact CB-CB 4.35Å; R219-L435 PolarHBondContact N-O 3.2Å; R219-L435 PolarHBondContact O-N 2.95Å; R219-T437 HydrophobicContact CG-CG2 4.41Å; R219-T437 PolarHBondContact NE-OG1 2.74Å
220	Q	98.2	Very high	94.5	Very high	4 Å²	4	45.2 Å²	45.2	2%	0.019	23%	0.233	C	C	.	.			trans	-65.2	143.8	174.2	-59.3	-58.4	-29.6	0	0	110.6	W218 P368 E369 E370 I429 E434	W218-Q220 PolarHBondContact O-N 2.67Å; Q220-P368 WeakPolarHBondContact CG-O 3.12Å; Q220-P368 PolarHBondContact N-O 2.84Å; Q220-E369 PolarHBondContact NE2-O 3.25Å; Q220-E369 VanDerWaalsContact NE2-O 3.07Å; Q220-E370 WeakPolarHBondContact CG-O 3.34Å; Q220-I429 HydrophobicContact CB-CD1 4.32Å; Q220-I429 HydrophobicContact CB-CG2 4.25Å; Q220-I429 HydrophobicContact CG-CG2 4.36Å; Q220-E434 PolarHBondContact NE2-OE1 2.92Å
221	R	98.3	Very high	93.9	Very high	1 Å²	1	45.3 Å²	45.3	0%	0.004	24%	0.235	C	C	.	.			trans	-129.7	147.1	173.7	-61.1	-169.4	-71.1	-178.6	-7.3	111.1	A168 V171 R273 A274 L275 I429 D433 L435	A168-R221 PolarHBondContact O-NH1 3.43Å; V171-R221 PolarHBondContact O-NH1 2.85Å; V171-R221 PolarHBondContact O-NH2 3.08Å; V171-R221 VanDerWaalsContact O-NH2 3.13Å; R221-R273 HydrophobicContact CB-CB 3.83Å; R221-R273 HydrophobicContact CG-CB 4.46Å; R221-A274 CarbonylContact C-O 3.59Å; R221-A274 WeakPolarHBondContact CA-O 3.28Å; R221-A274 WeakPolarHBondContact CB-O 3.11Å; R221-L275 HydrophobicContact CG-CB 4.43Å; R221-L275 HydrophobicContact CG-CD1 3.99Å; R221-I429 WeakPolarHBondContact O-CD1 3.46Å; R221-D433 VanDerWaalsContact CZ-O 3.24Å; R221-D433 PolarHBondContact NE-O 3.26Å; R221-D433 PolarHBondContact NH2-O 2.89Å; R221-L435 HydrophobicContact CG-CB 4.26Å
222	I	98.5	Very high	93.4	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	119.7	177.7	-53.6	175	0	0	0	108.9	R273 A274 V278 L310 T312 I373 M427 I429	I222-R273 WeakPolarHBondContact O-CA 3.47Å; I222-A274 HydrophobicContact CB-CB 3.92Å; I222-A274 HydrophobicContact CD1-CB 4.43Å; I222-A274 HydrophobicContact CG1-CB 4.37Å; I222-A274 PolarHBondContact N-O 2.86Å; I222-A274 PolarHBondContact O-N 3.24Å; I222-V278 HydrophobicContact CB-CG2 4.31Å; I222-V278 HydrophobicContact CD1-CG2 4.1Å; I222-V278 HydrophobicContact CG2-CG2 4.18Å; I222-L310 HydrophobicContact CD1-CB 4.23Å; I222-L310 WeakPolarHBondContact CD1-O 3.32Å; I222-T312 HydrophobicContact CD1-CG2 4.06Å; I222-T312 HydrophobicContact CG1-CG2 3.64Å; I222-I373 HydrophobicContact CD1-CG2 4.19Å; I222-I373 HydrophobicContact CG1-CD1 4.32Å; I222-I373 HydrophobicContact CG1-CG1 4.37Å; I222-I373 HydrophobicContact CG2-CD1 4.23Å; I222-M427 HydrophobicContact CG2-CB 3.68Å; I222-M427 HydrophobicContact CG2-CG 3.98Å; I222-I429 HydrophobicContact CG1-CD1 4Å
223	R	97.9	Very high	92.9	Very high	19 Å²	19	40 Å²	40	7%	0.072	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	137.4	166.4	178.5	172.7	-69.6	-167.8	-3.6	109.9	Y225 L269 M427 M428 N430 E432 D433	R223-Y225 VanDerWaalsContact CD-CE2 3.43Å; R223-Y225 WeakPolarHBondContact CD-OH 3.28Å; R223-Y225 HydrophobicContact CG-CD2 4.26Å; R223-Y225 HydrophobicContact CG-CE2 3.72Å; R223-L269 HydrophobicContact CG-CD1 3.65Å; R223-M427 VanDerWaalsContact O-CA 3.29Å; R223-M427 WeakPolarHBondContact O-CA 3.4Å; R223-M428 HydrophobicContact CB-CG 4.22Å; R223-M428 PolarHBondContact N-O 3.46Å; R223-M428 PolarHBondContact O-N 3.07Å; R223-M428 VanDerWaalsContact O-N 3.07Å; R223-N430 VanDerWaalsContact CZ-ND2 3.34Å; R223-N430 PolarHBondContact NH1-ND2 3.18Å; R223-E432 IonicContact CZ-OE1 3.38Å; R223-E432 IonicContact NH1-OE1 2.75Å; R223-E432 PolarHBondContact NH1-OE1 3.48Å; R223-E432 VanDerWaalsContact NH2-CD 3.31Å; R223-E432 VanDerWaalsContact NH2-CG 3.26Å; R223-E432 IonicContact NH2-OE1 3.1Å; R223-E432 PolarHBondContact NH2-OE1 2.91Å; R223-D433 WeakPolarHBondContact CB-OD2 3.45Å; R223-D433 IonicContact CZ-OD1 2.79Å; R223-D433 IonicContact CZ-OD2 3.47Å; R223-D433 IonicContact NE-OD1 2.76Å; R223-D433 IonicContact NE-OD2 3.61Å; R223-D433 PolarHBondContact NE-OD2 2.89Å; R223-D433 IonicContact NH2-OD1 3.63Å; R223-D433 PolarHBondContact NH2-OD1 3.27Å; R223-D433 IonicContact NH2-OD2 3.71Å; R223-D433 PolarHBondContact NH2-OD2 2.84Å
224	L	97.6	Very high	92.5	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	132.2	-178.8	-57.4	113.4	0	0	0	111.2	L270 V272 V278 M409 V411 S426 M427	L224-L270 HydrophobicContact CB-CB 4.25Å; L224-L270 HydrophobicContact CB-CD1 3.84Å; L224-L270 HydrophobicContact CB-CG 4.22Å; L224-L270 PolarHBondContact O-N 2.89Å; L224-V272 HydrophobicContact CD1-CG2 4.45Å; L224-V278 HydrophobicContact CD1-CG2 4.42Å; L224-V278 HydrophobicContact CD2-CB 4.44Å; L224-V278 HydrophobicContact CD2-CG1 3.83Å; L224-V278 HydrophobicContact CD2-CG2 3.73Å; L224-V278 HydrophobicContact CG-CG2 4.38Å; L224-M409 HydrophobicContact CD2-CE 3.89Å; L224-M409 HydrophobicContact CD2-CG 4.47Å; L224-M409 HydrophobicContact CD2-SD 3.56Å; L224-M409 VanDerWaalsContact CD2-SD 3.56Å; L224-V411 HydrophobicContact CD1-CG1 4.49Å; L224-V411 HydrophobicContact CD1-CG2 3.96Å; L224-V411 HydrophobicContact CD2-CG2 4.22Å; L224-S426 WeakPolarHBondContact CA-O 3.49Å; L224-M427 HydrophobicContact CD2-CG 3.87Å; L224-M427 HydrophobicContact CD2-SD 4.41Å; L224-M427 HydrophobicContact CG-CG 4.26Å
225	Y	97.1	Very high	92.2	Very high	56 Å²	56	40.7 Å²	40.7	22%	0.22	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	143	164.3	-63.6	-96.8	0	0	0	109.7	R223 P267 Q268 L269 A425 S426 M428	R223-Y225 VanDerWaalsContact CD-CE2 3.43Å; R223-Y225 WeakPolarHBondContact CD-OH 3.28Å; R223-Y225 HydrophobicContact CG-CD2 4.26Å; R223-Y225 HydrophobicContact CG-CE2 3.72Å; Y225-P267 HydrophobicContact CD1-CB 4Å; Y225-P267 HydrophobicContact CG-CB 4.36Å; Y225-Q268 CarbonylContact C-O 3.55Å; Y225-Q268 WeakPolarHBondContact CA-O 3.38Å; Y225-L269 HydrophobicContact CD1-CB 4.05Å; Y225-L269 HydrophobicContact CD1-CD1 4.29Å; Y225-L269 HydrophobicContact CE1-CB 3.82Å; Y225-L269 HydrophobicContact CE1-CD1 3.9Å; Y225-L269 HydrophobicContact CE1-CG 4.39Å; Y225-L269 HydrophobicContact CE2-CD1 4.26Å; Y225-A425 CarbonylContact O-C 3.49Å; Y225-A425 VanDerWaalsContact O-CA 3.29Å; Y225-A425 WeakPolarHBondContact O-CA 3.39Å; Y225-S426 PolarHBondContact N-O 2.64Å; Y225-S426 PolarHBondContact O-N 3.47Å; Y225-M428 HydrophobicContact CD2-CE 4.39Å; Y225-M428 HydrophobicContact CE2-CE 4.35Å; Y225-M428 HydrophobicContact CE2-SD 4.01Å
226	L	95.6	Very high	91.8	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	132.1	176.5	-170.8	64.4	0	0	0	109.9	I231 Q268 L270 F419 I424	L226-I231 HydrophobicContact CD1-CG2 4.2Å; L226-I231 HydrophobicContact CD2-CB 3.95Å; L226-I231 HydrophobicContact CD2-CG2 4.26Å; L226-I231 HydrophobicContact CG-CB 4.01Å; L226-I231 HydrophobicContact CG-CD1 4.23Å; L226-I231 HydrophobicContact CG-CG2 3.88Å; L226-Q268 PolarHBondContact N-O 2.87Å; L226-Q268 WeakPolarHBondContact O-CB 3.37Å; L226-Q268 PolarHBondContact O-N 3.15Å; L226-L270 HydrophobicContact CB-CD1 4.46Å; L226-L270 HydrophobicContact CB-CD2 3.93Å; L226-L270 HydrophobicContact CB-CG 4.3Å; L226-L270 HydrophobicContact CD2-CD2 4.37Å; L226-F419 HydrophobicContact CD1-CD2 3.77Å; L226-F419 HydrophobicContact CD1-CE2 3.78Å; L226-I424 WeakPolarHBondContact CA-O 3.17Å
227	E	94.8	Very high	91.3	Very high	56 Å²	56	35 Å²	35	26%	0.262	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	175	177	71	-175.8	165	0	0	111.6	I231 P267 A423 I424	E227-I231 VanDerWaalsContact O-CG2 3.26Å; E227-I231 WeakPolarHBondContact O-CG2 3.44Å; E227-P267 WeakPolarHBondContact OE2-CD 3.2Å; E227-P267 VanDerWaalsContact OE2-CG 3.28Å; E227-P267 WeakPolarHBondContact OE2-CG 3.26Å; E227-A423 CarbonylContact O-C 3.54Å; E227-I424 HydrophobicContact CG-CB 3.68Å; E227-I424 HydrophobicContact CG-CD1 4.43Å; E227-I424 HydrophobicContact CG-CG2 4.13Å; E227-I424 PolarHBondContact N-O 2.93Å; E227-I424 PolarHBondContact O-N 3Å
228	G	89.2	Confident	90.7	Very high	40 Å²	40	37 Å²	37	41%	0.412	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	104.4	-165.1	176.9	0	0	0	0	0	113
229	T	82.8	Confident	89.5	Confident	105 Å²	105	38 Å²	38	64%	0.644	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	133.6	-171.5	52	0	0	0	0	111.8	I231 G422	T229-I231 VanDerWaalsContact C-N 3.28Å; T229-I231 PolarHBondContact O-N 2.88Å; T229-G422 PolarHBondContact N-O 3.31Å
230	G	72.8	Confident	87.8	Confident	70 Å²	70	42.2 Å²	42.2	72%	0.722	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.4	22.8	173.7	0	0	0	0	0	114.3
231	I	83.7	Confident	85.8	Confident	25 Å²	25	45.1 Å²	45.1	13%	0.128	26%	0.264	C	S	.	.			trans	-70.1	142.5	176.5	58.8	160.9	0	0	0	111.5	L226 E227 T229 Q268 A423	L226-I231 HydrophobicContact CD1-CG2 4.2Å; L226-I231 HydrophobicContact CD2-CB 3.95Å; L226-I231 HydrophobicContact CD2-CG2 4.26Å; L226-I231 HydrophobicContact CG-CB 4.01Å; L226-I231 HydrophobicContact CG-CD1 4.23Å; L226-I231 HydrophobicContact CG-CG2 3.88Å; E227-I231 VanDerWaalsContact O-CG2 3.26Å; E227-I231 WeakPolarHBondContact O-CG2 3.44Å; T229-I231 VanDerWaalsContact C-N 3.28Å; T229-I231 PolarHBondContact O-N 2.88Å; I231-Q268 HydrophobicContact CD1-CG 4.39Å; I231-A423 HydrophobicContact CG2-CB 3.94Å
232	N	84.2	Confident	83.6	Confident	35 Å²	35	50.7 Å²	50.7	19%	0.187	29%	0.289	C	S	.	.			trans	-120.2	107.1	168.5	-174.6	0.4	0	0	0	108.8	V234 E418	N232-V234 PolarHBondContact O-N 3.31Å; N232-V234 WeakPolarHBondContact OD1-CB 3.45Å; N232-V234 WeakPolarHBondContact OD1-CG2 3.48Å; N232-V234 PolarHBondContact OD1-N 3.32Å; N232-E418 HydrophobicContact CB-CB 4.45Å
233	P	84.3	Confident	81	Confident	44 Å²	44	53.5 Å²	53.5	29%	0.286	30%	0.304	S	S	.	.			trans	-77.3	-2.4	178.4	35.7	-39.5	0	0	0	113.1	P235 L270 F417	P233-P235 WeakPolarHBondContact O-CD 3.21Å; P233-L270 HydrophobicContact CB-CD2 4.22Å; P233-F417 WeakPolarHBondContact O-CE1 3.46Å
234	V	86.6	Confident	78.5	Confident	68 Å²	68	55.6 Å²	55.6	41%	0.412	32%	0.322	S	S	.	.			trans	-70.9	121.1	179.5	-179.6	0	0	0	0	109.3	N232	N232-V234 PolarHBondContact O-N 3.31Å; N232-V234 WeakPolarHBondContact OD1-CB 3.45Å; N232-V234 WeakPolarHBondContact OD1-CG2 3.48Å; N232-V234 PolarHBondContact OD1-N 3.32Å
235	P	89.1	Confident	76.1	Confident	60 Å²	60	59.8 Å²	59.8	39%	0.39	34%	0.344	S	S	.	.			trans	-75.7	142	179.4	29	-32.7	0	0	0	111.8	P233 T415 F417	P233-P235 WeakPolarHBondContact O-CD 3.21Å; P235-T415 HydrophobicContact CB-CG2 3.45Å; P235-T415 VanDerWaalsContact CB-CG2 3.45Å; P235-F417 HydrophobicContact CB-CE1 3.72Å; P235-F417 HydrophobicContact CB-CZ 3.83Å
236	V	87.7	Confident	73.5	Confident	15 Å²	15	62.5 Å²	62.5	9%	0.091	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	120.1	169.3	-179.7	0	0	0	0	109.6	L238 L252 T415 S416	V236-L238 PolarHBondContact O-N 2.89Å; V236-L252 HydrophobicContact CG2-CD2 4.47Å; V236-T415 WeakPolarHBondContact O-CA 3.44Å; V236-S416 PolarHBondContact N-O 3.11Å; V236-S416 PolarHBondContact O-N 3.41Å
237	D	85.3	Confident	71.2	Confident	41 Å²	41	66.7 Å²	66.7	22%	0.219	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	109.2	172.8	-172.3	-27	0	0	0	110.4	R141 H239 E240 Q241	R141-D237 IonicContact CZ-OD2 3.89Å; R141-D237 IonicContact NH1-OD1 3.31Å; R141-D237 PolarHBondContact NH1-OD1 2.69Å; R141-D237 IonicContact NH1-OD2 3.6Å; R141-D237 PolarHBondContact NH1-OD2 2.8Å; D237-H239 VanDerWaalsContact C-N 3.26Å; D237-H239 PolarHBondContact O-N 3.07Å; D237-H239 WeakPolarHBondContact OD1-CA 3.29Å; D237-H239 WeakPolarHBondContact OD1-CB 3.17Å; D237-H239 IonicContact OD1-CD2 2.62Å; D237-H239 IonicContact OD1-CG 3.62Å; D237-H239 PolarHBondContact OD1-N 3.07Å; D237-E240 HydrophobicContact CB-CG 4.32Å; D237-E240 PolarHBondContact OD1-N 3.16Å; D237-Q241 WeakPolarHBondContact O-CB 3.46Å; D237-Q241 PolarHBondContact O-N 3.25Å
238	L	84.3	Confident	69	Low	49 Å²	49	65.3 Å²	65.3	26%	0.257	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-19.2	-177.6	-63.7	-179.9	0	0	0	113.6	V236 Q241 V410 G414	V236-L238 PolarHBondContact O-N 2.89Å; L238-Q241 CarbonylContact O-C 3.58Å; L238-V410 HydrophobicContact CD1-CG1 3.78Å; L238-V410 HydrophobicContact CD1-CG2 4.32Å; L238-G414 PolarHBondContact N-O 3.32Å
239	H	74.3	Confident	67.2	Low	89 Å²	89	65.6 Å²	65.6	41%	0.412	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-33.8	179.8	-67	-78.3	0	0	0	113	R141 D237 Q241	R141-H239 VanDerWaalsContact CZ-CD2 3.49Å; R141-H239 PolarHBondContact NH2-CD2 2.96Å; D237-H239 VanDerWaalsContact C-N 3.26Å; D237-H239 PolarHBondContact O-N 3.07Å; D237-H239 WeakPolarHBondContact OD1-CA 3.29Å; D237-H239 WeakPolarHBondContact OD1-CB 3.17Å; D237-H239 IonicContact OD1-CD2 2.62Å; D237-H239 IonicContact OD1-CG 3.62Å; D237-H239 PolarHBondContact OD1-N 3.07Å; H239-Q241 VanDerWaalsContact C-N 3.29Å
240	E	61.8	Low	65.7	Low	110 Å²	110	68.6 Å²	68.6	51%	0.514	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-32.2	171.9	-61.7	-160.9	146.3	0	0	111.1	D237	D237-E240 HydrophobicContact CB-CG 4.32Å; D237-E240 PolarHBondContact OD1-N 3.16Å
241	Q	55.7	Low	64.8	Low	65 Å²	65	66.5 Å²	66.5	30%	0.304	34%	0.342	S	S	.	.			trans	-104.2	61.9	-176.2	-69.3	-167.8	15.1	0	0	111.3	D237 L238 H239 L243	D237-Q241 WeakPolarHBondContact O-CB 3.46Å; D237-Q241 PolarHBondContact O-N 3.25Å; L238-Q241 CarbonylContact O-C 3.58Å; H239-Q241 VanDerWaalsContact C-N 3.29Å; Q241-L243 HydrophobicContact CB-CD1 3.6Å; Q241-L243 HydrophobicContact CB-CD2 4.45Å; Q241-L243 HydrophobicContact CB-CG 3.64Å; Q241-L243 HydrophobicContact CG-CD1 3.91Å; Q241-L243 HydrophobicContact CG-CG 4.27Å; Q241-L243 PolarHBondContact O-N 2.8Å
242	Q	51.6	Low	63.2	Low	117 Å²	117	66.5 Å²	66.5	55%	0.547	34%	0.343	S	S	.	.			trans	-65.7	62.5	161.7	-75.8	-170.1	1.3	0	0	110.5	F82	F82-Q242 VanDerWaalsContact CZ-CD 3.46Å; F82-Q242 HydrophobicContact CZ-CG 4.26Å; F82-Q242 VanDerWaalsContact CZ-OE1 3.24Å
243	L	45	Very low	61.4	Low	59 Å²	59	68.6 Å²	68.6	31%	0.309	35%	0.354	S	S	.	.			trans	-83.5	135.1	-174.3	-68.9	178.7	0	0	0	107.7	Q241 Q247 H248 A251	Q241-L243 HydrophobicContact CB-CD1 3.6Å; Q241-L243 HydrophobicContact CB-CD2 4.45Å; Q241-L243 HydrophobicContact CB-CG 3.64Å; Q241-L243 HydrophobicContact CG-CD1 3.91Å; Q241-L243 HydrophobicContact CG-CG 4.27Å; Q241-L243 PolarHBondContact O-N 2.8Å; L243-Q247 HydrophobicContact CB-CB 3.44Å; L243-Q247 VanDerWaalsContact CB-CB 3.44Å; L243-Q247 HydrophobicContact CD1-CB 4.04Å; L243-Q247 HydrophobicContact CD2-CB 3.42Å; L243-Q247 VanDerWaalsContact CD2-CB 3.42Å; L243-Q247 HydrophobicContact CD2-CG 4.01Å; L243-Q247 HydrophobicContact CG-CB 3.71Å; L243-H248 HydrophobicContact CB-CB 4.45Å; L243-A251 HydrophobicContact CD1-CB 4.11Å
244	S	46.1	Very low	59.5	Low	64 Å²	64	72.2 Å²	72.2	45%	0.448	37%	0.37	S	S	.	.			trans	-53.1	149.9	155.6	59.4	0	0	0	0	108.8	N246 Q247 H248	S244-N246 PolarHBondContact O-N 2.93Å; S244-Q247 WeakPolarHBondContact O-CA 3.27Å; S244-Q247 WeakPolarHBondContact O-CB 3.28Å; S244-Q247 PolarHBondContact O-N 3.45Å; S244-Q247 PolarHBondContact OG-OE1 3.11Å; S244-H248 PolarHBondContact O-N 3.11Å; S244-H248 VanDerWaalsContact O-N 3.08Å
245	L	46.6	Very low	57.5	Low	87 Å²	87	73.7 Å²	73.7	46%	0.455	37%	0.372	S	S	.	.	H	α-helix	trans	-45.5	-34.9	178.1	-176.8	67.5	0	0	0	113.3	H248 N249 L284	L245-H248 PolarHBondContact O-N 3.16Å; L245-N249 PolarHBondContact O-N 2.62Å; L245-L284 HydrophobicContact CD2-CD1 4.31Å
246	N	42.5	Very low	55.3	Low	114 Å²	114	79.8 Å²	79.8	61%	0.61	39%	0.387	S	S	*	.	H	α-helix	trans	-66.6	-34.7	175.1	-74.9	-33.7	0	0	0	114.3	S244 R250	S244-N246 PolarHBondContact O-N 2.93Å; N246-R250 WeakPolarHBondContact O-CB 3.47Å; N246-R250 VanDerWaalsContact O-CG 3.24Å; N246-R250 WeakPolarHBondContact O-CG 3.49Å; N246-R250 PolarHBondContact O-N 3.39Å
247	Q	46.7	Very low	52.9	Low	88 Å²	88	82.9 Å²	82.9	41%	0.411	41%	0.414	S	S	.	.	H	α-helix	trans	-77.1	-35.5	176.1	-79.6	167.8	-30.9	0	0	111.1	L243 S244 N249 R250 A251	L243-Q247 HydrophobicContact CB-CB 3.44Å; L243-Q247 VanDerWaalsContact CB-CB 3.44Å; L243-Q247 HydrophobicContact CD1-CB 4.04Å; L243-Q247 HydrophobicContact CD2-CB 3.42Å; L243-Q247 VanDerWaalsContact CD2-CB 3.42Å; L243-Q247 HydrophobicContact CD2-CG 4.01Å; L243-Q247 HydrophobicContact CG-CB 3.71Å; S244-Q247 WeakPolarHBondContact O-CA 3.27Å; S244-Q247 WeakPolarHBondContact O-CB 3.28Å; S244-Q247 PolarHBondContact O-N 3.45Å; S244-Q247 PolarHBondContact OG-OE1 3.11Å; Q247-N249 VanDerWaalsContact C-N 3.35Å; Q247-R250 CarbonylContact O-C 3.58Å; Q247-R250 PolarHBondContact O-N 3.01Å; Q247-R250 VanDerWaalsContact O-N 3.11Å; Q247-A251 PolarHBondContact O-N 3.27Å
248	H	49.3	Very low	50.8	Low	27 Å²	27	88.6 Å²	88.6	13%	0.125	44%	0.439	C	S	.	.	H	α-helix	trans	-58.7	-48.5	171.4	-174.8	69.9	0	0	0	110.5	L243 S244 L245 R250 A251 L252	L243-H248 HydrophobicContact CB-CB 4.45Å; S244-H248 PolarHBondContact O-N 3.11Å; S244-H248 VanDerWaalsContact O-N 3.08Å; L245-H248 PolarHBondContact O-N 3.16Å; H248-R250 VanDerWaalsContact C-N 3.28Å; H248-R250 PolarHBondContact O-N 3.24Å; H248-A251 PolarHBondContact O-N 3.48Å; H248-L252 PolarHBondContact O-N 2.91Å
249	N	51.2	Low	48.8	Very low	46 Å²	46	93.6 Å²	93.6	25%	0.246	47%	0.466	C	S	.	.	H	α-helix	trans	-63.4	-31	174	-69.1	-10.5	0	0	0	112.8	L245 Q247 N253	L245-N249 PolarHBondContact O-N 2.62Å; Q247-N249 VanDerWaalsContact C-N 3.35Å; N249-N253 WeakPolarHBondContact O-CB 3.33Å; N249-N253 PolarHBondContact O-N 2.89Å; N249-N253 PolarHBondContact O-ND2 2.89Å
250	R	52.1	Low	47.3	Very low	168 Å²	168	98.3 Å²	98.3	63%	0.634	49%	0.489	S	S	*	.	H	α-helix	trans	-77.4	-36.1	176.3	-79.9	176.5	-174.8	-175.4	2	112.9	N246 Q247 H248 L252 N253 I254	N246-R250 WeakPolarHBondContact O-CB 3.47Å; N246-R250 VanDerWaalsContact O-CG 3.24Å; N246-R250 WeakPolarHBondContact O-CG 3.49Å; N246-R250 PolarHBondContact O-N 3.39Å; Q247-R250 CarbonylContact O-C 3.58Å; Q247-R250 PolarHBondContact O-N 3.01Å; Q247-R250 VanDerWaalsContact O-N 3.11Å; H248-R250 VanDerWaalsContact C-N 3.28Å; H248-R250 PolarHBondContact O-N 3.24Å; R250-L252 VanDerWaalsContact C-N 3.33Å; R250-N253 CarbonylContact O-C 3.56Å; R250-N253 PolarHBondContact O-N 2.99Å; R250-I254 HydrophobicContact CB-CD1 4.08Å; R250-I254 VanDerWaalsContact O-CB 3.24Å; R250-I254 WeakPolarHBondContact O-CB 3.26Å; R250-I254 WeakPolarHBondContact O-CD1 3.35Å; R250-I254 WeakPolarHBondContact O-CG1 3.1Å; R250-I254 PolarHBondContact O-N 3.01Å
251	A	52.2	Low	46.7	Very low	25 Å²	25	104.1 Å²	104.1	21%	0.207	51%	0.506	C	S	.	.	H	α-helix	trans	-60.8	-47	175.1	0	0	0	0	0	110.2	L243 Q247 H248 N253	L243-A251 HydrophobicContact CD1-CB 4.11Å; Q247-A251 PolarHBondContact O-N 3.27Å; H248-A251 PolarHBondContact O-N 3.48Å; A251-N253 VanDerWaalsContact C-N 3.32Å; A251-N253 PolarHBondContact O-N 3.39Å
252	L	51.6	Low	46.2	Very low	25 Å²	25	105.8 Å²	105.8	13%	0.131	52%	0.524	C	S	.	.	H	α-helix	trans	-64.7	-32.3	174.1	-66.4	169.3	0	0	0	113	V236 H248 R250 R256	V236-L252 HydrophobicContact CG2-CD2 4.47Å; H248-L252 PolarHBondContact O-N 2.91Å; R250-L252 VanDerWaalsContact C-N 3.33Å; L252-R256 WeakPolarHBondContact O-CG 3.46Å
253	N	45.2	Very low	46.1	Very low	79 Å²	79	109.2 Å²	109.2	42%	0.422	54%	0.539	S	S	.	.	H	α-helix	trans	-88.6	-23.3	179.9	-76.8	-51.1	0	0	0	115.1	N249 R250 A251 R256	N249-N253 WeakPolarHBondContact O-CB 3.33Å; N249-N253 PolarHBondContact O-N 2.89Å; N249-N253 PolarHBondContact O-ND2 2.89Å; R250-N253 CarbonylContact O-C 3.56Å; R250-N253 PolarHBondContact O-N 2.99Å; A251-N253 VanDerWaalsContact C-N 3.32Å; A251-N253 PolarHBondContact O-N 3.39Å; N253-R256 WeakPolarHBondContact O-CB 3.44Å; N253-R256 PolarHBondContact O-N 3.11Å; N253-R256 WeakPolarHBondContact OD1-CD 3.37Å; N253-R256 PolarHBondContact OD1-NH1 3.15Å
254	I	45.1	Very low	46.7	Very low	121 Å²	121	108.3 Å²	108.3	62%	0.621	54%	0.54	S	S	*	.	H	α-helix	trans	-75	-34.4	179.6	-73.4	164.5	0	0	0	110.1	R250 R256 A257	R250-I254 HydrophobicContact CB-CD1 4.08Å; R250-I254 VanDerWaalsContact O-CB 3.24Å; R250-I254 WeakPolarHBondContact O-CB 3.26Å; R250-I254 WeakPolarHBondContact O-CD1 3.35Å; R250-I254 WeakPolarHBondContact O-CG1 3.1Å; R250-I254 PolarHBondContact O-N 3.01Å; I254-R256 PolarHBondContact O-N 2.83Å; I254-A257 PolarHBondContact O-N 3.17Å
255	E	44.9	Very low	47.5	Very low	98 Å²	98	111.7 Å²	111.7	46%	0.458	56%	0.564	S	S	.	*	G	3₁₀ helix	trans	-65.8	-19.6	169.9	-70.3	-175.2	175.5	0	0	112.6	A257 H258	E255-A257 PolarHBondContact O-N 3.2Å; E255-A257 VanDerWaalsContact O-N 3.16Å; E255-H258 CarbonylContact O-C 3.27Å; E255-H258 PolarHBondContact O-N 3.12Å
256	R	42.7	Very low	49.2	Very low	189 Å²	189	108.9 Å²	108.9	71%	0.713	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-68.7	-11.9	175.4	-60.5	173.3	85	169	11.1	113.8	L252 N253 I254	L252-R256 WeakPolarHBondContact O-CG 3.46Å; N253-R256 WeakPolarHBondContact O-CB 3.44Å; N253-R256 PolarHBondContact O-N 3.11Å; N253-R256 WeakPolarHBondContact OD1-CD 3.37Å; N253-R256 PolarHBondContact OD1-NH1 3.15Å; I254-R256 PolarHBondContact O-N 2.83Å
257	A	37.9	Very low	51.5	Low	79 Å²	79	107.2 Å²	107.2	65%	0.653	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-84.2	-16.6	179	0	0	0	0	0	113.3	I254 E255	I254-A257 PolarHBondContact O-N 3.17Å; E255-A257 PolarHBondContact O-N 3.2Å; E255-A257 VanDerWaalsContact O-N 3.16Å
258	H	41	Very low	53.7	Low	161 Å²	161	105.1 Å²	105.1	75%	0.745	54%	0.542	S	S	*	.	S	Bend	trans	-147.4	92.2	175.4	-81.9	-66	0	0	0	108.3	E255	E255-H258 CarbonylContact O-C 3.27Å; E255-H258 PolarHBondContact O-N 3.12Å
259	D	40.8	Very low	55.9	Low	155 Å²	155	107.8 Å²	107.8	83%	0.829	56%	0.557	S	S	*	*			trans	-178.1	143.3	133.4	-90.8	-20.2	0	0	0	112.8	R261	D259-R261 PolarHBondContact O-N 2.9Å
260	E	44.5	Very low	58	Low	188 Å²	188	105.7 Å²	105.7	88%	0.879	55%	0.546	S	S	*	.			trans	-57.5	121.8	172.8	-64	176.2	156	0	0	109	C262	E260-C262 PolarHBondContact O-N 3.3Å
261	R	47.5	Very low	59.9	Low	231 Å²	231	100.8 Å²	100.8	87%	0.872	54%	0.535	S	S	*	.			trans	-56.2	111.5	177.3	-71.1	-179.7	-179.2	-173	-0.1	108.8	D259 E263	D259-R261 PolarHBondContact O-N 2.9Å; R261-E263 PolarHBondContact O-N 3.33Å
262	C	45.8	Very low	62	Low	101 Å²	101	100 Å²	100	68%	0.682	53%	0.528	S	S	*	.			trans	-71.4	94.8	175.1	-147.7	0	0	0	0	107.9	E260 A264	E260-C262 PolarHBondContact O-N 3.3Å; C262-A264 PolarHBondContact O-N 2.91Å
263	E	50.3	Low	64.1	Low	188 Å²	188	99.7 Å²	99.7	88%	0.879	53%	0.525	S	S	*	.			trans	-70.5	71.6	164.7	-74.5	-172	171.2	0	0	108.5	R261 S265	R261-E263 PolarHBondContact O-N 3.33Å; E263-S265 PolarHBondContact O-N 3.49Å
264	A	55.8	Low	66.7	Low	40 Å²	40	95.9 Å²	95.9	33%	0.331	51%	0.505	S	S	.	.			trans	-71.7	113.6	174.6	0	0	0	0	0	109.2	C262 G266 Q268	C262-A264 PolarHBondContact O-N 2.91Å; A264-G266 PolarHBondContact O-N 2.92Å; A264-Q268 HydrophobicContact CB-CG 4.16Å
265	S	63.7	Low	69.2	Low	136 Å²	136	90.1 Å²	90.1	95%	0.951	48%	0.475	S	S	*	.			trans	-76.3	66.7	175.9	177.9	0	0	0	0	110.8	E263	E263-S265 PolarHBondContact O-N 3.49Å
266	G	81.6	Confident	71.7	Confident	28 Å²	28	86 Å²	86	29%	0.289	46%	0.456	S	S	.	.	S	Bend	trans	147.4	179.7	167.4	0	0	0	0	0	116	A264 Q268	A264-G266 PolarHBondContact O-N 2.92Å; G266-Q268 PolarHBondContact O-N 3.24Å
267	P	91.2	Very high	74.3	Confident	79 Å²	79	77.8 Å²	77.8	51%	0.513	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-59.6	119.6	177.4	-16.5	24.4	0	0	0	113.5	Y225 E227	Y225-P267 HydrophobicContact CD1-CB 4Å; Y225-P267 HydrophobicContact CG-CB 4.36Å; E227-P267 WeakPolarHBondContact OE2-CD 3.2Å; E227-P267 VanDerWaalsContact OE2-CG 3.28Å; E227-P267 WeakPolarHBondContact OE2-CG 3.26Å
268	Q	93.8	Very high	77.2	Confident	44 Å²	44	74 Å²	74	21%	0.206	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	123.8	172.7	-61.9	-171.1	-0.7	0	0	110.7	Y225 L226 I231 A264 G266 L270	Y225-Q268 CarbonylContact C-O 3.55Å; Y225-Q268 WeakPolarHBondContact CA-O 3.38Å; L226-Q268 PolarHBondContact N-O 2.87Å; L226-Q268 WeakPolarHBondContact O-CB 3.37Å; L226-Q268 PolarHBondContact O-N 3.15Å; I231-Q268 HydrophobicContact CD1-CG 4.39Å; A264-Q268 HydrophobicContact CB-CG 4.16Å; G266-Q268 PolarHBondContact O-N 3.24Å; Q268-L270 PolarHBondContact O-N 2.81Å
269	L	95.4	Very high	79.9	Confident	83 Å²	83	68.2 Å²	68.2	44%	0.435	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	123.1	172.9	178.9	61.2	0	0	0	110	R223 Y225	R223-L269 HydrophobicContact CG-CD1 3.65Å; Y225-L269 HydrophobicContact CD1-CB 4.05Å; Y225-L269 HydrophobicContact CD1-CD1 4.29Å; Y225-L269 HydrophobicContact CE1-CB 3.82Å; Y225-L269 HydrophobicContact CE1-CD1 3.9Å; Y225-L269 HydrophobicContact CE1-CG 4.39Å; Y225-L269 HydrophobicContact CE2-CD1 4.26Å
270	L	95.2	Very high	82.6	Confident	2 Å²	2	61 Å²	61	1%	0.01	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	150.3	176.7	-62.1	-173.3	0	0	0	111.4	L224 L226 P233 Q268 V272 R273 M409 F417	L224-L270 HydrophobicContact CB-CB 4.25Å; L224-L270 HydrophobicContact CB-CD1 3.84Å; L224-L270 HydrophobicContact CB-CG 4.22Å; L224-L270 PolarHBondContact O-N 2.89Å; L226-L270 HydrophobicContact CB-CD1 4.46Å; L226-L270 HydrophobicContact CB-CD2 3.93Å; L226-L270 HydrophobicContact CB-CG 4.3Å; L226-L270 HydrophobicContact CD2-CD2 4.37Å; P233-L270 HydrophobicContact CB-CD2 4.22Å; Q268-L270 PolarHBondContact O-N 2.81Å; L270-V272 PolarHBondContact O-N 2.97Å; L270-V272 VanDerWaalsContact O-N 3.15Å; L270-R273 PolarHBondContact O-NH1 3.31Å; L270-M409 HydrophobicContact CD1-CE 3.46Å; L270-M409 VanDerWaalsContact CD1-CE 3.46Å; L270-F417 HydrophobicContact CB-CZ 4.34Å; L270-F417 HydrophobicContact CD1-CD1 4.13Å; L270-F417 HydrophobicContact CD1-CD2 3.96Å; L270-F417 HydrophobicContact CD1-CE1 4.04Å; L270-F417 HydrophobicContact CD1-CE2 3.88Å; L270-F417 HydrophobicContact CD1-CG 4.08Å; L270-F417 HydrophobicContact CD1-CZ 3.92Å; L270-F417 HydrophobicContact CD2-CD1 4.19Å; L270-F417 HydrophobicContact CD2-CE1 3.97Å; L270-F417 HydrophobicContact CD2-CZ 4.49Å; L270-F417 HydrophobicContact CG-CE1 4.44Å; L270-F417 HydrophobicContact CG-CZ 4.49Å
271	P	92.6	Very high	85.1	Confident	64 Å²	64	52.1 Å²	52.1	42%	0.416	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	3.1	-175.7	31.8	-36.7	0	0	0	113.9
272	V	94.8	Very high	87.4	Confident	9 Å²	9	42.2 Å²	42.2	6%	0.055	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	160.9	-176.8	-62.4	0	0	0	0	111.7	L224 L270 V411 T415 F417	L224-V272 HydrophobicContact CD1-CG2 4.45Å; L270-V272 PolarHBondContact O-N 2.97Å; L270-V272 VanDerWaalsContact O-N 3.15Å; V272-V411 HydrophobicContact CG2-CB 4.39Å; V272-V411 HydrophobicContact CG2-CG1 4.18Å; V272-V411 HydrophobicContact CG2-CG2 4.17Å; V272-T415 HydrophobicContact CG1-CG2 4.43Å; V272-F417 HydrophobicContact CG2-CE2 3.76Å; V272-F417 HydrophobicContact CG2-CZ 3.76Å
273	R	97.2	Very high	89.5	Confident	18 Å²	18	39.2 Å²	39.2	7%	0.068	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	132.4	173.4	-58.8	-64.7	178.5	-88.8	-6.7	108.5	L172 R221 I222 L270 L275 D433	L172-R273 HydrophobicContact CD2-CG 4.34Å; R221-R273 HydrophobicContact CB-CB 3.83Å; R221-R273 HydrophobicContact CG-CB 4.46Å; I222-R273 WeakPolarHBondContact O-CA 3.47Å; L270-R273 PolarHBondContact O-NH1 3.31Å; R273-L275 PolarHBondContact O-N 3.49Å; R273-D433 HydrophobicContact CG-CB 4.3Å; R273-D433 IonicContact CZ-OD1 2.67Å; R273-D433 IonicContact NE-OD1 3.66Å; R273-D433 PolarHBondContact NE-OD1 3.49Å; R273-D433 IonicContact NE-OD2 3.99Å; R273-D433 IonicContact NH2-OD1 2.67Å
274	A	98.1	Very high	91.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	118.7	179.4	0	0	0	0	0	110	R221 I222 V278 V411	R221-A274 CarbonylContact C-O 3.59Å; R221-A274 WeakPolarHBondContact CA-O 3.28Å; R221-A274 WeakPolarHBondContact CB-O 3.11Å; I222-A274 HydrophobicContact CB-CB 3.92Å; I222-A274 HydrophobicContact CD1-CB 4.43Å; I222-A274 HydrophobicContact CG1-CB 4.37Å; I222-A274 PolarHBondContact N-O 2.86Å; I222-A274 PolarHBondContact O-N 3.24Å; A274-V278 HydrophobicContact CB-CG2 3.54Å; A274-V411 HydrophobicContact CB-CG1 3.67Å
275	L	98.2	Very high	92.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	23%	0.23	C	C	.	.	S	Bend	trans	-81	-40.8	172.9	179.2	59.1	0	0	0	111.6	M164 L165 A168 L192 R219 R221 R273 T312 T314 D412 L435	M164-L275 HydrophobicContact CE-CD2 4.27Å; L165-L275 HydrophobicContact CD2-CB 4.04Å; L165-L275 HydrophobicContact CD2-CD2 4.07Å; L165-L275 HydrophobicContact CD2-CG 4.28Å; A168-L275 HydrophobicContact CB-CD2 3.87Å; L192-L275 HydrophobicContact CD1-CD2 4.4Å; R219-L275 HydrophobicContact CB-CD1 3.75Å; R221-L275 HydrophobicContact CG-CB 4.43Å; R221-L275 HydrophobicContact CG-CD1 3.99Å; R273-L275 PolarHBondContact O-N 3.49Å; L275-T312 PolarHBondContact O-OG1 3.36Å; L275-T314 HydrophobicContact CD1-CG2 4.14Å; L275-T314 HydrophobicContact CG-CG2 4.02Å; L275-D412 PolarHBondContact N-OD1 3.35Å; L275-D412 VanDerWaalsContact N-OD1 3.16Å; L275-D412 PolarHBondContact N-OD2 2.86Å; L275-L435 HydrophobicContact CD1-CD2 4.07Å; L275-L435 HydrophobicContact CD2-CD2 3.74Å
276	N	97.8	Very high	94.1	Very high	11 Å²	11	35.6 Å²	35.6	6%	0.059	22%	0.219	C	C	.	.	S	Bend	trans	-97	-71.8	178.3	-80.4	-2.3	0	0	0	110.9	L165 C311 T312 T314 D412	L165-N276 HydrophobicContact CD2-CB 4.35Å; N276-C311 CarbonylContact O-C 3.57Å; N276-C311 VanDerWaalsContact O-CA 3.26Å; N276-C311 WeakPolarHBondContact O-CA 3.29Å; N276-C311 WeakPolarHBondContact O-CB 3.49Å; N276-T312 PolarHBondContact O-N 2.87Å; N276-T314 WeakPolarHBondContact OD1-CG2 3.28Å; N276-D412 WeakPolarHBondContact CA-OD1 3.45Å; N276-D412 WeakPolarHBondContact CB-OD1 3.32Å; N276-D412 PolarHBondContact N-OD1 3.45Å
277	E	97.8	Very high	94.6	Very high	17 Å²	17	38.8 Å²	38.8	8%	0.079	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	157.7	-171.9	63	-94.8	155.4	0	0	114.6	L310 C311 W319 D412	E277-L310 CarbonylContact C-O 3.51Å; E277-L310 WeakPolarHBondContact CA-O 3.43Å; E277-L310 VanDerWaalsContact CB-O 3.26Å; E277-L310 WeakPolarHBondContact CB-O 3.49Å; E277-C311 HydrophobicContact CB-CB 3.9Å; E277-W319 HydrophobicContact CG-CE3 4.3Å; E277-D412 PolarHBondContact N-OD1 3.04Å; E277-D412 VanDerWaalsContact N-OD1 3.11Å; E277-D412 PolarHBondContact O-N 2.93Å
278	V	98.3	Very high	94.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	132.6	165.6	-175.7	0	0	0	0	107.5	I222 L224 A274 I280 L310 M409 V410 M427	I222-V278 HydrophobicContact CB-CG2 4.31Å; I222-V278 HydrophobicContact CD1-CG2 4.1Å; I222-V278 HydrophobicContact CG2-CG2 4.18Å; L224-V278 HydrophobicContact CD1-CG2 4.42Å; L224-V278 HydrophobicContact CD2-CB 4.44Å; L224-V278 HydrophobicContact CD2-CG1 3.83Å; L224-V278 HydrophobicContact CD2-CG2 3.73Å; L224-V278 HydrophobicContact CG-CG2 4.38Å; A274-V278 HydrophobicContact CB-CG2 3.54Å; V278-I280 HydrophobicContact CG1-CG1 4.33Å; V278-L310 HydrophobicContact CB-CB 4.42Å; V278-L310 HydrophobicContact CB-CD1 4.23Å; V278-L310 HydrophobicContact CG1-CD1 4.45Å; V278-L310 PolarHBondContact N-O 2.77Å; V278-L310 PolarHBondContact O-N 2.82Å; V278-M409 HydrophobicContact CG1-CG 3.58Å; V278-M409 HydrophobicContact CG1-SD 3.98Å; V278-V410 CarbonylContact C-O 3.59Å; V278-V410 WeakPolarHBondContact CA-O 3.37Å; V278-M427 HydrophobicContact CB-SD 4.33Å; V278-M427 HydrophobicContact CG1-SD 3.97Å
279	F	98	Very high	94.9	Very high	39 Å²	39	34.6 Å²	34.6	17%	0.171	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	133.1	173.5	178.8	-102.2	0	0	0	111.2	L308 N309 W319 M409 V410	F279-L308 CarbonylContact C-O 3.49Å; F279-L308 WeakPolarHBondContact CA-O 3.21Å; F279-L308 VanDerWaalsContact CD2-O 3.28Å; F279-L308 WeakPolarHBondContact CD2-O 3.19Å; F279-N309 HydrophobicContact CD2-CB 4.39Å; F279-W319 HydrophobicContact CB-CH2 4.26Å; F279-W319 HydrophobicContact CB-CZ3 3.65Å; F279-W319 HydrophobicContact CD1-CH2 4.18Å; F279-W319 HydrophobicContact CD1-CZ3 4.36Å; F279-W319 AromaticContact CD2-CH2 3.33Å; F279-W319 HydrophobicContact CD2-CH2 3.33Å; F279-W319 AromaticContact CD2-CZ3 3.52Å; F279-W319 HydrophobicContact CD2-CZ3 3.52Å; F279-W319 HydrophobicContact CE1-CH2 4.41Å; F279-W319 AromaticContact CE2-CH2 3.61Å; F279-W319 HydrophobicContact CE2-CH2 3.61Å; F279-W319 HydrophobicContact CE2-CZ3 4.28Å; F279-W319 AromaticContact CG-CH2 3.64Å; F279-W319 HydrophobicContact CG-CH2 3.64Å; F279-W319 AromaticContact CG-CZ3 3.56Å; F279-W319 HydrophobicContact CG-CZ3 3.56Å; F279-W319 HydrophobicContact CZ-CH2 4.15Å; F279-M409 CarbonylContact O-C 3.56Å; F279-M409 WeakPolarHBondContact O-CA 3.38Å; F279-V410 PolarHBondContact N-O 2.88Å; F279-V410 PolarHBondContact O-N 2.77Å
280	I	97.7	Very high	94.9	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	125.4	179.2	-62.1	172.9	0	0	0	108.5	V278 G307 L308 L310 V400 C408 M409 F419 A425 M427	V278-I280 HydrophobicContact CG1-CG1 4.33Å; I280-G307 CarbonylContact O-C 3.6Å; I280-G307 WeakPolarHBondContact O-CA 3.34Å; I280-L308 HydrophobicContact CB-CB 4.47Å; I280-L308 PolarHBondContact N-O 2.91Å; I280-L308 PolarHBondContact O-N 2.84Å; I280-L310 HydrophobicContact CD1-CD1 4.38Å; I280-V400 HydrophobicContact CD1-CB 4.16Å; I280-V400 HydrophobicContact CD1-CG1 4.28Å; I280-V400 HydrophobicContact CD1-CG2 4.12Å; I280-C408 WeakPolarHBondContact CA-O 3.2Å; I280-M409 HydrophobicContact CD1-CG 4.32Å; I280-M409 HydrophobicContact CD1-SD 4.18Å; I280-M409 HydrophobicContact CG1-CB 4.1Å; I280-M409 HydrophobicContact CG1-CG 3.82Å; I280-M409 HydrophobicContact CG1-SD 4.34Å; I280-F419 HydrophobicContact CD1-CE1 4.24Å; I280-F419 HydrophobicContact CG2-CD1 3.42Å; I280-F419 VanDerWaalsContact CG2-CD1 3.42Å; I280-F419 HydrophobicContact CG2-CE1 3.62Å; I280-F419 HydrophobicContact CG2-CG 4.44Å; I280-A425 HydrophobicContact CD1-CB 4.44Å; I280-M427 HydrophobicContact CD1-CE 3.97Å; I280-M427 HydrophobicContact CD1-SD 4.06Å
281	G	96.8	Very high	94.9	Very high	3 Å²	3	33.8 Å²	33.8	3%	0.031	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.2	169.1	175.5	0	0	0	0	0	113.3	S289 A407 C408	G281-S289 VanDerWaalsContact CA-OG 3.27Å; G281-S289 WeakPolarHBondContact CA-OG 3.46Å; G281-A407 CarbonylContact O-C 3.57Å; G281-A407 WeakPolarHBondContact O-CA 3.4Å; G281-A407 VanDerWaalsContact O-CB 3.23Å; G281-A407 WeakPolarHBondContact O-CB 3.44Å; G281-C408 PolarHBondContact N-O 3.27Å; G281-C408 PolarHBondContact O-N 2.83Å
282	E	94.9	Very high	95.1	Very high	22 Å²	22	31.7 Å²	31.7	10%	0.103	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	137.1	170.6	-69.8	-84.2	-179.4	0	0	110.7	L284 R287 S289 C404 W405 D406	E282-L284 PolarHBondContact O-N 3.3Å; E282-R287 HydrophobicContact CB-CB 4.2Å; E282-R287 HydrophobicContact CB-CG 4.49Å; E282-R287 HydrophobicContact CG-CB 4.28Å; E282-R287 HydrophobicContact CG-CG 4.03Å; E282-R287 WeakPolarHBondContact OE1-CD 3.48Å; E282-R287 WeakPolarHBondContact OE2-CD 3.22Å; E282-R287 IonicContact OE2-CZ 3.86Å; E282-R287 IonicContact OE2-NE 3.95Å; E282-R287 IonicContact OE2-NH1 3.44Å; E282-R287 PolarHBondContact OE2-NH1 3.14Å; E282-S289 PolarHBondContact N-OG 3.37Å; E282-C404 HydrophobicContact CG-CB 4.21Å; E282-C404 VanDerWaalsContact OE1-CA 3.26Å; E282-C404 WeakPolarHBondContact OE1-CA 3.44Å; E282-C404 VanDerWaalsContact OE1-CB 3.23Å; E282-C404 WeakPolarHBondContact OE1-CB 3.29Å; E282-W405 PolarHBondContact OE1-N 3.06Å; E282-D406 CarbonylContact C-O 3.53Å; E282-D406 WeakPolarHBondContact CA-O 3.44Å; E282-D406 PolarHBondContact OE2-N 3.23Å; E282-D406 VanDerWaalsContact OE2-N 3.15Å; E282-D406 VanDerWaalsContact OE2-O 3.1Å
283	S	90.7	Very high	95.1	Very high	38 Å²	38	31.6 Å²	31.6	27%	0.266	18%	0.178	S	C	.	.	S	Bend	trans	-62	-33.2	178.6	-57.9	0	0	0	0	112	D406 C408	S283-D406 WeakPolarHBondContact CB-O 3.39Å; S283-D406 PolarHBondContact N-O 2.81Å; S283-D406 PolarHBondContact OG-O 3.31Å; S283-D406 VanDerWaalsContact OG-O 3.04Å; S283-D406 PolarHBondContact OG-OD1 2.84Å; S283-C408 PolarHBondContact OG-SG 3.01Å; S283-C408 VanDerWaalsContact OG-SG 3.39Å
284	L	88.7	Confident	95	Very high	65 Å²	65	31 Å²	31	34%	0.34	18%	0.176	S	C	.	.	S	Bend	trans	-90.9	112.4	175.1	-173.6	68.3	0	0	0	110.3	L245 E282 S286 R287	L245-L284 HydrophobicContact CD2-CD1 4.31Å; E282-L284 PolarHBondContact O-N 3.3Å; L284-S286 WeakPolarHBondContact CD2-OG 3.4Å; L284-S286 WeakPolarHBondContact CG-OG 3.48Å; L284-S286 PolarHBondContact O-N 3.31Å; L284-R287 HydrophobicContact CB-CB 4.47Å; L284-R287 WeakPolarHBondContact O-CB 3.07Å; L284-R287 PolarHBondContact O-N 3.22Å
285	S	87.6	Confident	94.9	Very high	120 Å²	120	32.8 Å²	32.8	84%	0.839	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-22	-175.6	59.3	0	0	0	0	115.5	R287	S285-R287 VanDerWaalsContact C-N 3.31Å
286	S	89.2	Confident	94.7	Very high	103 Å²	103	36.2 Å²	36.2	72%	0.72	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-7.4	176.1	60.1	0	0	0	0	113.7	L284	L284-S286 WeakPolarHBondContact CD2-OG 3.4Å; L284-S286 WeakPolarHBondContact CG-OG 3.48Å; L284-S286 PolarHBondContact O-N 3.31Å
287	R	92	Very high	94.6	Very high	95 Å²	95	41.1 Å²	41.1	36%	0.358	23%	0.232	S	C	.	.	S	Bend	trans	-99	124.5	177.1	-169.6	-175	-73	160.3	1.1	109.7	E282 L284 S285 S289	E282-R287 HydrophobicContact CB-CB 4.2Å; E282-R287 HydrophobicContact CB-CG 4.49Å; E282-R287 HydrophobicContact CG-CB 4.28Å; E282-R287 HydrophobicContact CG-CG 4.03Å; E282-R287 WeakPolarHBondContact OE1-CD 3.48Å; E282-R287 WeakPolarHBondContact OE2-CD 3.22Å; E282-R287 IonicContact OE2-CZ 3.86Å; E282-R287 IonicContact OE2-NE 3.95Å; E282-R287 IonicContact OE2-NH1 3.44Å; E282-R287 PolarHBondContact OE2-NH1 3.14Å; L284-R287 HydrophobicContact CB-CB 4.47Å; L284-R287 WeakPolarHBondContact O-CB 3.07Å; L284-R287 PolarHBondContact O-N 3.22Å; S285-R287 VanDerWaalsContact C-N 3.31Å; R287-S289 PolarHBondContact O-N 2.95Å
288	A	94.4	Very high	94.4	Very high	34 Å²	34	41.6 Å²	41.6	28%	0.281	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-70.4	129.6	175.4	0	0	0	0	0	110.5	K304 S305 I381	A288-K304 HydrophobicContact CB-CD 4.46Å; A288-K304 HydrophobicContact CB-CG 4.12Å; A288-S305 CarbonylContact C-O 3.56Å; A288-I381 HydrophobicContact CB-CD1 3.93Å
289	S	96.8	Very high	94.1	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.014	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	130.3	175.4	-55.2	0	0	0	0	109.7	G281 E282 R287 K304 S305	G281-S289 VanDerWaalsContact CA-OG 3.27Å; G281-S289 WeakPolarHBondContact CA-OG 3.46Å; E282-S289 PolarHBondContact N-OG 3.37Å; R287-S289 PolarHBondContact O-N 2.95Å; S289-K304 VanDerWaalsContact O-CA 3.29Å; S289-K304 WeakPolarHBondContact O-CA 3.49Å; S289-S305 PolarHBondContact N-O 3.35Å; S289-S305 PolarHBondContact O-N 2.86Å
290	Y	96.1	Very high	93.9	Very high	66 Å²	66	49.8 Å²	49.8	26%	0.259	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	127.5	172.6	176	-147	0	0	0	108.7	K302 Q303 F386 R403 C404	Y290-K302 HydrophobicContact CE2-CB 4.21Å; Y290-K302 HydrophobicContact CE2-CG 4.3Å; Y290-Q303 WeakPolarHBondContact CD2-O 3.24Å; Y290-F386 AromaticContact CD2-CE1 3.82Å; Y290-F386 HydrophobicContact CD2-CE1 3.82Å; Y290-F386 HydrophobicContact CD2-CZ 4.3Å; Y290-F386 AromaticContact CE2-CE1 3.66Å; Y290-F386 HydrophobicContact CE2-CE1 3.66Å; Y290-F386 HydrophobicContact CE2-CZ 4.29Å; Y290-R403 HydrophobicContact CD1-CB 3.3Å; Y290-R403 HydrophobicContact CD1-CG 3.94Å; Y290-R403 HydrophobicContact CD2-CB 4.35Å; Y290-R403 HydrophobicContact CE1-CB 3.65Å; Y290-R403 HydrophobicContact CE1-CG 3.78Å; Y290-R403 HydrophobicContact CE2-CG 4.37Å; Y290-R403 HydrophobicContact CG-CB 3.69Å; Y290-R403 HydrophobicContact CG-CG 4.3Å; Y290-R403 CarbonylContact O-C 3.56Å; Y290-R403 VanDerWaalsContact O-C 3.27Å; Y290-R403 VanDerWaalsContact O-CA 3.26Å; Y290-R403 WeakPolarHBondContact O-CA 3.37Å; Y290-R403 VanDerWaalsContact O-CB 3.25Å; Y290-R403 WeakPolarHBondContact O-CB 3.31Å; Y290-R403 PolarHBondContact O-N 2.82Å; Y290-C404 PolarHBondContact O-N 3.27Å; Y290-C404 PolarHBondContact O-SG 3.19Å
291	Y	96.3	Very high	93.7	Very high	2 Å²	2	53 Å²	53	1%	0.008	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	167.2	179.8	54	-90.2	0	0	0	110.5	I293 Q303 S305 L308 V400 R401	Y291-I293 HydrophobicContact CD2-CB 4.29Å; Y291-I293 HydrophobicContact CE2-CB 4.27Å; Y291-Q303 HydrophobicContact CD2-CB 3.93Å; Y291-Q303 HydrophobicContact CE1-CB 4.44Å; Y291-Q303 HydrophobicContact CE2-CB 3.47Å; Y291-Q303 VanDerWaalsContact CE2-CB 3.47Å; Y291-Q303 HydrophobicContact CE2-CG 4.13Å; Y291-Q303 PolarHBondContact N-O 2.86Å; Y291-Q303 PolarHBondContact O-N 2.85Å; Y291-Q303 VanDerWaalsContact O-O 3.08Å; Y291-S305 VanDerWaalsContact CE1-OG 3.28Å; Y291-S305 WeakPolarHBondContact CE1-OG 3.46Å; Y291-S305 PolarHBondContact OH-OG 3.5Å; Y291-L308 HydrophobicContact CE1-CB 4.5Å; Y291-L308 HydrophobicContact CE2-CB 4.35Å; Y291-L308 HydrophobicContact CE2-CD2 4.34Å; Y291-V400 HydrophobicContact CD2-CG1 4.04Å; Y291-V400 HydrophobicContact CG-CG1 4.25Å; Y291-R401 CarbonylContact C-O 3.59Å; Y291-R401 VanDerWaalsContact CA-O 3.29Å; Y291-R401 WeakPolarHBondContact CA-O 3.23Å; Y291-R401 VanDerWaalsContact CB-O 3.3Å; Y291-R401 WeakPolarHBondContact CB-O 3.23Å
292	E	95.6	Very high	93.6	Very high	20 Å²	20	58.1 Å²	58.1	9%	0.093	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	137.9	166.1	-62.4	161.4	-152	0	0	108.1	W300 E301 K302 V400 R401 R403	E292-W300 HydrophobicContact CB-CE3 3.76Å; E292-W300 HydrophobicContact CB-CZ3 4.37Å; E292-W300 WeakPolarHBondContact O-CZ3 3.32Å; E292-E301 CarbonylContact C-O 3.5Å; E292-E301 VanDerWaalsContact CA-O 3.26Å; E292-E301 WeakPolarHBondContact CA-O 3.47Å; E292-K302 HydrophobicContact CG-CG 4.04Å; E292-V400 CarbonylContact O-C 3.59Å; E292-V400 WeakPolarHBondContact O-CA 3.23Å; E292-R401 HydrophobicContact CB-CB 4.28Å; E292-R401 PolarHBondContact N-O 2.87Å; E292-R401 PolarHBondContact O-N 2.91Å; E292-R401 IonicContact OE2-CZ 2.62Å; E292-R401 IonicContact OE2-NH1 2.85Å; E292-R401 PolarHBondContact OE2-NH1 3Å; E292-R403 IonicContact OE1-CZ 3.82Å; E292-R403 VanDerWaalsContact OE1-CZ 3.29Å; E292-R403 IonicContact OE1-NE 4Å; E292-R403 PolarHBondContact OE1-NE 2.98Å; E292-R403 IonicContact OE1-NH2 3.15Å; E292-R403 PolarHBondContact OE1-NH2 3.38Å; E292-R403 IonicContact OE2-NH2 3.75Å
293	I	95.4	Very high	93.6	Very high	6 Å²	6	57.1 Å²	57.1	3%	0.031	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	137.9	178.9	-170.6	174.2	0	0	0	109.8	Y291 V295 W300 E301 Q303 L308 F375 V398 C399 V400	Y291-I293 HydrophobicContact CD2-CB 4.29Å; Y291-I293 HydrophobicContact CE2-CB 4.27Å; I293-V295 HydrophobicContact CD1-CG2 4.28Å; I293-V295 HydrophobicContact CG1-CG2 4.26Å; I293-W300 WeakPolarHBondContact O-CA 3.5Å; I293-E301 HydrophobicContact CG2-CB 4.24Å; I293-E301 PolarHBondContact N-O 2.71Å; I293-E301 PolarHBondContact O-N 3.34Å; I293-Q303 HydrophobicContact CG2-CG 3.65Å; I293-L308 HydrophobicContact CD1-CD1 3.93Å; I293-L308 HydrophobicContact CD1-CD2 3.86Å; I293-F375 HydrophobicContact CD1-CD2 4.24Å; I293-F375 HydrophobicContact CD1-CE2 4.4Å; I293-V398 HydrophobicContact CD1-CG1 3.83Å; I293-V398 HydrophobicContact CG1-CG1 3.82Å; I293-C399 CarbonylContact C-O 3.57Å; I293-C399 WeakPolarHBondContact CA-O 3.4Å; I293-V400 HydrophobicContact CG1-CG2 4.36Å
294	S	95.4	Very high	93.8	Very high	5 Å²	5	58.7 Å²	58.7	4%	0.035	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	133.7	168.5	168.2	0	0	0	0	108.3	G298 C399	S294-G298 PolarHBondContact OG-O 2.9Å; S294-C399 PolarHBondContact N-O 2.72Å; S294-C399 PolarHBondContact O-N 3.3Å
295	V	95	Very high	94.1	Very high	39 Å²	39	55.7 Å²	55.7	24%	0.236	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	127	-176.7	-179.3	0	0	0	0	108	I293 D297 G298 F375 S395	I293-V295 HydrophobicContact CD1-CG2 4.28Å; I293-V295 HydrophobicContact CG1-CG2 4.26Å; V295-D297 VanDerWaalsContact C-N 3.27Å; V295-D297 PolarHBondContact O-N 3.18Å; V295-G298 WeakPolarHBondContact O-CA 3.43Å; V295-G298 PolarHBondContact O-N 2.84Å; V295-F375 HydrophobicContact CB-CE1 4.4Å; V295-F375 HydrophobicContact CG1-CE1 3.93Å; V295-F375 HydrophobicContact CG2-CD1 4.2Å; V295-F375 HydrophobicContact CG2-CE1 3.56Å; V295-F375 HydrophobicContact CG2-CZ 3.9Å; V295-S395 VanDerWaalsContact CG1-CB 3.5Å
296	D	94.6	Very high	94.5	Very high	71 Å²	71	51.7 Å²	51.7	38%	0.38	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.4	47.7	179.5	-62.5	-45.8	0	0	0	113.1	G298 S395 S396 K397	D296-G298 PolarHBondContact O-N 2.78Å; D296-G298 VanDerWaalsContact O-N 3.08Å; D296-S395 WeakPolarHBondContact OD2-CA 3.43Å; D296-S395 WeakPolarHBondContact OD2-CB 3.26Å; D296-S396 WeakPolarHBondContact OD1-CA 3.33Å; D296-S396 PolarHBondContact OD1-N 3.1Å; D296-S396 PolarHBondContact OD1-OG 2.66Å; D296-K397 PolarHBondContact N-O 3.34Å; D296-K397 PolarHBondContact OD1-N 2.75Å
297	D	94.6	Very high	94.9	Very high	115 Å²	115	46.8 Å²	46.8	62%	0.615	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	17.8	-178.6	-60.6	-51	0	0	0	114.6	V295 K397	V295-D297 VanDerWaalsContact C-N 3.27Å; V295-D297 PolarHBondContact O-N 3.18Å; D297-K397 WeakPolarHBondContact OD1-CE 3.43Å; D297-K397 IonicContact OD1-NZ 2.76Å; D297-K397 PolarHBondContact OD1-NZ 2.69Å; D297-K397 IonicContact OD2-NZ 3.99Å; D297-K397 PolarHBondContact OD2-NZ 2.9Å
298	G	93.6	Very high	95.1	Very high	27 Å²	27	42.2 Å²	42.2	28%	0.278	22%	0.224	S	C	.	.			trans	-71	179.5	171.4	0	0	0	0	0	113.6	S294 V295 D296	S294-G298 PolarHBondContact OG-O 2.9Å; V295-G298 WeakPolarHBondContact O-CA 3.43Å; V295-G298 PolarHBondContact O-N 2.84Å; D296-G298 PolarHBondContact O-N 2.78Å; D296-G298 VanDerWaalsContact O-N 3.08Å
299	P	93.7	Very high	95.3	Very high	109 Å²	109	40.6 Å²	40.6	71%	0.708	21%	0.211	S	C	*	.			trans	-61.2	148.6	-179.6	27.5	-35	0	0	0	111.9	E301	P299-E301 PolarHBondContact O-N 3.49Å
300	W	93.9	Very high	95.3	Very high	101 Å²	101	40.5 Å²	40.5	38%	0.383	21%	0.21	S	C	.	.			trans	-74.2	124.8	174	-70.9	89.1	0	0	0	110.7	E292 I293 C399 R401 I424	E292-W300 HydrophobicContact CB-CE3 3.76Å; E292-W300 HydrophobicContact CB-CZ3 4.37Å; E292-W300 WeakPolarHBondContact O-CZ3 3.32Å; I293-W300 WeakPolarHBondContact O-CA 3.5Å; W300-C399 HydrophobicContact CH2-CB 3.62Å; W300-C399 HydrophobicContact CZ2-CB 4.09Å; W300-C399 HydrophobicContact CZ3-CB 4.35Å; W300-R401 HydrophobicContact CH2-CB 4.26Å; W300-R401 HydrophobicContact CZ3-CB 3.87Å; W300-I424 HydrophobicContact CH2-CG2 4.5Å
301	E	92.9	Very high	95.4	Very high	69 Å²	69	37.4 Å²	37.4	32%	0.322	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133	176.2	-64.5	-171.5	178	0	0	110.8	E292 I293 P299 Q303 S389	E292-E301 CarbonylContact C-O 3.5Å; E292-E301 VanDerWaalsContact CA-O 3.26Å; E292-E301 WeakPolarHBondContact CA-O 3.47Å; I293-E301 HydrophobicContact CG2-CB 4.24Å; I293-E301 PolarHBondContact N-O 2.71Å; I293-E301 PolarHBondContact O-N 3.34Å; P299-E301 PolarHBondContact O-N 3.49Å; E301-Q303 PolarHBondContact OE2-NE2 2.83Å; E301-S389 PolarHBondContact OE1-OG 3.09Å; E301-S389 VanDerWaalsContact OE1-OG 3.12Å; E301-S389 PolarHBondContact OE2-OG 3.45Å
302	K	94.2	Very high	95.5	Very high	112 Å²	112	37.3 Å²	37.3	49%	0.487	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	125.1	172.9	-71.9	177.2	179.8	177.6	0	109.9	Y290 E292 F386	Y290-K302 HydrophobicContact CE2-CB 4.21Å; Y290-K302 HydrophobicContact CE2-CG 4.3Å; E292-K302 HydrophobicContact CG-CG 4.04Å; K302-F386 HydrophobicContact CB-CD1 4.39Å; K302-F386 HydrophobicContact CB-CE1 4.42Å
303	Q	94.9	Very high	95.6	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	137.8	179.9	-68.7	-58.1	-28.2	0	0	111.2	Y290 Y291 I293 E301 I377 S387	Y290-Q303 WeakPolarHBondContact CD2-O 3.24Å; Y291-Q303 HydrophobicContact CD2-CB 3.93Å; Y291-Q303 HydrophobicContact CE1-CB 4.44Å; Y291-Q303 HydrophobicContact CE2-CB 3.47Å; Y291-Q303 VanDerWaalsContact CE2-CB 3.47Å; Y291-Q303 HydrophobicContact CE2-CG 4.13Å; Y291-Q303 PolarHBondContact N-O 2.86Å; Y291-Q303 PolarHBondContact O-N 2.85Å; Y291-Q303 VanDerWaalsContact O-O 3.08Å; I293-Q303 HydrophobicContact CG2-CG 3.65Å; E301-Q303 PolarHBondContact OE2-NE2 2.83Å; Q303-I377 HydrophobicContact CG-CD1 3.98Å; Q303-S387 PolarHBondContact NE2-O 2.86Å
304	K	95.3	Very high	95.7	Very high	71 Å²	71	36.4 Å²	36.4	31%	0.309	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	124.4	171.8	-165.2	176.9	-179	169.9	0	109.3	A288 S289 I381 F386	A288-K304 HydrophobicContact CB-CD 4.46Å; A288-K304 HydrophobicContact CB-CG 4.12Å; S289-K304 VanDerWaalsContact O-CA 3.29Å; S289-K304 WeakPolarHBondContact O-CA 3.49Å; K304-I381 HydrophobicContact CB-CB 4.41Å; K304-I381 HydrophobicContact CD-CD1 4.15Å; K304-I381 HydrophobicContact CG-CD1 4.02Å; K304-I381 WeakPolarHBondContact O-CB 3.38Å; K304-I381 PolarHBondContact O-N 2.9Å; K304-F386 HydrophobicContact CB-CD1 3.75Å; K304-F386 HydrophobicContact CB-CD2 3.99Å; K304-F386 HydrophobicContact CB-CE1 3.81Å; K304-F386 HydrophobicContact CB-CE2 4.05Å; K304-F386 HydrophobicContact CB-CG 3.85Å; K304-F386 HydrophobicContact CB-CZ 3.96Å; K304-F386 HydrophobicContact CD-CD2 4.21Å; K304-F386 HydrophobicContact CD-CE2 3.67Å; K304-F386 HydrophobicContact CD-CZ 3.87Å; K304-F386 HydrophobicContact CG-CE2 4.5Å; K304-F386 HydrophobicContact CG-CZ 4.48Å
305	S	95.6	Very high	95.8	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.007	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	-178.5	-167.6	63	0	0	0	0	111.2	A288 S289 Y291 G307 R378	A288-S305 CarbonylContact C-O 3.56Å; S289-S305 PolarHBondContact N-O 3.35Å; S289-S305 PolarHBondContact O-N 2.86Å; Y291-S305 VanDerWaalsContact CE1-OG 3.28Å; Y291-S305 WeakPolarHBondContact CE1-OG 3.46Å; Y291-S305 PolarHBondContact OH-OG 3.5Å; S305-G307 PolarHBondContact O-N 2.86Å; S305-G307 PolarHBondContact OG-N 2.98Å; S305-G307 PolarHBondContact OG-O 3.27Å; S305-R378 VanDerWaalsContact CB-O 3.31Å; S305-R378 WeakPolarHBondContact CB-O 3.48Å
306	S	95.9	Very high	95.9	Very high	36 Å²	36	34.3 Å²	34.3	25%	0.252	18%	0.181	S	C	.	.	S	Bend	trans	-79.1	1.9	170.5	-59.7	0	0	0	0	113.5	R378 E379	S306-R378 WeakPolarHBondContact CB-O 3.44Å; S306-R378 PolarHBondContact N-O 3.31Å; S306-E379 WeakPolarHBondContact CB-OE2 3.39Å; S306-E379 PolarHBondContact OG-OE2 2.88Å
307	G	96	Very high	95.9	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.186	C	C	.	.			trans	136	177.6	178.3	0	0	0	0	0	112.8	I280 S305 R378	I280-G307 CarbonylContact O-C 3.6Å; I280-G307 WeakPolarHBondContact O-CA 3.34Å; S305-G307 PolarHBondContact O-N 2.86Å; S305-G307 PolarHBondContact OG-N 2.98Å; S305-G307 PolarHBondContact OG-O 3.27Å; G307-R378 PolarHBondContact O-N 2.75Å
308	L	97.3	Very high	95.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	128.7	180	-179.3	68.8	0	0	0	109.2	F279 I280 Y291 I293 L310 F375 I377 V400	F279-L308 CarbonylContact C-O 3.49Å; F279-L308 WeakPolarHBondContact CA-O 3.21Å; F279-L308 VanDerWaalsContact CD2-O 3.28Å; F279-L308 WeakPolarHBondContact CD2-O 3.19Å; I280-L308 HydrophobicContact CB-CB 4.47Å; I280-L308 PolarHBondContact N-O 2.91Å; I280-L308 PolarHBondContact O-N 2.84Å; Y291-L308 HydrophobicContact CE1-CB 4.5Å; Y291-L308 HydrophobicContact CE2-CB 4.35Å; Y291-L308 HydrophobicContact CE2-CD2 4.34Å; I293-L308 HydrophobicContact CD1-CD1 3.93Å; I293-L308 HydrophobicContact CD1-CD2 3.86Å; L308-L310 HydrophobicContact CD2-CD1 3.86Å; L308-L310 HydrophobicContact CD2-CG 4.38Å; L308-L310 HydrophobicContact CG-CD1 3.88Å; L308-L310 HydrophobicContact CG-CG 4.33Å; L308-F375 HydrophobicContact CD1-CB 4.4Å; L308-F375 HydrophobicContact CD1-CD2 4.14Å; L308-I377 HydrophobicContact CD1-CG1 3.99Å; L308-V400 HydrophobicContact CD2-CG1 4.49Å; L308-V400 HydrophobicContact CD2-CG2 3.42Å; L308-V400 VanDerWaalsContact CD2-CG2 3.42Å
309	N	98	Very high	95.9	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	132.2	172.4	173.9	-91.7	0	0	0	109.5	F279 I323 F375 S376	F279-N309 HydrophobicContact CD2-CB 4.39Å; N309-I323 HydrophobicContact CB-CD1 3.77Å; N309-F375 CarbonylContact O-C 3.2Å; N309-F375 VanDerWaalsContact O-CA 3.28Å; N309-F375 WeakPolarHBondContact O-CA 3.31Å; N309-S376 PolarHBondContact N-O 2.88Å; N309-S376 PolarHBondContact O-N 2.88Å
310	L	98.1	Very high	96	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	115.3	174.5	-54.1	95.8	0	0	0	107.9	I222 E277 V278 I280 L308 I373 F375 V398 M427	I222-L310 HydrophobicContact CD1-CB 4.23Å; I222-L310 WeakPolarHBondContact CD1-O 3.32Å; E277-L310 CarbonylContact C-O 3.51Å; E277-L310 WeakPolarHBondContact CA-O 3.43Å; E277-L310 VanDerWaalsContact CB-O 3.26Å; E277-L310 WeakPolarHBondContact CB-O 3.49Å; V278-L310 HydrophobicContact CB-CB 4.42Å; V278-L310 HydrophobicContact CB-CD1 4.23Å; V278-L310 HydrophobicContact CG1-CD1 4.45Å; V278-L310 PolarHBondContact N-O 2.77Å; V278-L310 PolarHBondContact O-N 2.82Å; I280-L310 HydrophobicContact CD1-CD1 4.38Å; L308-L310 HydrophobicContact CD2-CD1 3.86Å; L308-L310 HydrophobicContact CD2-CG 4.38Å; L308-L310 HydrophobicContact CG-CD1 3.88Å; L308-L310 HydrophobicContact CG-CG 4.33Å; L310-I373 HydrophobicContact CB-CG2 3.82Å; L310-I373 HydrophobicContact CD2-CG2 4.29Å; L310-F375 HydrophobicContact CD2-CB 4.48Å; L310-F375 HydrophobicContact CG-CB 4.31Å; L310-V398 HydrophobicContact CD2-CB 3.54Å; L310-V398 HydrophobicContact CD2-CG1 3.7Å; L310-V398 HydrophobicContact CD2-CG2 3.81Å; L310-M427 HydrophobicContact CD1-CE 4.35Å; L310-M427 HydrophobicContact CD1-SD 3.7Å; L310-M427 HydrophobicContact CD2-CB 4.31Å; L310-M427 HydrophobicContact CD2-CE 3.93Å; L310-M427 HydrophobicContact CD2-SD 3.67Å; L310-M427 HydrophobicContact CG-SD 4.27Å
311	C	97.3	Very high	96.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	158	-178.2	69.9	0	0	0	0	112.8	N276 E277 S320 Y366 I373 L374	N276-C311 CarbonylContact O-C 3.57Å; N276-C311 VanDerWaalsContact O-CA 3.26Å; N276-C311 WeakPolarHBondContact O-CA 3.29Å; N276-C311 WeakPolarHBondContact O-CB 3.49Å; E277-C311 HydrophobicContact CB-CB 3.9Å; C311-S320 WeakPolarHBondContact SG-CB 3.21Å; C311-S320 PolarHBondContact SG-OG 3.37Å; C311-Y366 PolarHBondContact O-OH 2.77Å; C311-I373 WeakPolarHBondContact O-CA 3.4Å; C311-L374 PolarHBondContact N-O 3.11Å; C311-L374 PolarHBondContact O-N 3.37Å
312	T	98.3	Very high	96.2	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.134	C	C	.	.			trans	-91.7	174.9	167.7	74.7	0	0	0	0	110.6	I222 L275 N276 T314 G315 S316 Y366	I222-T312 HydrophobicContact CD1-CG2 4.06Å; I222-T312 HydrophobicContact CG1-CG2 3.64Å; L275-T312 PolarHBondContact O-OG1 3.36Å; N276-T312 PolarHBondContact O-N 2.87Å; T312-T314 PolarHBondContact O-N 3.27Å; T312-T314 PolarHBondContact OG1-N 3.33Å; T312-T314 VanDerWaalsContact OG1-N 3.09Å; T312-G315 CarbonylContact O-C 3.56Å; T312-G315 PolarHBondContact O-N 3.22Å; T312-G315 PolarHBondContact OG1-N 3.46Å; T312-S316 PolarHBondContact O-N 2.91Å; T312-Y366 VanDerWaalsContact CA-OH 3.28Å; T312-Y366 WeakPolarHBondContact CA-OH 3.47Å; T312-Y366 PolarHBondContact O-OH 3.13Å
313	G	97.6	Very high	96.3	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.01	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-27.3	172.7	0	0	0	0	0	112.9	S316 Y366	G313-S316 WeakPolarHBondContact O-CB 3.35Å; G313-S316 PolarHBondContact O-OG 2.74Å; G313-Y366 VanDerWaalsContact CA-CZ 3.49Å; G313-Y366 PolarHBondContact N-OH 3.42Å
314	T	97.6	Very high	96.3	Very high	7 Å²	7	26 Å²	26	4%	0.043	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-45.8	171.6	-60.6	0	0	0	0	111	L192 R219 L275 N276 T312 S316 P368	L192-T314 HydrophobicContact CD1-CG2 4.47Å; L192-T314 HydrophobicContact CD2-CG2 3.28Å; R219-T314 VanDerWaalsContact NH1-CG2 3.34Å; R219-T314 PolarHBondContact NH1-OG1 2.85Å; L275-T314 HydrophobicContact CD1-CG2 4.14Å; L275-T314 HydrophobicContact CG-CG2 4.02Å; N276-T314 WeakPolarHBondContact OD1-CG2 3.28Å; T312-T314 PolarHBondContact O-N 3.27Å; T312-T314 PolarHBondContact OG1-N 3.33Å; T312-T314 VanDerWaalsContact OG1-N 3.09Å; T314-S316 PolarHBondContact O-N 2.81Å; T314-P368 WeakPolarHBondContact OG1-CB 3.46Å
315	G	97.3	Very high	96.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-69.3	-14.8	177.1	0	0	0	0	0	114.7	T312 K317 A318	T312-G315 CarbonylContact O-C 3.56Å; T312-G315 PolarHBondContact O-N 3.22Å; T312-G315 PolarHBondContact OG1-N 3.46Å; G315-K317 PolarHBondContact O-N 3.44Å; G315-A318 WeakPolarHBondContact O-CB 3.28Å; G315-A318 PolarHBondContact O-N 2.94Å
316	S	96.8	Very high	96.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-59.8	-18.6	177.5	76.5	0	0	0	0	114	T312 G313 T314 F321 L365	T312-S316 PolarHBondContact O-N 2.91Å; G313-S316 WeakPolarHBondContact O-CB 3.35Å; G313-S316 PolarHBondContact O-OG 2.74Å; T314-S316 PolarHBondContact O-N 2.81Å; S316-F321 VanDerWaalsContact O-CB 3.24Å; S316-F321 WeakPolarHBondContact O-CB 3.38Å; S316-L365 WeakPolarHBondContact O-CD2 3.48Å
317	K	94.3	Very high	96.4	Very high	113 Å²	113	32 Å²	32	49%	0.491	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-98.1	-4	174.7	-63.7	179.5	-178.7	-176	0	113.7	G315 L365	G315-K317 PolarHBondContact O-N 3.44Å; K317-L365 HydrophobicContact CG-CD2 3.86Å
318	A	94.4	Very high	96.4	Very high	27 Å²	27	34.8 Å²	34.8	22%	0.223	18%	0.178	C	C	.	.	S	Bend	trans	-102.1	-131.9	-172	0	0	0	0	0	111.5	G315 S320 F321 N322	G315-A318 WeakPolarHBondContact O-CB 3.28Å; G315-A318 PolarHBondContact O-N 2.94Å; A318-S320 VanDerWaalsContact C-N 3.35Å; A318-S320 PolarHBondContact O-N 3.28Å; A318-F321 WeakPolarHBondContact O-CB 3.34Å; A318-F321 PolarHBondContact O-N 3.41Å; A318-N322 PolarHBondContact O-ND2 3.02Å
319	W	95.1	Very high	96.4	Very high	100 Å²	100	40.1 Å²	40.1	38%	0.379	20%	0.203	S	C	.	.	H	α-helix	trans	-66.3	-38.4	-177.3	-178.6	42.5	0	0	0	112.2	E277 F279 F321 N322 I323	E277-W319 HydrophobicContact CG-CE3 4.3Å; F279-W319 HydrophobicContact CB-CH2 4.26Å; F279-W319 HydrophobicContact CB-CZ3 3.65Å; F279-W319 HydrophobicContact CD1-CH2 4.18Å; F279-W319 HydrophobicContact CD1-CZ3 4.36Å; F279-W319 AromaticContact CD2-CH2 3.33Å; F279-W319 HydrophobicContact CD2-CH2 3.33Å; F279-W319 AromaticContact CD2-CZ3 3.52Å; F279-W319 HydrophobicContact CD2-CZ3 3.52Å; F279-W319 HydrophobicContact CE1-CH2 4.41Å; F279-W319 AromaticContact CE2-CH2 3.61Å; F279-W319 HydrophobicContact CE2-CH2 3.61Å; F279-W319 HydrophobicContact CE2-CZ3 4.28Å; F279-W319 AromaticContact CG-CH2 3.64Å; F279-W319 HydrophobicContact CG-CH2 3.64Å; F279-W319 AromaticContact CG-CZ3 3.56Å; F279-W319 HydrophobicContact CG-CZ3 3.56Å; F279-W319 HydrophobicContact CZ-CH2 4.15Å; W319-F321 VanDerWaalsContact C-N 3.28Å; W319-F321 PolarHBondContact O-N 3.01Å; W319-N322 PolarHBondContact O-N 2.84Å; W319-I323 HydrophobicContact CD2-CG2 4.46Å; W319-I323 HydrophobicContact CG-CG2 4.46Å; W319-I323 HydrophobicContact CZ2-CG2 4.21Å; W319-I323 PolarHBondContact O-N 3.41Å; W319-I323 VanDerWaalsContact O-N 3.16Å
320	S	95.9	Very high	96.4	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.014	22%	0.22	C	C	.	.	H	α-helix	trans	-52.6	-43.6	175.6	175.8	0	0	0	0	112.6	C311 A318 N322 I323 N324	C311-S320 WeakPolarHBondContact SG-CB 3.21Å; C311-S320 PolarHBondContact SG-OG 3.37Å; A318-S320 VanDerWaalsContact C-N 3.35Å; A318-S320 PolarHBondContact O-N 3.28Å; S320-N322 VanDerWaalsContact C-N 3.32Å; S320-N322 PolarHBondContact O-N 3.15Å; S320-I323 VanDerWaalsContact O-CG1 3.28Å; S320-I323 WeakPolarHBondContact O-CG1 2.91Å; S320-N324 WeakPolarHBondContact O-CB 3.44Å; S320-N324 PolarHBondContact O-N 3.33Å; S320-N324 PolarHBondContact O-ND2 3.43Å; S320-N324 PolarHBondContact OG-ND2 3.16Å
321	F	96	Very high	96.3	Very high	41 Å²	41	43.1 Å²	43.1	18%	0.18	23%	0.225	C	C	.	.	H	α-helix	trans	-54.8	-50	175.3	-172.9	-106.8	0	0	0	111.8	S316 A318 W319 I323 N324 R325 N361 L364 L365	S316-F321 VanDerWaalsContact O-CB 3.24Å; S316-F321 WeakPolarHBondContact O-CB 3.38Å; A318-F321 WeakPolarHBondContact O-CB 3.34Å; A318-F321 PolarHBondContact O-N 3.41Å; W319-F321 VanDerWaalsContact C-N 3.28Å; W319-F321 PolarHBondContact O-N 3.01Å; F321-I323 PolarHBondContact O-N 2.98Å; F321-N324 PolarHBondContact O-N 3.38Å; F321-N324 VanDerWaalsContact O-N 3.15Å; F321-R325 HydrophobicContact CE1-CB 4.3Å; F321-R325 HydrophobicContact CZ-CB 4.43Å; F321-R325 WeakPolarHBondContact O-CB 3.36Å; F321-R325 PolarHBondContact O-N 3.39Å; F321-N361 HydrophobicContact CE2-CB 4.29Å; F321-N361 WeakPolarHBondContact CE2-O 3.48Å; F321-N361 HydrophobicContact CZ-CB 4.09Å; F321-L364 HydrophobicContact CD2-CB 4.35Å; F321-L364 HydrophobicContact CD2-CD1 4.45Å; F321-L365 HydrophobicContact CD2-CD2 3.59Å; F321-L365 HydrophobicContact CD2-CG 4.4Å; F321-L365 HydrophobicContact CE2-CD2 3.88Å; F321-L365 HydrophobicContact CE2-CG 4.25Å
322	N	95.1	Very high	96.2	Very high	78 Å²	78	46.9 Å²	46.9	42%	0.417	24%	0.243	S	C	.	.	H	α-helix	trans	-71.6	-29.9	-168.7	-75.5	-77.9	0	0	0	112.9	A318 W319 S320 N324 R325	A318-N322 PolarHBondContact O-ND2 3.02Å; W319-N322 PolarHBondContact O-N 2.84Å; S320-N322 VanDerWaalsContact C-N 3.32Å; S320-N322 PolarHBondContact O-N 3.15Å; N322-N324 VanDerWaalsContact C-N 3.34Å; N322-R325 VanDerWaalsContact OD1-CZ 3.3Å; N322-R325 PolarHBondContact OD1-NH1 2.85Å
323	I	94.8	Very high	96.1	Very high	52 Å²	52	50.5 Å²	50.5	27%	0.267	26%	0.263	S	S	.	.	H	α-helix	trans	-81.3	-17.4	174.8	64.7	174.3	0	0	0	112.7	N309 W319 S320 F321	N309-I323 HydrophobicContact CB-CD1 3.77Å; W319-I323 HydrophobicContact CD2-CG2 4.46Å; W319-I323 HydrophobicContact CG-CG2 4.46Å; W319-I323 HydrophobicContact CZ2-CG2 4.21Å; W319-I323 PolarHBondContact O-N 3.41Å; W319-I323 VanDerWaalsContact O-N 3.16Å; S320-I323 VanDerWaalsContact O-CG1 3.28Å; S320-I323 WeakPolarHBondContact O-CG1 2.91Å; F321-I323 PolarHBondContact O-N 2.98Å
324	N	95.7	Very high	95.9	Very high	16 Å²	16	55 Å²	55	9%	0.086	29%	0.29	C	S	.	.	H	α-helix	trans	-108.1	-20.3	-172.5	-78.4	-55.4	0	0	0	114.5	S320 F321 N322 L364 S376 R392	S320-N324 WeakPolarHBondContact O-CB 3.44Å; S320-N324 PolarHBondContact O-N 3.33Å; S320-N324 PolarHBondContact O-ND2 3.43Å; S320-N324 PolarHBondContact OG-ND2 3.16Å; F321-N324 PolarHBondContact O-N 3.38Å; F321-N324 VanDerWaalsContact O-N 3.15Å; N322-N324 VanDerWaalsContact C-N 3.34Å; N324-L364 VanDerWaalsContact C-CD1 3.5Å; N324-L364 HydrophobicContact CB-CD1 3.86Å; N324-L364 HydrophobicContact CB-CD2 4.18Å; N324-S376 PolarHBondContact ND2-OG 2.91Å; N324-R392 PolarHBondContact O-NH1 2.9Å; N324-R392 WeakPolarHBondContact OD1-CD 3.26Å; N324-R392 PolarHBondContact OD1-NH1 3.35Å
325	R	95.9	Very high	95.8	Very high	132 Å²	132	56.4 Å²	56.4	50%	0.498	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-65.3	152.1	177.7	70.8	178.2	-176.8	-176.8	-2.7	111.8	F321 N322 N361 L364	F321-R325 HydrophobicContact CE1-CB 4.3Å; F321-R325 HydrophobicContact CZ-CB 4.43Å; F321-R325 WeakPolarHBondContact O-CB 3.36Å; F321-R325 PolarHBondContact O-N 3.39Å; N322-R325 VanDerWaalsContact OD1-CZ 3.3Å; N322-R325 PolarHBondContact OD1-NH1 2.85Å; R325-N361 WeakPolarHBondContact CA-OD1 3.27Å; R325-N361 VanDerWaalsContact CB-OD1 3.26Å; R325-N361 WeakPolarHBondContact CB-OD1 3.4Å; R325-L364 HydrophobicContact CB-CD1 4.26Å
326	V	96.7	Very high	95.5	Very high	38 Å²	38	59.2 Å²	59.2	23%	0.23	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-101.9	144	171	-65.7	0	0	0	0	110.3	V331 T357 Y360 N361	V326-V331 HydrophobicContact CB-CG2 4.16Å; V326-V331 HydrophobicContact CG2-CG2 3.55Å; V326-T357 HydrophobicContact CG2-CG2 4.36Å; V326-Y360 HydrophobicContact CB-CD1 4.25Å; V326-Y360 HydrophobicContact CB-CE1 4.11Å; V326-Y360 HydrophobicContact CG1-CD1 4.03Å; V326-Y360 HydrophobicContact CG1-CE1 3.47Å; V326-Y360 VanDerWaalsContact CG1-CE1 3.47Å; V326-Y360 HydrophobicContact CG2-CD1 3.4Å; V326-Y360 VanDerWaalsContact CG2-CD1 3.4Å; V326-Y360 HydrophobicContact CG2-CE1 3.77Å; V326-Y360 HydrophobicContact CG2-CG 4.03Å; V326-N361 PolarHBondContact N-OD1 2.97Å; V326-N361 PolarHBondContact O-ND2 3.31Å; V326-N361 VanDerWaalsContact O-ND2 3.15Å
327	A	96.7	Very high	95.4	Very high	64 Å²	64	63.1 Å²	63.1	53%	0.529	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-81.2	147.4	170.4	0	0	0	0	0	109.9	Q329 A330 V331	A327-Q329 PolarHBondContact O-N 2.87Å; A327-Q329 VanDerWaalsContact O-N 3.16Å; A327-A330 WeakPolarHBondContact O-CB 3.49Å; A327-A330 PolarHBondContact O-N 3.23Å; A327-V331 PolarHBondContact O-N 3.32Å
328	T	96.4	Very high	95.3	Very high	60 Å²	60	59.4 Å²	59.4	37%	0.368	32%	0.322	S	S	.	.	H	α-helix	trans	-51.2	-40.7	176.7	-47.9	0	0	0	0	112.1	A330 V331 E332 V353 E354	T328-A330 VanDerWaalsContact C-N 3.34Å; T328-A330 PolarHBondContact O-N 2.91Å; T328-V331 PolarHBondContact O-N 3.48Å; T328-E332 PolarHBondContact O-N 2.82Å; T328-V353 HydrophobicContact CG2-CG1 3.61Å; T328-E354 HydrophobicContact CG2-CG 4.32Å
329	Q	96.8	Very high	95.1	Very high	112 Å²	112	62.7 Å²	62.7	52%	0.523	33%	0.331	S	S	.	.	H	α-helix	trans	-58.2	-43.5	176.5	-173	63.9	59.2	0	0	112.5	A327 V331 E332 D333	A327-Q329 PolarHBondContact O-N 2.87Å; A327-Q329 VanDerWaalsContact O-N 3.16Å; Q329-V331 VanDerWaalsContact C-N 3.33Å; Q329-V331 PolarHBondContact O-N 2.66Å; Q329-E332 PolarHBondContact O-N 3.16Å; Q329-D333 PolarHBondContact NE2-OD1 3.4Å; Q329-D333 WeakPolarHBondContact O-CB 3.22Å; Q329-D333 PolarHBondContact O-N 3.27Å
330	A	96.8	Very high	95	Very high	45 Å²	45	67.3 Å²	67.3	37%	0.372	35%	0.348	S	S	.	.	H	α-helix	trans	-66.3	-38	-178.8	0	0	0	0	0	111.5	A327 T328 V334	A327-A330 WeakPolarHBondContact O-CB 3.49Å; A327-A330 PolarHBondContact O-N 3.23Å; T328-A330 VanDerWaalsContact C-N 3.34Å; T328-A330 PolarHBondContact O-N 2.91Å; A330-V334 VanDerWaalsContact O-CG2 3.29Å; A330-V334 WeakPolarHBondContact O-CG2 3.37Å; A330-V334 PolarHBondContact O-N 2.95Å; A330-V334 VanDerWaalsContact O-N 3.13Å
331	V	96.5	Very high	94.8	Very high	17 Å²	17	73.6 Å²	73.6	10%	0.103	38%	0.378	C	S	.	.	H	α-helix	trans	-66.1	-45.1	175.5	177.8	0	0	0	0	110.5	V326 A327 T328 Q329 D333 V334 L335 V353 V356 T357	V326-V331 HydrophobicContact CB-CG2 4.16Å; V326-V331 HydrophobicContact CG2-CG2 3.55Å; A327-V331 PolarHBondContact O-N 3.32Å; T328-V331 PolarHBondContact O-N 3.48Å; Q329-V331 VanDerWaalsContact C-N 3.33Å; Q329-V331 PolarHBondContact O-N 2.66Å; V331-D333 PolarHBondContact O-N 2.94Å; V331-V334 PolarHBondContact O-N 3.13Å; V331-L335 HydrophobicContact CG1-CD1 3.85Å; V331-L335 HydrophobicContact CG1-CG 4.35Å; V331-L335 WeakPolarHBondContact O-CB 3.21Å; V331-L335 VanDerWaalsContact O-CG 3.3Å; V331-L335 WeakPolarHBondContact O-CG 3.42Å; V331-L335 PolarHBondContact O-N 3.39Å; V331-V353 HydrophobicContact CB-CG1 4.21Å; V331-V353 HydrophobicContact CG1-CG1 4.12Å; V331-V356 HydrophobicContact CG1-CB 4.18Å; V331-V356 HydrophobicContact CG1-CG1 3.8Å; V331-T357 WeakPolarHBondContact CG2-OG1 3.29Å
332	E	95.4	Very high	94.3	Very high	80 Å²	80	74.6 Å²	74.6	37%	0.374	40%	0.4	S	S	.	.	H	α-helix	trans	-58	-47	175.7	-177.4	168.7	-155.6	0	0	112	T328 Q329 V334 L335 N336 V353	T328-E332 PolarHBondContact O-N 2.82Å; Q329-E332 PolarHBondContact O-N 3.16Å; E332-V334 PolarHBondContact O-N 3.05Å; E332-L335 PolarHBondContact O-N 3.48Å; E332-N336 WeakPolarHBondContact CG-ND2 3.3Å; E332-N336 VanDerWaalsContact O-CB 3.31Å; E332-N336 WeakPolarHBondContact O-CB 3.5Å; E332-N336 PolarHBondContact O-N 2.59Å; E332-N336 PolarHBondContact O-ND2 3.16Å; E332-N336 VanDerWaalsContact O-ND2 3.11Å; E332-V353 HydrophobicContact CB-CG1 3.92Å; E332-V353 HydrophobicContact CB-CG2 4.39Å
333	D	95.8	Very high	93.6	Very high	76 Å²	76	77.4 Å²	77.4	41%	0.406	41%	0.414	S	S	.	.	H	α-helix	trans	-60.1	-45.4	179.6	-67	-19.5	0	0	0	111.5	Q329 V331 N336 I337	Q329-D333 PolarHBondContact NE2-OD1 3.4Å; Q329-D333 WeakPolarHBondContact O-CB 3.22Å; Q329-D333 PolarHBondContact O-N 3.27Å; V331-D333 PolarHBondContact O-N 2.94Å; D333-N336 PolarHBondContact O-N 3.21Å; D333-I337 WeakPolarHBondContact O-CD1 3.26Å; D333-I337 VanDerWaalsContact O-CG1 3.28Å; D333-I337 WeakPolarHBondContact O-CG1 3.28Å; D333-I337 PolarHBondContact O-N 3.14Å
334	V	95	Very high	93	Very high	96 Å²	96	77 Å²	77	58%	0.582	41%	0.412	S	S	*	.	H	α-helix	trans	-63.5	-46.6	177.9	170.3	0	0	0	0	111.4	A330 V331 E332 N336 I337 A338	A330-V334 VanDerWaalsContact O-CG2 3.29Å; A330-V334 WeakPolarHBondContact O-CG2 3.37Å; A330-V334 PolarHBondContact O-N 2.95Å; A330-V334 VanDerWaalsContact O-N 3.13Å; V331-V334 PolarHBondContact O-N 3.13Å; E332-V334 PolarHBondContact O-N 3.05Å; V334-N336 VanDerWaalsContact C-N 3.33Å; V334-N336 PolarHBondContact O-N 3.5Å; V334-I337 WeakPolarHBondContact O-CB 3.46Å; V334-I337 PolarHBondContact O-N 3.12Å; V334-A338 PolarHBondContact O-N 2.95Å
335	L	93.8	Very high	92.2	Very high	35 Å²	35	82 Å²	82	18%	0.183	45%	0.449	C	S	.	.	H	α-helix	trans	-64.3	-38.9	179.1	-71.8	175.1	0	0	0	111.8	V331 E332 A338 K339 L344 L348 V353	V331-L335 HydrophobicContact CG1-CD1 3.85Å; V331-L335 HydrophobicContact CG1-CG 4.35Å; V331-L335 WeakPolarHBondContact O-CB 3.21Å; V331-L335 VanDerWaalsContact O-CG 3.3Å; V331-L335 WeakPolarHBondContact O-CG 3.42Å; V331-L335 PolarHBondContact O-N 3.39Å; E332-L335 PolarHBondContact O-N 3.48Å; L335-A338 PolarHBondContact O-N 2.94Å; L335-K339 WeakPolarHBondContact O-CB 3.37Å; L335-K339 PolarHBondContact O-N 2.74Å; L335-L344 HydrophobicContact CD2-CD2 4.39Å; L335-L348 HydrophobicContact CB-CD1 3.99Å; L335-L348 HydrophobicContact CB-CD2 3.77Å; L335-L348 HydrophobicContact CD1-CD2 4.11Å; L335-L348 HydrophobicContact CG-CD2 4.38Å; L335-V353 HydrophobicContact CD1-CG2 4.19Å
336	N	92.6	Very high	91.5	Very high	59 Å²	59	80.7 Å²	80.7	32%	0.316	45%	0.451	S	S	.	.	H	α-helix	trans	-64.2	-37.9	174.3	-80.4	-39.9	0	0	0	112.3	E332 D333 V334 R340 L348	E332-N336 WeakPolarHBondContact CG-ND2 3.3Å; E332-N336 VanDerWaalsContact O-CB 3.31Å; E332-N336 WeakPolarHBondContact O-CB 3.5Å; E332-N336 PolarHBondContact O-N 2.59Å; E332-N336 PolarHBondContact O-ND2 3.16Å; E332-N336 VanDerWaalsContact O-ND2 3.11Å; D333-N336 PolarHBondContact O-N 3.21Å; V334-N336 VanDerWaalsContact C-N 3.33Å; V334-N336 PolarHBondContact O-N 3.5Å; N336-R340 WeakPolarHBondContact O-CG 3.44Å; N336-R340 PolarHBondContact O-N 3.48Å; N336-R340 VanDerWaalsContact O-N 3.07Å; N336-L348 VanDerWaalsContact OD1-CD1 3.25Å; N336-L348 WeakPolarHBondContact OD1-CD1 3.44Å
337	I	94	Very high	90.8	Very high	83 Å²	83	83.5 Å²	83.5	43%	0.426	47%	0.47	S	S	.	.	H	α-helix	trans	-62.9	-48.1	172.2	-68.2	160.2	0	0	0	110.4	D333 V334 K339 R340 Q341	D333-I337 WeakPolarHBondContact O-CD1 3.26Å; D333-I337 VanDerWaalsContact O-CG1 3.28Å; D333-I337 WeakPolarHBondContact O-CG1 3.28Å; D333-I337 PolarHBondContact O-N 3.14Å; V334-I337 WeakPolarHBondContact O-CB 3.46Å; V334-I337 PolarHBondContact O-N 3.12Å; I337-K339 VanDerWaalsContact C-N 3.29Å; I337-K339 PolarHBondContact O-N 2.96Å; I337-R340 PolarHBondContact O-N 2.71Å; I337-R340 VanDerWaalsContact O-N 3.13Å; I337-Q341 WeakPolarHBondContact O-CG 3.44Å; I337-Q341 PolarHBondContact O-N 3.41Å; I337-Q341 VanDerWaalsContact O-N 3.12Å
338	A	92.4	Very high	90.3	Very high	34 Å²	34	82.3 Å²	82.3	28%	0.281	46%	0.455	S	S	.	.	H	α-helix	trans	-59.2	-40.3	179.1	0	0	0	0	0	112.4	V334 L335 Q341 N343	V334-A338 PolarHBondContact O-N 2.95Å; L335-A338 PolarHBondContact O-N 2.94Å; A338-Q341 PolarHBondContact O-N 3.35Å; A338-N343 PolarHBondContact O-N 2.84Å
339	K	90.7	Very high	89.9	Confident	97 Å²	97	83.2 Å²	83.2	42%	0.422	46%	0.457	S	S	.	.	H	α-helix	trans	-62.3	-43.6	174	-173.6	174.7	-179.7	179.1	0	112.6	L335 I337 Q341 G342 L344 L348	L335-K339 WeakPolarHBondContact O-CB 3.37Å; L335-K339 PolarHBondContact O-N 2.74Å; I337-K339 VanDerWaalsContact C-N 3.29Å; I337-K339 PolarHBondContact O-N 2.96Å; K339-Q341 PolarHBondContact O-N 2.9Å; K339-G342 PolarHBondContact O-N 2.83Å; K339-G342 VanDerWaalsContact O-N 3.09Å; K339-L344 HydrophobicContact CB-CB 4.38Å; K339-L348 HydrophobicContact CB-CD1 4.08Å; K339-L348 HydrophobicContact CD-CD1 3.78Å; K339-L348 HydrophobicContact CD-CG 4.13Å
340	R	91.1	Very high	89.8	Confident	196 Å²	196	87 Å²	87	74%	0.74	47%	0.467	S	S	*	.	H	α-helix	trans	-63.5	-29.2	176.9	-76.3	-172.3	-67.7	-180	-2.3	113.4	N336 I337 G342	N336-R340 WeakPolarHBondContact O-CG 3.44Å; N336-R340 PolarHBondContact O-N 3.48Å; N336-R340 VanDerWaalsContact O-N 3.07Å; I337-R340 PolarHBondContact O-N 2.71Å; I337-R340 VanDerWaalsContact O-N 3.13Å; R340-G342 PolarHBondContact O-N 2.88Å
341	Q	92.8	Very high	89.7	Confident	135 Å²	135	91.9 Å²	91.9	63%	0.631	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	1.5	176.3	-65.1	-65.9	-23.7	0	0	113.2	I337 A338 K339 N343	I337-Q341 WeakPolarHBondContact O-CG 3.44Å; I337-Q341 PolarHBondContact O-N 3.41Å; I337-Q341 VanDerWaalsContact O-N 3.12Å; A338-Q341 PolarHBondContact O-N 3.35Å; K339-Q341 PolarHBondContact O-N 2.9Å; Q341-N343 PolarHBondContact O-N 3.2Å
342	G	86.3	Confident	89.5	Confident	62 Å²	62	93.8 Å²	93.8	64%	0.639	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	3.2	-177.9	0	0	0	0	0	114.2	K339 R340 L344	K339-G342 PolarHBondContact O-N 2.83Å; K339-G342 VanDerWaalsContact O-N 3.09Å; R340-G342 PolarHBondContact O-N 2.88Å; G342-L344 VanDerWaalsContact C-N 3.32Å; G342-L344 PolarHBondContact O-N 3.12Å
343	N	79.6	Confident	89.5	Confident	136 Å²	136	90.2 Å²	90.2	73%	0.727	48%	0.475	S	S	*	.			trans	-89	4.1	-176	-66.7	-28.7	0	0	0	113.3	A338 Q341	A338-N343 PolarHBondContact O-N 2.84Å; Q341-N343 PolarHBondContact O-N 3.2Å
344	L	82.4	Confident	89.6	Confident	43 Å²	43	89.9 Å²	89.9	23%	0.225	47%	0.471	C	S	.	.			trans	-140.8	112.7	178.8	-163.9	74.9	0	0	0	111	L335 K339 G342 L346 L348	L335-L344 HydrophobicContact CD2-CD2 4.39Å; K339-L344 HydrophobicContact CB-CB 4.38Å; G342-L344 VanDerWaalsContact C-N 3.32Å; G342-L344 PolarHBondContact O-N 3.12Å; L344-L346 HydrophobicContact CD1-CD1 4.28Å; L344-L346 HydrophobicContact CG-CB 4.39Å; L344-L348 HydrophobicContact CD2-CD2 3.66Å; L344-L348 HydrophobicContact CD2-CG 4.27Å
345	S	79.7	Confident	89.6	Confident	123 Å²	123	91.8 Å²	91.8	86%	0.86	47%	0.471	S	S	*	.			trans	-90.7	-3.9	179.9	-36.1	0	0	0	0	113.5
346	L	79.8	Confident	89.7	Confident	103 Å²	103	92.8 Å²	92.8	54%	0.539	48%	0.479	S	S	.	.	S	Bend	trans	-82.1	143.7	-173.2	-68	166.2	0	0	0	112.1	L344 L348	L344-L346 HydrophobicContact CD1-CD1 4.28Å; L344-L346 HydrophobicContact CG-CB 4.39Å; L346-L348 PolarHBondContact O-N 3.49Å
347	P	81.7	Confident	90	Very high	97 Å²	97	90.1 Å²	90.1	63%	0.63	47%	0.465	S	S	*	.			trans	-67.8	115.6	170.2	27.8	-31.3	0	0	0	109.5	N349	P347-N349 PolarHBondContact O-N 3.01Å; P347-N349 VanDerWaalsContact O-N 3.16Å
348	L	85.9	Confident	90.2	Very high	39 Å²	39	90.3 Å²	90.3	20%	0.204	47%	0.467	C	S	.	.			trans	-73.9	103.6	172.4	-64.5	177.3	0	0	0	108.6	L335 N336 K339 L344 L346 L352	L335-L348 HydrophobicContact CB-CD1 3.99Å; L335-L348 HydrophobicContact CB-CD2 3.77Å; L335-L348 HydrophobicContact CD1-CD2 4.11Å; L335-L348 HydrophobicContact CG-CD2 4.38Å; N336-L348 VanDerWaalsContact OD1-CD1 3.25Å; N336-L348 WeakPolarHBondContact OD1-CD1 3.44Å; K339-L348 HydrophobicContact CB-CD1 4.08Å; K339-L348 HydrophobicContact CD-CD1 3.78Å; K339-L348 HydrophobicContact CD-CG 4.13Å; L344-L348 HydrophobicContact CD2-CD2 3.66Å; L344-L348 HydrophobicContact CD2-CG 4.27Å; L346-L348 PolarHBondContact O-N 3.49Å; L348-L352 HydrophobicContact CD2-CD2 4.21Å
349	N	90.1	Very high	90.4	Very high	79 Å²	79	94.4 Å²	94.4	42%	0.422	48%	0.48	S	S	.	.			trans	-110.2	163.2	170.5	69.6	13.6	0	0	0	109.9	P347 E351 L352 V353	P347-N349 PolarHBondContact O-N 3.01Å; P347-N349 VanDerWaalsContact O-N 3.16Å; N349-E351 VanDerWaalsContact C-N 3.27Å; N349-E351 PolarHBondContact O-N 2.87Å; N349-L352 PolarHBondContact O-N 2.95Å; N349-L352 VanDerWaalsContact OD1-CB 3.22Å; N349-L352 WeakPolarHBondContact OD1-CB 3.42Å; N349-L352 PolarHBondContact OD1-N 2.87Å; N349-V353 PolarHBondContact O-N 2.92Å
350	R	93.1	Very high	90.7	Very high	192 Å²	192	93.7 Å²	93.7	73%	0.725	48%	0.475	S	S	*	.	H	α-helix	trans	-59.9	-37.9	-177.6	-177.6	174.6	169	176.7	-2.8	112.8	L352 V353 E354	R350-L352 PolarHBondContact O-N 3.26Å; R350-V353 PolarHBondContact O-N 2.96Å; R350-E354 HydrophobicContact CG-CG 4.34Å; R350-E354 IonicContact CZ-OE1 3.81Å; R350-E354 IonicContact NE-OE1 2.79Å; R350-E354 PolarHBondContact NE-OE1 3.39Å; R350-E354 IonicContact NH2-OE1 3.29Å; R350-E354 PolarHBondContact NH2-OE1 2.64Å; R350-E354 VanDerWaalsContact NH2-OE1 3.1Å; R350-E354 WeakPolarHBondContact O-CB 3.33Å; R350-E354 WeakPolarHBondContact O-CG 3.26Å; R350-E354 PolarHBondContact O-N 2.82Å
351	E	94.5	Very high	91	Very high	148 Å²	148	85.2 Å²	85.2	69%	0.692	45%	0.445	S	S	*	.	H	α-helix	trans	-61.9	-43.2	179.7	-173.8	-178.6	-177	0	0	112.2	N349 E354 K355	N349-E351 VanDerWaalsContact C-N 3.27Å; N349-E351 PolarHBondContact O-N 2.87Å; E351-E354 PolarHBondContact O-N 3.2Å; E351-K355 VanDerWaalsContact O-CB 3.28Å; E351-K355 WeakPolarHBondContact O-CB 3.45Å; E351-K355 PolarHBondContact O-N 3.09Å
352	L	93.2	Very high	91.2	Very high	56 Å²	56	85 Å²	85	29%	0.293	44%	0.444	S	S	.	.	H	α-helix	trans	-63.1	-44.9	176.1	177.8	63.6	0	0	0	111.3	L348 N349 R350 K355 V356	L348-L352 HydrophobicContact CD2-CD2 4.21Å; N349-L352 PolarHBondContact O-N 2.95Å; N349-L352 VanDerWaalsContact OD1-CB 3.22Å; N349-L352 WeakPolarHBondContact OD1-CB 3.42Å; N349-L352 PolarHBondContact OD1-N 2.87Å; R350-L352 PolarHBondContact O-N 3.26Å; L352-K355 PolarHBondContact O-N 3.08Å; L352-V356 HydrophobicContact CD1-CG2 4.05Å; L352-V356 HydrophobicContact CG-CG2 4.46Å; L352-V356 WeakPolarHBondContact O-CB 3.24Å; L352-V356 VanDerWaalsContact O-CG2 3.29Å; L352-V356 WeakPolarHBondContact O-CG2 3.25Å; L352-V356 PolarHBondContact O-N 3.33Å
353	V	95.4	Very high	91.6	Very high	6 Å²	6	85.7 Å²	85.7	4%	0.036	44%	0.439	C	S	.	.	H	α-helix	trans	-62.2	-46.3	178.9	-179.1	0	0	0	0	110.4	T328 V331 E332 L335 N349 R350 V356 T357	T328-V353 HydrophobicContact CG2-CG1 3.61Å; V331-V353 HydrophobicContact CB-CG1 4.21Å; V331-V353 HydrophobicContact CG1-CG1 4.12Å; E332-V353 HydrophobicContact CB-CG1 3.92Å; E332-V353 HydrophobicContact CB-CG2 4.39Å; L335-V353 HydrophobicContact CD1-CG2 4.19Å; N349-V353 PolarHBondContact O-N 2.92Å; R350-V353 PolarHBondContact O-N 2.96Å; V353-V356 PolarHBondContact O-N 3.23Å; V353-T357 VanDerWaalsContact O-CB 3.28Å; V353-T357 WeakPolarHBondContact O-CB 3.3Å; V353-T357 PolarHBondContact O-N 2.93Å; V353-T357 PolarHBondContact O-OG1 3.3Å
354	E	96.7	Very high	92.4	Very high	68 Å²	68	79.8 Å²	79.8	32%	0.318	41%	0.407	S	S	.	.	H	α-helix	trans	-61.7	-44.7	177	-74.3	176.4	176.6	0	0	111.2	T328 R350 E351 T357 N358	T328-E354 HydrophobicContact CG2-CG 4.32Å; R350-E354 HydrophobicContact CG-CG 4.34Å; R350-E354 IonicContact CZ-OE1 3.81Å; R350-E354 IonicContact NE-OE1 2.79Å; R350-E354 PolarHBondContact NE-OE1 3.39Å; R350-E354 IonicContact NH2-OE1 3.29Å; R350-E354 PolarHBondContact NH2-OE1 2.64Å; R350-E354 VanDerWaalsContact NH2-OE1 3.1Å; R350-E354 WeakPolarHBondContact O-CB 3.33Å; R350-E354 WeakPolarHBondContact O-CG 3.26Å; R350-E354 PolarHBondContact O-N 2.82Å; E351-E354 PolarHBondContact O-N 3.2Å; E354-T357 PolarHBondContact O-N 3.41Å; E354-N358 WeakPolarHBondContact O-CB 3.14Å; E354-N358 PolarHBondContact O-N 2.94Å; E354-N358 PolarHBondContact O-ND2 3.41Å
355	K	96.3	Very high	93	Very high	136 Å²	136	81 Å²	81	59%	0.591	41%	0.413	S	S	*	.	H	α-helix	trans	-60.4	-50.2	177.3	-174.6	177.7	178.8	-179.8	0	112.3	E351 L352 T357 N358 E359	E351-K355 VanDerWaalsContact O-CB 3.28Å; E351-K355 WeakPolarHBondContact O-CB 3.45Å; E351-K355 PolarHBondContact O-N 3.09Å; L352-K355 PolarHBondContact O-N 3.08Å; K355-T357 VanDerWaalsContact C-N 3.31Å; K355-T357 PolarHBondContact O-N 3.25Å; K355-N358 PolarHBondContact O-N 3.37Å; K355-E359 WeakPolarHBondContact O-CB 3.32Å; K355-E359 PolarHBondContact O-N 3.27Å
356	V	96.4	Very high	93.9	Very high	56 Å²	56	76 Å²	76	34%	0.339	38%	0.376	S	S	.	.	H	α-helix	trans	-62.6	-40.2	178.3	172.6	0	0	0	0	111.1	V331 L352 V353 Y360	V331-V356 HydrophobicContact CG1-CB 4.18Å; V331-V356 HydrophobicContact CG1-CG1 3.8Å; L352-V356 HydrophobicContact CD1-CG2 4.05Å; L352-V356 HydrophobicContact CG-CG2 4.46Å; L352-V356 WeakPolarHBondContact O-CB 3.24Å; L352-V356 VanDerWaalsContact O-CG2 3.29Å; L352-V356 WeakPolarHBondContact O-CG2 3.25Å; L352-V356 PolarHBondContact O-N 3.33Å; V353-V356 PolarHBondContact O-N 3.23Å; V356-Y360 WeakPolarHBondContact O-CB 3.28Å; V356-Y360 PolarHBondContact O-N 3.35Å
357	T	97.9	Very high	94.7	Very high	3 Å²	3	73.2 Å²	73.2	2%	0.018	37%	0.365	C	S	.	.	H	α-helix	trans	-61.4	-47.3	176.6	-58.5	0	0	0	0	111	V326 V331 V353 E354 K355 N361	V326-T357 HydrophobicContact CG2-CG2 4.36Å; V331-T357 WeakPolarHBondContact CG2-OG1 3.29Å; V353-T357 VanDerWaalsContact O-CB 3.28Å; V353-T357 WeakPolarHBondContact O-CB 3.3Å; V353-T357 PolarHBondContact O-N 2.93Å; V353-T357 PolarHBondContact O-OG1 3.3Å; E354-T357 PolarHBondContact O-N 3.41Å; K355-T357 VanDerWaalsContact C-N 3.31Å; K355-T357 PolarHBondContact O-N 3.25Å; T357-N361 WeakPolarHBondContact O-CB 3.21Å; T357-N361 PolarHBondContact O-N 2.93Å; T357-N361 PolarHBondContact O-ND2 3.28Å
358	N	97.8	Very high	95.5	Very high	88 Å²	88	69.8 Å²	69.8	47%	0.471	34%	0.343	S	S	.	.	H	α-helix	trans	-66.3	-47.4	-179.7	-68.4	-17.1	0	0	0	111.1	E354 K355 Y360 N361 E362	E354-N358 WeakPolarHBondContact O-CB 3.14Å; E354-N358 PolarHBondContact O-N 2.94Å; E354-N358 PolarHBondContact O-ND2 3.41Å; K355-N358 PolarHBondContact O-N 3.37Å; N358-Y360 VanDerWaalsContact C-N 3.34Å; N358-Y360 PolarHBondContact O-N 3.09Å; N358-N361 PolarHBondContact O-N 3.35Å; N358-N361 VanDerWaalsContact O-N 3.11Å; N358-E362 WeakPolarHBondContact O-CB 3.15Å; N358-E362 VanDerWaalsContact O-CG 3.3Å; N358-E362 WeakPolarHBondContact O-CG 3.22Å; N358-E362 PolarHBondContact O-N 3.21Å
359	E	97.8	Very high	96	Very high	120 Å²	120	70.8 Å²	70.8	56%	0.561	35%	0.346	S	S	*	.	H	α-helix	trans	-60	-42.7	179.1	-172.9	173.7	169.6	0	0	111.9	K355 S363	K355-E359 WeakPolarHBondContact O-CB 3.32Å; K355-E359 PolarHBondContact O-N 3.27Å; E359-S363 PolarHBondContact O-N 3.3Å
360	Y	97	Very high	96.4	Very high	81 Å²	81	70.3 Å²	70.3	32%	0.318	34%	0.341	S	S	.	.	H	α-helix	trans	-62.9	-46.1	173.3	174.9	-82.6	0	0	0	111.8	V326 V356 N358 S363 L364 R392	V326-Y360 HydrophobicContact CB-CD1 4.25Å; V326-Y360 HydrophobicContact CB-CE1 4.11Å; V326-Y360 HydrophobicContact CG1-CD1 4.03Å; V326-Y360 HydrophobicContact CG1-CE1 3.47Å; V326-Y360 VanDerWaalsContact CG1-CE1 3.47Å; V326-Y360 HydrophobicContact CG2-CD1 3.4Å; V326-Y360 VanDerWaalsContact CG2-CD1 3.4Å; V326-Y360 HydrophobicContact CG2-CE1 3.77Å; V326-Y360 HydrophobicContact CG2-CG 4.03Å; V356-Y360 WeakPolarHBondContact O-CB 3.28Å; V356-Y360 PolarHBondContact O-N 3.35Å; N358-Y360 VanDerWaalsContact C-N 3.34Å; N358-Y360 PolarHBondContact O-N 3.09Å; Y360-S363 WeakPolarHBondContact O-CB 2.94Å; Y360-S363 PolarHBondContact O-N 3Å; Y360-S363 PolarHBondContact O-OG 2.97Å; Y360-L364 HydrophobicContact CE1-CD1 4.31Å; Y360-R392 PolarHBondContact OH-NH1 3.12Å; Y360-R392 PolarHBondContact OH-NH2 3.31Å
361	N	97.4	Very high	96.5	Very high	19 Å²	19	65.4 Å²	65.4	10%	0.102	34%	0.335	C	S	.	.	H	α-helix	trans	-67.8	-37.8	-178	-72.4	-23.5	0	0	0	111.5	F321 R325 V326 T357 N358 S363 L364	F321-N361 HydrophobicContact CE2-CB 4.29Å; F321-N361 WeakPolarHBondContact CE2-O 3.48Å; F321-N361 HydrophobicContact CZ-CB 4.09Å; R325-N361 WeakPolarHBondContact CA-OD1 3.27Å; R325-N361 VanDerWaalsContact CB-OD1 3.26Å; R325-N361 WeakPolarHBondContact CB-OD1 3.4Å; V326-N361 PolarHBondContact N-OD1 2.97Å; V326-N361 PolarHBondContact O-ND2 3.31Å; V326-N361 VanDerWaalsContact O-ND2 3.15Å; T357-N361 WeakPolarHBondContact O-CB 3.21Å; T357-N361 PolarHBondContact O-N 2.93Å; T357-N361 PolarHBondContact O-ND2 3.28Å; N358-N361 PolarHBondContact O-N 3.35Å; N358-N361 VanDerWaalsContact O-N 3.11Å; N361-S363 VanDerWaalsContact C-N 3.28Å; N361-S363 PolarHBondContact O-N 3.34Å; N361-L364 WeakPolarHBondContact O-CB 3.44Å; N361-L364 PolarHBondContact O-N 3.46Å
362	E	96.8	Very high	96.6	Very high	130 Å²	130	60.8 Å²	60.8	61%	0.607	31%	0.312	S	S	*	.	H	α-helix	trans	-62.4	-34.9	173.3	-75.1	173.9	178.7	0	0	111.9	N358 L364 L365	N358-E362 WeakPolarHBondContact O-CB 3.15Å; N358-E362 VanDerWaalsContact O-CG 3.3Å; N358-E362 WeakPolarHBondContact O-CG 3.22Å; N358-E362 PolarHBondContact O-N 3.21Å; E362-L364 PolarHBondContact O-N 3.44Å; E362-L364 VanDerWaalsContact O-N 3.15Å; E362-L365 WeakPolarHBondContact O-CB 3.29Å; E362-L365 PolarHBondContact O-N 3.37Å
363	S	94.9	Very high	96.8	Very high	77 Å²	77	58.1 Å²	58.1	54%	0.538	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-16.9	176.2	83.1	0	0	0	0	114.2	E359 Y360 N361 L365	E359-S363 PolarHBondContact O-N 3.3Å; Y360-S363 WeakPolarHBondContact O-CB 2.94Å; Y360-S363 PolarHBondContact O-N 3Å; Y360-S363 PolarHBondContact O-OG 2.97Å; N361-S363 VanDerWaalsContact C-N 3.28Å; N361-S363 PolarHBondContact O-N 3.34Å; S363-L365 VanDerWaalsContact C-N 3.29Å
364	L	95	Very high	96.9	Very high	12 Å²	12	58.4 Å²	58.4	6%	0.063	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-19.7	174.4	-57.2	173.9	0	0	0	112.2	F321 N324 R325 Y360 N361 E362	F321-L364 HydrophobicContact CD2-CB 4.35Å; F321-L364 HydrophobicContact CD2-CD1 4.45Å; N324-L364 VanDerWaalsContact C-CD1 3.5Å; N324-L364 HydrophobicContact CB-CD1 3.86Å; N324-L364 HydrophobicContact CB-CD2 4.18Å; R325-L364 HydrophobicContact CB-CD1 4.26Å; Y360-L364 HydrophobicContact CE1-CD1 4.31Å; N361-L364 WeakPolarHBondContact O-CB 3.44Å; N361-L364 PolarHBondContact O-N 3.46Å; E362-L364 PolarHBondContact O-N 3.44Å; E362-L364 VanDerWaalsContact O-N 3.15Å
365	L	96.6	Very high	96.9	Very high	67 Å²	67	55.6 Å²	55.6	35%	0.351	29%	0.286	S	S	.	.			trans	-85.9	136.9	-180	-54.1	-177	0	0	0	109.7	S316 K317 F321 E362 S363	S316-L365 WeakPolarHBondContact O-CD2 3.48Å; K317-L365 HydrophobicContact CG-CD2 3.86Å; F321-L365 HydrophobicContact CD2-CD2 3.59Å; F321-L365 HydrophobicContact CD2-CG 4.4Å; F321-L365 HydrophobicContact CE2-CD2 3.88Å; F321-L365 HydrophobicContact CE2-CG 4.25Å; E362-L365 WeakPolarHBondContact O-CB 3.29Å; E362-L365 PolarHBondContact O-N 3.37Å; S363-L365 VanDerWaalsContact C-N 3.29Å
366	Y	97.4	Very high	96.9	Very high	19 Å²	19	49.2 Å²	49.2	8%	0.075	26%	0.259	C	S	.	.			trans	-146	163.2	174.9	62.5	-78.5	0	0	0	110.3	C311 T312 G313 E370 K372 L374 F394	C311-Y366 PolarHBondContact O-OH 2.77Å; T312-Y366 VanDerWaalsContact CA-OH 3.28Å; T312-Y366 WeakPolarHBondContact CA-OH 3.47Å; T312-Y366 PolarHBondContact O-OH 3.13Å; G313-Y366 VanDerWaalsContact CA-CZ 3.49Å; G313-Y366 PolarHBondContact N-OH 3.42Å; Y366-E370 HydrophobicContact CD2-CB 4.35Å; Y366-K372 HydrophobicContact CD2-CD 4.39Å; Y366-K372 HydrophobicContact CD2-CG 4.12Å; Y366-K372 HydrophobicContact CE2-CG 3.84Å; Y366-L374 HydrophobicContact CE1-CB 3.91Å; Y366-L374 HydrophobicContact CE1-CD2 4.22Å; Y366-L374 PolarHBondContact OH-N 2.95Å; Y366-F394 AromaticContact CD1-CE1 3.78Å; Y366-F394 HydrophobicContact CD1-CE1 3.78Å; Y366-F394 HydrophobicContact CD1-CZ 4.06Å; Y366-F394 HydrophobicContact CD2-CE1 4.19Å; Y366-F394 AromaticContact CE1-CE1 3.76Å; Y366-F394 HydrophobicContact CE1-CE1 3.76Å; Y366-F394 HydrophobicContact CE1-CZ 4.4Å; Y366-F394 HydrophobicContact CE2-CE1 4.12Å; Y366-F394 AromaticContact CG-CE1 4Å; Y366-F394 HydrophobicContact CG-CE1 4Å; Y366-F394 HydrophobicContact CG-CZ 4.31Å; Y366-F394 AromaticContact CZ-CE1 3.91Å
367	S	97.2	Very high	96.8	Very high	45 Å²	45	47 Å²	47	32%	0.315	25%	0.245	S	C	.	.			trans	-65.4	137.9	-170.7	172	0	0	0	0	110.7	E369 E370	S367-E369 PolarHBondContact O-N 3.44Å; S367-E369 VanDerWaalsContact O-N 3.12Å; S367-E369 PolarHBondContact OG-N 3.48Å; S367-E370 WeakPolarHBondContact CB-OE1 3.49Å; S367-E370 PolarHBondContact N-OE1 3.36Å; S367-E370 PolarHBondContact O-N 3.42Å; S367-E370 VanDerWaalsContact O-N 3.14Å
368	P	97.4	Very high	96.7	Very high	24 Å²	24	51 Å²	51	16%	0.156	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-13.4	174.9	31	-38.8	0	0	0	113.3	L217 R219 Q220 T314	L217-P368 HydrophobicContact CD1-CG 3.95Å; L217-P368 HydrophobicContact CD2-CG 4.25Å; L217-P368 HydrophobicContact CG-CG 4.4Å; R219-P368 WeakPolarHBondContact CA-O 3.49Å; R219-P368 HydrophobicContact CG-CB 4.24Å; Q220-P368 WeakPolarHBondContact CG-O 3.12Å; Q220-P368 PolarHBondContact N-O 2.84Å; T314-P368 WeakPolarHBondContact OG1-CB 3.46Å
369	E	97.4	Very high	96.5	Very high	61 Å²	61	52.1 Å²	52.1	29%	0.285	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-9.9	178.9	-52.9	-172.3	96.5	0	0	112.5	R215 L217 W218 Q220 S367	R215-E369 IonicContact CZ-OE2 3.89Å; R215-E369 IonicContact NH1-OE1 3.24Å; R215-E369 IonicContact NH1-OE2 3.83Å; R215-E369 PolarHBondContact NH1-OE2 2.87Å; R215-E369 IonicContact NH2-OE2 2.8Å; L217-E369 HydrophobicContact CD1-CG 3.66Å; L217-E369 WeakPolarHBondContact CD1-OE2 3.43Å; W218-E369 PolarHBondContact N-OE1 3.39Å; W218-E369 WeakPolarHBondContact O-CA 3.28Å; W218-E369 WeakPolarHBondContact O-CG 3.3Å; Q220-E369 PolarHBondContact NE2-O 3.25Å; Q220-E369 VanDerWaalsContact NE2-O 3.07Å; S367-E369 PolarHBondContact O-N 3.44Å; S367-E369 VanDerWaalsContact O-N 3.12Å; S367-E369 PolarHBondContact OG-N 3.48Å
370	E	97.4	Very high	96.2	Very high	68 Å²	68	47.9 Å²	47.9	32%	0.318	25%	0.245	S	C	.	.	S	Bend	trans	-75.1	123.3	179.9	-77.5	176.8	-103.9	0	0	111.7	Q220 Y366 S367 K372	Q220-E370 WeakPolarHBondContact CG-O 3.34Å; Y366-E370 HydrophobicContact CD2-CB 4.35Å; S367-E370 WeakPolarHBondContact CB-OE1 3.49Å; S367-E370 PolarHBondContact N-OE1 3.36Å; S367-E370 PolarHBondContact O-N 3.42Å; S367-E370 VanDerWaalsContact O-N 3.14Å; E370-K372 HydrophobicContact CB-CD 4.34Å; E370-K372 HydrophobicContact CB-CG 4.21Å; E370-K372 PolarHBondContact O-N 3.16Å; E370-K372 WeakPolarHBondContact OE2-CE 3.25Å; E370-K372 IonicContact OE2-NZ 3.05Å; E370-K372 PolarHBondContact OE2-NZ 3.26Å
371	P	96.6	Very high	96	Very high	90 Å²	90	47.1 Å²	47.1	58%	0.584	25%	0.246	S	C	*	.			trans	-80	57.8	-173.4	35.3	-38	0	0	0	112.5	I429	P371-I429 HydrophobicContact CB-CG2 3.96Å
372	K	96.2	Very high	95.5	Very high	51 Å²	51	50.1 Å²	50.1	22%	0.222	27%	0.273	C	S	.	.			trans	-138.1	151.8	-179.4	67.9	-170.9	-173.2	-174.7	0	111.2	Y366 E370 F394	Y366-K372 HydrophobicContact CD2-CD 4.39Å; Y366-K372 HydrophobicContact CD2-CG 4.12Å; Y366-K372 HydrophobicContact CE2-CG 3.84Å; E370-K372 HydrophobicContact CB-CD 4.34Å; E370-K372 HydrophobicContact CB-CG 4.21Å; E370-K372 PolarHBondContact O-N 3.16Å; E370-K372 WeakPolarHBondContact OE2-CE 3.25Å; E370-K372 IonicContact OE2-NZ 3.05Å; E370-K372 PolarHBondContact OE2-NZ 3.26Å; K372-F394 HydrophobicContact CB-CD1 4.43Å; K372-F394 HydrophobicContact CD-CB 4.36Å; K372-F394 HydrophobicContact CD-CD1 3.53Å; K372-F394 HydrophobicContact CD-CE1 3.94Å; K372-F394 HydrophobicContact CD-CG 3.98Å; K372-F394 HydrophobicContact CG-CD1 3.79Å; K372-F394 HydrophobicContact CG-CE1 4.27Å
373	I	97.6	Very high	95	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	127.1	175.5	-54.7	176.8	0	0	0	107.4	I222 L310 C311 F394 S395 I429	I222-I373 HydrophobicContact CD1-CG2 4.19Å; I222-I373 HydrophobicContact CG1-CD1 4.32Å; I222-I373 HydrophobicContact CG1-CG1 4.37Å; I222-I373 HydrophobicContact CG2-CD1 4.23Å; L310-I373 HydrophobicContact CB-CG2 3.82Å; L310-I373 HydrophobicContact CD2-CG2 4.29Å; C311-I373 WeakPolarHBondContact O-CA 3.4Å; I373-F394 CarbonylContact O-C 3.44Å; I373-F394 WeakPolarHBondContact O-CA 3.47Å; I373-S395 PolarHBondContact N-O 2.93Å; I373-S395 PolarHBondContact O-N 3.18Å; I373-S395 PolarHBondContact O-OG 2.8Å; I373-I429 HydrophobicContact CD1-CD1 4.27Å; I373-I429 HydrophobicContact CD1-CG1 4.07Å; I373-I429 HydrophobicContact CG1-CD1 3.81Å; I373-I429 HydrophobicContact CG1-CG1 3.58Å
374	L	97.3	Very high	94.4	Very high	11 Å²	11	56.5 Å²	56.5	6%	0.058	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	110.3	164.8	176.6	65.5	0	0	0	108.2	C311 Y366 R392 F394	C311-L374 PolarHBondContact N-O 3.11Å; C311-L374 PolarHBondContact O-N 3.37Å; Y366-L374 HydrophobicContact CE1-CB 3.91Å; Y366-L374 HydrophobicContact CE1-CD2 4.22Å; Y366-L374 PolarHBondContact OH-N 2.95Å; L374-R392 HydrophobicContact CD1-CB 4.43Å; L374-F394 HydrophobicContact CB-CD1 3.95Å; L374-F394 HydrophobicContact CB-CE1 3.75Å; L374-F394 HydrophobicContact CD1-CD1 4.2Å; L374-F394 HydrophobicContact CD1-CE1 4.06Å; L374-F394 HydrophobicContact CD1-CG 4.5Å; L374-F394 HydrophobicContact CD1-CZ 4.23Å; L374-F394 HydrophobicContact CG-CE1 4.33Å
375	F	95.8	Very high	93.5	Very high	10 Å²	10	61 Å²	61	4%	0.044	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	147.6	168.2	80.8	-97.2	0	0	0	110.5	I293 V295 L308 N309 L310 I377 R392 C393 V398	I293-F375 HydrophobicContact CD1-CD2 4.24Å; I293-F375 HydrophobicContact CD1-CE2 4.4Å; V295-F375 HydrophobicContact CB-CE1 4.4Å; V295-F375 HydrophobicContact CG1-CE1 3.93Å; V295-F375 HydrophobicContact CG2-CD1 4.2Å; V295-F375 HydrophobicContact CG2-CE1 3.56Å; V295-F375 HydrophobicContact CG2-CZ 3.9Å; L308-F375 HydrophobicContact CD1-CB 4.4Å; L308-F375 HydrophobicContact CD1-CD2 4.14Å; N309-F375 CarbonylContact O-C 3.2Å; N309-F375 VanDerWaalsContact O-CA 3.28Å; N309-F375 WeakPolarHBondContact O-CA 3.31Å; L310-F375 HydrophobicContact CD2-CB 4.48Å; L310-F375 HydrophobicContact CG-CB 4.31Å; F375-I377 HydrophobicContact CD2-CG1 4.44Å; F375-I377 HydrophobicContact CE2-CD1 4.43Å; F375-I377 HydrophobicContact CE2-CG1 4.36Å; F375-R392 WeakPolarHBondContact O-CA 3.47Å; F375-R392 WeakPolarHBondContact O-CB 3.42Å; F375-C393 HydrophobicContact CD1-CB 4.22Å; F375-C393 VanDerWaalsContact CD1-O 3.27Å; F375-C393 WeakPolarHBondContact CD1-O 3.45Å; F375-C393 HydrophobicContact CE1-CB 3.41Å; F375-C393 VanDerWaalsContact CE1-CB 3.41Å; F375-C393 HydrophobicContact CZ-CB 3.68Å; F375-C393 PolarHBondContact N-O 3.16Å; F375-C393 VanDerWaalsContact N-O 3.07Å; F375-C393 PolarHBondContact O-N 3.26Å; F375-V398 HydrophobicContact CB-CG2 4.48Å; F375-V398 HydrophobicContact CD1-CG2 4.34Å
376	S	96.3	Very high	92.8	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.007	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	125.8	174.5	57.1	0	0	0	0	111.6	N309 N324 Q391	N309-S376 PolarHBondContact N-O 2.88Å; N309-S376 PolarHBondContact O-N 2.88Å; N324-S376 PolarHBondContact ND2-OG 2.91Å; S376-Q391 WeakPolarHBondContact CA-O 3.25Å
377	I	96.1	Very high	91.7	Very high	11 Å²	11	62 Å²	62	6%	0.056	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	120	176.1	-59.5	171.7	0	0	0	108	Q303 L308 F375 P380 Q391	Q303-I377 HydrophobicContact CG-CD1 3.98Å; L308-I377 HydrophobicContact CD1-CG1 3.99Å; F375-I377 HydrophobicContact CD2-CG1 4.44Å; F375-I377 HydrophobicContact CE2-CD1 4.43Å; F375-I377 HydrophobicContact CE2-CG1 4.36Å; I377-P380 HydrophobicContact CG2-CB 3.84Å; I377-Q391 PolarHBondContact N-O 2.79Å
378	R	94.5	Very high	90.6	Very high	85 Å²	85	61.4 Å²	61.4	32%	0.321	32%	0.322	S	S	.	.	S	Bend	trans	-85.4	116	-175.2	-171.6	178.7	179.4	-77.7	-25	110.7	S305 S306 G307	S305-R378 VanDerWaalsContact CB-O 3.31Å; S305-R378 WeakPolarHBondContact CB-O 3.48Å; S306-R378 WeakPolarHBondContact CB-O 3.44Å; S306-R378 PolarHBondContact N-O 3.31Å; G307-R378 PolarHBondContact O-N 2.75Å
379	E	93	Very high	89.4	Confident	113 Å²	113	64.1 Å²	64.1	53%	0.528	34%	0.342	S	S	.	.	S	Bend	trans	53.3	61.9	176.8	-60.1	158	169.7	0	0	112.1	S306 I381	S306-E379 WeakPolarHBondContact CB-OE2 3.39Å; S306-E379 PolarHBondContact OG-OE2 2.88Å; E379-I381 PolarHBondContact O-N 3.49Å
380	P	93.3	Very high	88.7	Confident	31 Å²	31	68.8 Å²	68.8	20%	0.201	36%	0.357	C	S	.	.			trans	-62.3	135.2	-177.5	25.7	-33.5	0	0	0	111.7	I377 A382 Q391	I377-P380 HydrophobicContact CG2-CB 3.84Å; P380-A382 PolarHBondContact O-N 2.8Å; P380-Q391 HydrophobicContact CG-CG 3.99Å
381	I	91.7	Very high	88.2	Confident	65 Å²	65	71.1 Å²	71.1	33%	0.333	37%	0.368	S	S	.	.			trans	-86	110.7	172.3	-58	-176.3	0	0	0	107.9	A288 K304 E379 F386	A288-I381 HydrophobicContact CB-CD1 3.93Å; K304-I381 HydrophobicContact CB-CB 4.41Å; K304-I381 HydrophobicContact CD-CD1 4.15Å; K304-I381 HydrophobicContact CG-CD1 4.02Å; K304-I381 WeakPolarHBondContact O-CB 3.38Å; K304-I381 PolarHBondContact O-N 2.9Å; E379-I381 PolarHBondContact O-N 3.49Å; I381-F386 WeakPolarHBondContact O-CB 3.37Å
382	A	87.6	Confident	88	Confident	81 Å²	81	70.4 Å²	70.4	67%	0.669	35%	0.353	S	S	*	.			trans	-102.9	122.1	175.8	0	0	0	0	0	111	P380 F386	P380-A382 PolarHBondContact O-N 2.8Å; A382-F386 CarbonylContact C-O 3.59Å; A382-F386 WeakPolarHBondContact CA-O 3.42Å
383	N	86.3	Confident	87.8	Confident	85 Å²	85	69.4 Å²	69.4	46%	0.455	35%	0.353	S	S	.	.	S	Bend	trans	-154.6	-165.2	174.9	63.7	36.2	0	0	0	110.5	V385 F386	N383-V385 PolarHBondContact O-N 3.5Å; N383-V385 WeakPolarHBondContact OD1-CA 3.45Å; N383-V385 WeakPolarHBondContact OD1-CB 3.49Å; N383-V385 PolarHBondContact OD1-N 3.01Å; N383-F386 PolarHBondContact N-O 3.21Å; N383-F386 PolarHBondContact OD1-N 3.45Å
384	R	81.4	Confident	87.7	Confident	256 Å²	256	73.3 Å²	73.3	97%	0.966	37%	0.37	S	S	*	.	S	Bend	trans	-61.4	-25.4	179.8	-176.6	175.4	172.9	178.3	-0.8	113.9
385	V	77.2	Confident	87.6	Confident	106 Å²	106	73.1 Å²	73.1	64%	0.642	37%	0.369	S	S	*	.	S	Bend	trans	-100.2	-37.4	-174.8	-178.1	0	0	0	0	111.5	N383	N383-V385 PolarHBondContact O-N 3.5Å; N383-V385 WeakPolarHBondContact OD1-CA 3.45Å; N383-V385 WeakPolarHBondContact OD1-CB 3.49Å; N383-V385 PolarHBondContact OD1-N 3.01Å
386	F	82	Confident	87.4	Confident	23 Å²	23	75.9 Å²	75.9	10%	0.101	39%	0.39	C	S	.	.			trans	-112.2	124.6	-178.6	-59	-72.5	0	0	0	109.9	Y290 K302 K304 I381 A382 N383	Y290-F386 AromaticContact CD2-CE1 3.82Å; Y290-F386 HydrophobicContact CD2-CE1 3.82Å; Y290-F386 HydrophobicContact CD2-CZ 4.3Å; Y290-F386 AromaticContact CE2-CE1 3.66Å; Y290-F386 HydrophobicContact CE2-CE1 3.66Å; Y290-F386 HydrophobicContact CE2-CZ 4.29Å; K302-F386 HydrophobicContact CB-CD1 4.39Å; K302-F386 HydrophobicContact CB-CE1 4.42Å; K304-F386 HydrophobicContact CB-CD1 3.75Å; K304-F386 HydrophobicContact CB-CD2 3.99Å; K304-F386 HydrophobicContact CB-CE1 3.81Å; K304-F386 HydrophobicContact CB-CE2 4.05Å; K304-F386 HydrophobicContact CB-CG 3.85Å; K304-F386 HydrophobicContact CB-CZ 3.96Å; K304-F386 HydrophobicContact CD-CD2 4.21Å; K304-F386 HydrophobicContact CD-CE2 3.67Å; K304-F386 HydrophobicContact CD-CZ 3.87Å; K304-F386 HydrophobicContact CG-CE2 4.5Å; K304-F386 HydrophobicContact CG-CZ 4.48Å; I381-F386 WeakPolarHBondContact O-CB 3.37Å; A382-F386 CarbonylContact C-O 3.59Å; A382-F386 WeakPolarHBondContact CA-O 3.42Å; N383-F386 PolarHBondContact N-O 3.21Å; N383-F386 PolarHBondContact OD1-N 3.45Å
387	S	74.3	Confident	87.4	Confident	86 Å²	86	78.3 Å²	78.3	60%	0.601	40%	0.4	S	S	*	.			trans	-128.5	137.7	172	62.6	0	0	0	0	108.3	Q303	Q303-S387 PolarHBondContact NE2-O 2.86Å
388	S	72.6	Confident	87.4	Confident	31 Å²	31	77.8 Å²	77.8	22%	0.217	40%	0.397	C	S	.	.			trans	-107.1	102.7	173	-179.5	0	0	0	0	106.7	R390	S388-R390 VanDerWaalsContact C-N 3.25Å; S388-R390 PolarHBondContact OG-O 2.97Å
389	S	72.8	Confident	87.6	Confident	81 Å²	81	74.2 Å²	74.2	57%	0.566	39%	0.385	S	S	*	.	S	Bend	trans	-63.8	-37.5	176.7	61.6	0	0	0	0	110.4	E301	E301-S389 PolarHBondContact OE1-OG 3.09Å; E301-S389 VanDerWaalsContact OE1-OG 3.12Å; E301-S389 PolarHBondContact OE2-OG 3.45Å
390	R	82.1	Confident	87.8	Confident	160 Å²	160	68.8 Å²	68.8	60%	0.604	36%	0.36	S	S	*	.			trans	-142	125.6	175.5	-62.9	-176.1	179	-168.1	-0.8	110.1	S388 R392 C393	S388-R390 VanDerWaalsContact C-N 3.25Å; S388-R390 PolarHBondContact OG-O 2.97Å; R390-R392 VanDerWaalsContact C-N 3.33Å; R390-C393 PolarHBondContact NH1-SG 3.35Å
391	Q	88.2	Confident	88	Confident	116 Å²	116	70.2 Å²	70.2	54%	0.542	36%	0.361	S	S	.	.	S	Bend	trans	-75.7	-27.4	175	-59.3	-171.5	-9.4	0	0	112	S376 I377 P380	S376-Q391 WeakPolarHBondContact CA-O 3.25Å; I377-Q391 PolarHBondContact N-O 2.79Å; P380-Q391 HydrophobicContact CG-CG 3.99Å
392	R	91.8	Very high	88.2	Confident	75 Å²	75	67.1 Å²	67.1	28%	0.283	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	141.7	-178.4	-50.3	-175.2	-60.6	-157.7	-2	110.6	N324 Y360 L374 F375 R390	N324-R392 PolarHBondContact O-NH1 2.9Å; N324-R392 WeakPolarHBondContact OD1-CD 3.26Å; N324-R392 PolarHBondContact OD1-NH1 3.35Å; Y360-R392 PolarHBondContact OH-NH1 3.12Å; Y360-R392 PolarHBondContact OH-NH2 3.31Å; L374-R392 HydrophobicContact CD1-CB 4.43Å; F375-R392 WeakPolarHBondContact O-CA 3.47Å; F375-R392 WeakPolarHBondContact O-CB 3.42Å; R390-R392 VanDerWaalsContact C-N 3.33Å
393	C	91.9	Very high	88.7	Confident	31 Å²	31	67.8 Å²	67.8	21%	0.209	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	155.3	172.6	-154	0	0	0	0	111	F375 R390	F375-C393 HydrophobicContact CD1-CB 4.22Å; F375-C393 VanDerWaalsContact CD1-O 3.27Å; F375-C393 WeakPolarHBondContact CD1-O 3.45Å; F375-C393 HydrophobicContact CE1-CB 3.41Å; F375-C393 VanDerWaalsContact CE1-CB 3.41Å; F375-C393 HydrophobicContact CZ-CB 3.68Å; F375-C393 PolarHBondContact N-O 3.16Å; F375-C393 VanDerWaalsContact N-O 3.07Å; F375-C393 PolarHBondContact O-N 3.26Å; R390-C393 PolarHBondContact NH1-SG 3.35Å
394	F	95.8	Very high	89.1	Confident	82 Å²	82	63.8 Å²	63.8	36%	0.36	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	143.3	166.2	-69.9	-71.1	0	0	0	109.8	Y366 K372 I373 L374	Y366-F394 AromaticContact CD1-CE1 3.78Å; Y366-F394 HydrophobicContact CD1-CE1 3.78Å; Y366-F394 HydrophobicContact CD1-CZ 4.06Å; Y366-F394 HydrophobicContact CD2-CE1 4.19Å; Y366-F394 AromaticContact CE1-CE1 3.76Å; Y366-F394 HydrophobicContact CE1-CE1 3.76Å; Y366-F394 HydrophobicContact CE1-CZ 4.4Å; Y366-F394 HydrophobicContact CE2-CE1 4.12Å; Y366-F394 AromaticContact CG-CE1 4Å; Y366-F394 HydrophobicContact CG-CE1 4Å; Y366-F394 HydrophobicContact CG-CZ 4.31Å; Y366-F394 AromaticContact CZ-CE1 3.91Å; K372-F394 HydrophobicContact CB-CD1 4.43Å; K372-F394 HydrophobicContact CD-CB 4.36Å; K372-F394 HydrophobicContact CD-CD1 3.53Å; K372-F394 HydrophobicContact CD-CE1 3.94Å; K372-F394 HydrophobicContact CD-CG 3.98Å; K372-F394 HydrophobicContact CG-CD1 3.79Å; K372-F394 HydrophobicContact CG-CE1 4.27Å; I373-F394 CarbonylContact O-C 3.44Å; I373-F394 WeakPolarHBondContact O-CA 3.47Å; L374-F394 HydrophobicContact CB-CD1 3.95Å; L374-F394 HydrophobicContact CB-CE1 3.75Å; L374-F394 HydrophobicContact CD1-CD1 4.2Å; L374-F394 HydrophobicContact CD1-CE1 4.06Å; L374-F394 HydrophobicContact CD1-CG 4.5Å; L374-F394 HydrophobicContact CD1-CZ 4.23Å; L374-F394 HydrophobicContact CG-CE1 4.33Å
395	S	94.8	Very high	89.5	Confident	7 Å²	7	61.3 Å²	61.3	5%	0.049	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	161.9	-179.1	56.2	0	0	0	0	110.3	V295 D296 I373 V398	V295-S395 VanDerWaalsContact CG1-CB 3.5Å; D296-S395 WeakPolarHBondContact OD2-CA 3.43Å; D296-S395 WeakPolarHBondContact OD2-CB 3.26Å; I373-S395 PolarHBondContact N-O 2.93Å; I373-S395 PolarHBondContact O-N 3.18Å; I373-S395 PolarHBondContact O-OG 2.8Å; S395-V398 WeakPolarHBondContact OG-CG2 3.41Å
396	S	91	Very high	90.2	Very high	68 Å²	68	57.7 Å²	57.7	48%	0.476	28%	0.278	S	S	.	.	S	Bend	trans	-95.9	-28.4	171.3	66.9	0	0	0	0	112.1	D296 M428 I429	D296-S396 WeakPolarHBondContact OD1-CA 3.33Å; D296-S396 PolarHBondContact OD1-N 3.1Å; D296-S396 PolarHBondContact OD1-OG 2.66Å; S396-M428 WeakPolarHBondContact O-CA 3.33Å; S396-I429 PolarHBondContact O-N 3.49Å
397	K	96.3	Very high	90.7	Very high	51 Å²	51	56.7 Å²	56.7	22%	0.222	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	136.1	-177.6	-178.4	-178	176.7	-169.7	0	110.7	D296 D297 M427 M428	D296-K397 PolarHBondContact N-O 3.34Å; D296-K397 PolarHBondContact OD1-N 2.75Å; D297-K397 WeakPolarHBondContact OD1-CE 3.43Å; D297-K397 IonicContact OD1-NZ 2.76Å; D297-K397 PolarHBondContact OD1-NZ 2.69Å; D297-K397 IonicContact OD2-NZ 3.99Å; D297-K397 PolarHBondContact OD2-NZ 2.9Å; K397-M427 CarbonylContact C-O 3.59Å; K397-M427 WeakPolarHBondContact CA-O 3.43Å; K397-M428 HydrophobicContact CD-CE 4.3Å; K397-M428 HydrophobicContact CG-CE 4.36Å
398	V	97.5	Very high	91.7	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	127.8	172.2	-175.4	0	0	0	0	109.2	I293 L310 F375 S395 V400 M427	I293-V398 HydrophobicContact CD1-CG1 3.83Å; I293-V398 HydrophobicContact CG1-CG1 3.82Å; L310-V398 HydrophobicContact CD2-CB 3.54Å; L310-V398 HydrophobicContact CD2-CG1 3.7Å; L310-V398 HydrophobicContact CD2-CG2 3.81Å; F375-V398 HydrophobicContact CB-CG2 4.48Å; F375-V398 HydrophobicContact CD1-CG2 4.34Å; S395-V398 WeakPolarHBondContact OG-CG2 3.41Å; V398-V400 HydrophobicContact CG1-CG2 4.06Å; V398-M427 HydrophobicContact CG1-CE 4.49Å; V398-M427 PolarHBondContact N-O 3.27Å; V398-M427 WeakPolarHBondContact O-CE 3.34Å; V398-M427 PolarHBondContact O-N 3.25Å
399	C	97.6	Very high	92.8	Very high	10 Å²	10	51.6 Å²	51.6	7%	0.068	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	134.2	172.5	-66	0	0	0	0	109.2	I293 S294 W300 A425 S426	I293-C399 CarbonylContact C-O 3.57Å; I293-C399 WeakPolarHBondContact CA-O 3.4Å; S294-C399 PolarHBondContact N-O 2.72Å; S294-C399 PolarHBondContact O-N 3.3Å; W300-C399 HydrophobicContact CH2-CB 3.62Å; W300-C399 HydrophobicContact CZ2-CB 4.09Å; W300-C399 HydrophobicContact CZ3-CB 4.35Å; C399-A425 CarbonylContact C-O 3.5Å; C399-A425 WeakPolarHBondContact CA-O 3.26Å; C399-S426 PolarHBondContact SG-OG 2.83Å
400	V	97.5	Very high	94	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	129.6	-178.6	-176.3	0	0	0	0	108.3	I280 Y291 E292 I293 L308 V398 F419 I424 A425 M427	I280-V400 HydrophobicContact CD1-CB 4.16Å; I280-V400 HydrophobicContact CD1-CG1 4.28Å; I280-V400 HydrophobicContact CD1-CG2 4.12Å; Y291-V400 HydrophobicContact CD2-CG1 4.04Å; Y291-V400 HydrophobicContact CG-CG1 4.25Å; E292-V400 CarbonylContact O-C 3.59Å; E292-V400 WeakPolarHBondContact O-CA 3.23Å; I293-V400 HydrophobicContact CG1-CG2 4.36Å; L308-V400 HydrophobicContact CD2-CG1 4.49Å; L308-V400 HydrophobicContact CD2-CG2 3.42Å; L308-V400 VanDerWaalsContact CD2-CG2 3.42Å; V398-V400 HydrophobicContact CG1-CG2 4.06Å; V400-F419 HydrophobicContact CB-CE1 4.49Å; V400-F419 HydrophobicContact CB-CZ 4.38Å; V400-F419 HydrophobicContact CG1-CE1 3.97Å; V400-F419 HydrophobicContact CG1-CZ 4.32Å; V400-F419 WeakPolarHBondContact O-CZ 3.21Å; V400-I424 CarbonylContact O-C 3.53Å; V400-I424 VanDerWaalsContact O-CA 3.24Å; V400-I424 WeakPolarHBondContact O-CA 3.46Å; V400-A425 PolarHBondContact N-O 3.36Å; V400-A425 PolarHBondContact O-N 2.9Å; V400-M427 HydrophobicContact CB-CE 4.23Å; V400-M427 HydrophobicContact CG2-CE 3.6Å
401	R	97.4	Very high	94.7	Very high	60 Å²	60	41.7 Å²	41.7	23%	0.226	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	120.3	171.4	176.5	-177.4	-62.9	121.2	5.5	108.5	Y291 E292 W300 A423 I424	Y291-R401 CarbonylContact C-O 3.59Å; Y291-R401 VanDerWaalsContact CA-O 3.29Å; Y291-R401 WeakPolarHBondContact CA-O 3.23Å; Y291-R401 VanDerWaalsContact CB-O 3.3Å; Y291-R401 WeakPolarHBondContact CB-O 3.23Å; E292-R401 HydrophobicContact CB-CB 4.28Å; E292-R401 PolarHBondContact N-O 2.87Å; E292-R401 PolarHBondContact O-N 2.91Å; E292-R401 IonicContact OE2-CZ 2.62Å; E292-R401 IonicContact OE2-NH1 2.85Å; E292-R401 PolarHBondContact OE2-NH1 3Å; W300-R401 HydrophobicContact CH2-CB 4.26Å; W300-R401 HydrophobicContact CZ3-CB 3.87Å; R401-A423 WeakPolarHBondContact CA-O 3.13Å; R401-I424 HydrophobicContact CB-CG1 4.1Å; R401-I424 HydrophobicContact CG-CG1 4.01Å
402	S	97.2	Very high	95.1	Very high	1 Å²	1	37 Å²	37	1%	0.007	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	137.2	179.4	-167.8	0	0	0	0	111.3	C404 F419 N420 G422 A423	S402-C404 WeakPolarHBondContact OG-CB 3.24Å; S402-C404 PolarHBondContact OG-N 3.4Å; S402-F419 VanDerWaalsContact CB-O 3.25Å; S402-F419 WeakPolarHBondContact CB-O 3.42Å; S402-F419 PolarHBondContact OG-O 3.26Å; S402-N420 VanDerWaalsContact CB-O 3.24Å; S402-N420 WeakPolarHBondContact CB-O 3.1Å; S402-N420 PolarHBondContact OG-O 3.17Å; S402-G422 PolarHBondContact O-N 3.12Å; S402-G422 VanDerWaalsContact O-N 3.12Å; S402-A423 PolarHBondContact N-O 3.39Å
403	R	96.1	Very high	95.1	Very high	94 Å²	94	35.5 Å²	35.5	36%	0.355	18%	0.178	S	C	.	.			trans	-120.4	18.2	162.1	-54.9	-64.5	-169.6	-176.8	-1	110.8	Y290 E292 D421	Y290-R403 HydrophobicContact CD1-CB 3.3Å; Y290-R403 HydrophobicContact CD1-CG 3.94Å; Y290-R403 HydrophobicContact CD2-CB 4.35Å; Y290-R403 HydrophobicContact CE1-CB 3.65Å; Y290-R403 HydrophobicContact CE1-CG 3.78Å; Y290-R403 HydrophobicContact CE2-CG 4.37Å; Y290-R403 HydrophobicContact CG-CB 3.69Å; Y290-R403 HydrophobicContact CG-CG 4.3Å; Y290-R403 CarbonylContact O-C 3.56Å; Y290-R403 VanDerWaalsContact O-C 3.27Å; Y290-R403 VanDerWaalsContact O-CA 3.26Å; Y290-R403 WeakPolarHBondContact O-CA 3.37Å; Y290-R403 VanDerWaalsContact O-CB 3.25Å; Y290-R403 WeakPolarHBondContact O-CB 3.31Å; Y290-R403 PolarHBondContact O-N 2.82Å; E292-R403 IonicContact OE1-CZ 3.82Å; E292-R403 VanDerWaalsContact OE1-CZ 3.29Å; E292-R403 IonicContact OE1-NE 4Å; E292-R403 PolarHBondContact OE1-NE 2.98Å; E292-R403 IonicContact OE1-NH2 3.15Å; E292-R403 PolarHBondContact OE1-NH2 3.38Å; E292-R403 IonicContact OE2-NH2 3.75Å; R403-D421 WeakPolarHBondContact CA-OD1 3.5Å; R403-D421 WeakPolarHBondContact CD-OD1 3.37Å; R403-D421 IonicContact NH1-OD1 3.07Å
404	C	94.9	Very high	94.9	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.014	17%	0.173	C	C	.	.			trans	-85.1	158.7	-177.6	-65	0	0	0	0	111.1	E282 Y290 S402 A407 D421	E282-C404 HydrophobicContact CG-CB 4.21Å; E282-C404 VanDerWaalsContact OE1-CA 3.26Å; E282-C404 WeakPolarHBondContact OE1-CA 3.44Å; E282-C404 VanDerWaalsContact OE1-CB 3.23Å; E282-C404 WeakPolarHBondContact OE1-CB 3.29Å; Y290-C404 PolarHBondContact O-N 3.27Å; Y290-C404 PolarHBondContact O-SG 3.19Å; S402-C404 WeakPolarHBondContact OG-CB 3.24Å; S402-C404 PolarHBondContact OG-N 3.4Å; C404-A407 HydrophobicContact CB-CB 3.3Å; C404-D421 WeakPolarHBondContact O-CA 3.45Å; C404-D421 WeakPolarHBondContact O-CB 3.49Å; C404-D421 PolarHBondContact O-N 3.34Å
405	W	90.6	Very high	94.7	Very high	204 Å²	204	31.8 Å²	31.8	77%	0.773	16%	0.163	S	C	*	.	S	Bend	trans	-95.4	-42.1	179.6	179.2	-92.2	0	0	0	113.6	E282 N420	E282-W405 PolarHBondContact OE1-N 3.06Å; W405-N420 VanDerWaalsContact C-OD1 3.27Å; W405-N420 PolarHBondContact O-OD1 2.78Å
406	D	91.1	Very high	94.7	Very high	30 Å²	30	31.6 Å²	31.6	16%	0.16	16%	0.162	C	C	.	.	S	Bend	trans	-138.1	71	-178.7	175.5	20.5	0	0	0	107.5	E282 S283 N420	E282-D406 CarbonylContact C-O 3.53Å; E282-D406 WeakPolarHBondContact CA-O 3.44Å; E282-D406 PolarHBondContact OE2-N 3.23Å; E282-D406 VanDerWaalsContact OE2-N 3.15Å; E282-D406 VanDerWaalsContact OE2-O 3.1Å; S283-D406 WeakPolarHBondContact CB-O 3.39Å; S283-D406 PolarHBondContact N-O 2.81Å; S283-D406 PolarHBondContact OG-O 3.31Å; S283-D406 VanDerWaalsContact OG-O 3.04Å; S283-D406 PolarHBondContact OG-OD1 2.84Å; D406-N420 VanDerWaalsContact CA-OD1 3.23Å; D406-N420 WeakPolarHBondContact CA-OD1 3.43Å; D406-N420 PolarHBondContact N-OD1 3.19Å
407	A	93.9	Very high	94.8	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.008	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	152.5	-178.8	0	0	0	0	0	112.1	G281 C404 F419 N420	G281-A407 CarbonylContact O-C 3.57Å; G281-A407 WeakPolarHBondContact O-CA 3.4Å; G281-A407 VanDerWaalsContact O-CB 3.23Å; G281-A407 WeakPolarHBondContact O-CB 3.44Å; C404-A407 HydrophobicContact CB-CB 3.3Å; A407-F419 WeakPolarHBondContact CB-O 3.2Å; A407-F419 PolarHBondContact O-N 2.58Å; A407-N420 PolarHBondContact N-OD1 3.45Å
408	C	94.8	Very high	94.6	Very high	11 Å²	11	28.3 Å²	28.3	7%	0.074	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	148.9	175.2	-65.6	0	0	0	0	110.7	I280 G281 S283 V410 S416 F417	I280-C408 WeakPolarHBondContact CA-O 3.2Å; G281-C408 PolarHBondContact N-O 3.27Å; G281-C408 PolarHBondContact O-N 2.83Å; S283-C408 PolarHBondContact OG-SG 3.01Å; S283-C408 VanDerWaalsContact OG-SG 3.39Å; C408-V410 HydrophobicContact CB-CG2 4.24Å; C408-S416 WeakPolarHBondContact CB-OG 3.44Å; C408-F417 CarbonylContact C-O 3.55Å; C408-F417 VanDerWaalsContact CA-O 3.32Å; C408-F417 WeakPolarHBondContact CA-O 3.39Å
409	M	96.3	Very high	94.5	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	112.4	163	179.5	172.6	65	0	0	108.5	L224 L270 V278 F279 I280 S416 F417 F419 A425	L224-M409 HydrophobicContact CD2-CE 3.89Å; L224-M409 HydrophobicContact CD2-CG 4.47Å; L224-M409 HydrophobicContact CD2-SD 3.56Å; L224-M409 VanDerWaalsContact CD2-SD 3.56Å; L270-M409 HydrophobicContact CD1-CE 3.46Å; L270-M409 VanDerWaalsContact CD1-CE 3.46Å; V278-M409 HydrophobicContact CG1-CG 3.58Å; V278-M409 HydrophobicContact CG1-SD 3.98Å; F279-M409 CarbonylContact O-C 3.56Å; F279-M409 WeakPolarHBondContact O-CA 3.38Å; I280-M409 HydrophobicContact CD1-CG 4.32Å; I280-M409 HydrophobicContact CD1-SD 4.18Å; I280-M409 HydrophobicContact CG1-CB 4.1Å; I280-M409 HydrophobicContact CG1-CG 3.82Å; I280-M409 HydrophobicContact CG1-SD 4.34Å; M409-S416 CarbonylContact O-C 3.57Å; M409-S416 WeakPolarHBondContact O-CA 3.43Å; M409-F417 HydrophobicContact CE-CB 4.27Å; M409-F417 HydrophobicContact CE-CD2 4.16Å; M409-F417 HydrophobicContact CE-CG 4.39Å; M409-F417 PolarHBondContact N-O 3.4Å; M409-F417 PolarHBondContact O-N 2.84Å; M409-F419 HydrophobicContact CB-CB 4.1Å; M409-F419 HydrophobicContact CB-CD2 4.47Å; M409-F419 HydrophobicContact CB-CG 4.26Å; M409-A425 HydrophobicContact SD-CB 3.79Å
410	V	96.6	Very high	94.3	Very high	28 Å²	28	29.5 Å²	29.5	17%	0.17	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	125.9	-176.6	-176.3	0	0	0	0	110.1	L238 V278 F279 C408 T415	L238-V410 HydrophobicContact CD1-CG1 3.78Å; L238-V410 HydrophobicContact CD1-CG2 4.32Å; V278-V410 CarbonylContact C-O 3.59Å; V278-V410 WeakPolarHBondContact CA-O 3.37Å; F279-V410 PolarHBondContact N-O 2.88Å; F279-V410 PolarHBondContact O-N 2.77Å; C408-V410 HydrophobicContact CB-CG2 4.24Å; V410-T415 CarbonylContact C-O 3.57Å; V410-T415 WeakPolarHBondContact CA-O 3.48Å
411	V	97.6	Very high	94.2	Very high	5 Å²	5	33.7 Å²	33.7	3%	0.03	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	123.2	179.4	-178.9	0	0	0	0	109.1	L224 V272 A274 G413 G414 T415 F417	L224-V411 HydrophobicContact CD1-CG1 4.49Å; L224-V411 HydrophobicContact CD1-CG2 3.96Å; L224-V411 HydrophobicContact CD2-CG2 4.22Å; V272-V411 HydrophobicContact CG2-CB 4.39Å; V272-V411 HydrophobicContact CG2-CG1 4.18Å; V272-V411 HydrophobicContact CG2-CG2 4.17Å; A274-V411 HydrophobicContact CB-CG1 3.67Å; V411-G413 PolarHBondContact O-N 3.46Å; V411-G414 PolarHBondContact O-N 2.78Å; V411-T415 PolarHBondContact N-O 3.08Å; V411-T415 PolarHBondContact O-N 3.04Å; V411-T415 VanDerWaalsContact O-N 3.16Å; V411-F417 HydrophobicContact CG2-CD2 4.38Å; V411-F417 HydrophobicContact CG2-CE2 4.04Å
412	D	96.8	Very high	94	Very high	17 Å²	17	31.5 Å²	31.5	9%	0.091	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	24.2	177.5	-68	-20.2	0	0	0	114.7	L165 L275 N276 E277 G414	L165-D412 HydrophobicContact CD1-CB 4.27Å; L165-D412 HydrophobicContact CD2-CB 4.31Å; L275-D412 PolarHBondContact N-OD1 3.35Å; L275-D412 VanDerWaalsContact N-OD1 3.16Å; L275-D412 PolarHBondContact N-OD2 2.86Å; N276-D412 WeakPolarHBondContact CA-OD1 3.45Å; N276-D412 WeakPolarHBondContact CB-OD1 3.32Å; N276-D412 PolarHBondContact N-OD1 3.45Å; E277-D412 PolarHBondContact N-OD1 3.04Å; E277-D412 VanDerWaalsContact N-OD1 3.11Å; E277-D412 PolarHBondContact O-N 2.93Å; D412-G414 PolarHBondContact O-N 3.35Å; D412-G414 VanDerWaalsContact O-N 3.11Å
413	G	91.6	Very high	93.9	Very high	44 Å²	44	31.6 Å²	31.6	45%	0.454	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.6	-0.4	-177	0	0	0	0	0	115.4	V411	V411-G413 PolarHBondContact O-N 3.46Å
414	G	87.6	Confident	94	Very high	9 Å²	9	28.3 Å²	28.3	9%	0.093	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-32.5	-173.1	0	0	0	0	0	114.7	L238 V411 D412	L238-G414 PolarHBondContact N-O 3.32Å; V411-G414 PolarHBondContact O-N 2.78Å; D412-G414 PolarHBondContact O-N 3.35Å; D412-G414 VanDerWaalsContact O-N 3.11Å
415	T	92.3	Very high	94.1	Very high	25 Å²	25	28.2 Å²	28.2	15%	0.153	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	130.6	-176.5	-57.7	0	0	0	0	110.5	P235 V236 V272 V410 V411 F417	P235-T415 HydrophobicContact CB-CG2 3.45Å; P235-T415 VanDerWaalsContact CB-CG2 3.45Å; V236-T415 WeakPolarHBondContact O-CA 3.44Å; V272-T415 HydrophobicContact CG1-CG2 4.43Å; V410-T415 CarbonylContact C-O 3.57Å; V410-T415 WeakPolarHBondContact CA-O 3.48Å; V411-T415 PolarHBondContact N-O 3.08Å; V411-T415 PolarHBondContact O-N 3.04Å; V411-T415 VanDerWaalsContact O-N 3.16Å; T415-F417 HydrophobicContact CG2-CE2 3.73Å; T415-F417 HydrophobicContact CG2-CZ 3.85Å
416	S	93.6	Very high	94.4	Very high	4 Å²	4	19.3 Å²	19.3	3%	0.028	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	146.4	179.9	-166.6	0	0	0	0	112	V236 C408 M409	V236-S416 PolarHBondContact N-O 3.11Å; V236-S416 PolarHBondContact O-N 3.41Å; C408-S416 WeakPolarHBondContact CB-OG 3.44Å; M409-S416 CarbonylContact O-C 3.57Å; M409-S416 WeakPolarHBondContact O-CA 3.43Å
417	F	93.5	Very high	94.8	Very high	1 Å²	1	17.9 Å²	17.9	0%	0.004	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	145.3	171	-58.4	-90.4	0	0	0	109.5	P233 P235 L270 V272 C408 M409 V411 T415	P233-F417 WeakPolarHBondContact O-CE1 3.46Å; P235-F417 HydrophobicContact CB-CE1 3.72Å; P235-F417 HydrophobicContact CB-CZ 3.83Å; L270-F417 HydrophobicContact CB-CZ 4.34Å; L270-F417 HydrophobicContact CD1-CD1 4.13Å; L270-F417 HydrophobicContact CD1-CD2 3.96Å; L270-F417 HydrophobicContact CD1-CE1 4.04Å; L270-F417 HydrophobicContact CD1-CE2 3.88Å; L270-F417 HydrophobicContact CD1-CG 4.08Å; L270-F417 HydrophobicContact CD1-CZ 3.92Å; L270-F417 HydrophobicContact CD2-CD1 4.19Å; L270-F417 HydrophobicContact CD2-CE1 3.97Å; L270-F417 HydrophobicContact CD2-CZ 4.49Å; L270-F417 HydrophobicContact CG-CE1 4.44Å; L270-F417 HydrophobicContact CG-CZ 4.49Å; V272-F417 HydrophobicContact CG2-CE2 3.76Å; V272-F417 HydrophobicContact CG2-CZ 3.76Å; C408-F417 CarbonylContact C-O 3.55Å; C408-F417 VanDerWaalsContact CA-O 3.32Å; C408-F417 WeakPolarHBondContact CA-O 3.39Å; M409-F417 HydrophobicContact CE-CB 4.27Å; M409-F417 HydrophobicContact CE-CD2 4.16Å; M409-F417 HydrophobicContact CE-CG 4.39Å; M409-F417 PolarHBondContact N-O 3.4Å; M409-F417 PolarHBondContact O-N 2.84Å; V411-F417 HydrophobicContact CG2-CD2 4.38Å; V411-F417 HydrophobicContact CG2-CE2 4.04Å; T415-F417 HydrophobicContact CG2-CE2 3.73Å; T415-F417 HydrophobicContact CG2-CZ 3.85Å
418	E	92.6	Very high	95	Very high	49 Å²	49	19.7 Å²	19.7	23%	0.229	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	135	171.5	-172.7	177	166.5	0	0	110.3	N232 N420	N232-E418 HydrophobicContact CB-CB 4.45Å; E418-N420 HydrophobicContact CG-CB 4.49Å; E418-N420 VanDerWaalsContact CG-ND2 3.33Å; E418-N420 WeakPolarHBondContact CG-ND2 3.33Å; E418-N420 PolarHBondContact OE1-ND2 2.93Å
419	F	94.5	Very high	95	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	13%	0.126	C	C	.	.			trans	-140.4	53	-175.6	-159.4	-109.5	0	0	0	112.6	L226 I280 V400 S402 A407 M409 A423 A425	L226-F419 HydrophobicContact CD1-CD2 3.77Å; L226-F419 HydrophobicContact CD1-CE2 3.78Å; I280-F419 HydrophobicContact CD1-CE1 4.24Å; I280-F419 HydrophobicContact CG2-CD1 3.42Å; I280-F419 VanDerWaalsContact CG2-CD1 3.42Å; I280-F419 HydrophobicContact CG2-CE1 3.62Å; I280-F419 HydrophobicContact CG2-CG 4.44Å; V400-F419 HydrophobicContact CB-CE1 4.49Å; V400-F419 HydrophobicContact CB-CZ 4.38Å; V400-F419 HydrophobicContact CG1-CE1 3.97Å; V400-F419 HydrophobicContact CG1-CZ 4.32Å; V400-F419 WeakPolarHBondContact O-CZ 3.21Å; S402-F419 VanDerWaalsContact CB-O 3.25Å; S402-F419 WeakPolarHBondContact CB-O 3.42Å; S402-F419 PolarHBondContact OG-O 3.26Å; A407-F419 WeakPolarHBondContact CB-O 3.2Å; A407-F419 PolarHBondContact O-N 2.58Å; M409-F419 HydrophobicContact CB-CB 4.1Å; M409-F419 HydrophobicContact CB-CD2 4.47Å; M409-F419 HydrophobicContact CB-CG 4.26Å; F419-A423 HydrophobicContact CD2-CB 3.78Å; F419-A423 HydrophobicContact CE2-CB 3.82Å; F419-A423 HydrophobicContact CG-CB 4.4Å; F419-A425 HydrophobicContact CD2-CB 4.4Å; F419-A425 HydrophobicContact CE2-CB 3.43Å; F419-A425 VanDerWaalsContact CE2-CB 3.43Å; F419-A425 HydrophobicContact CZ-CB 3.6Å
420	N	94.4	Very high	95	Very high	35 Å²	35	22.1 Å²	22.1	19%	0.187	14%	0.136	C	C	.	.			trans	-83	174.7	-176.6	-69.8	-26.6	0	0	0	113.5	S402 W405 D406 A407 E418 G422 A423	S402-N420 VanDerWaalsContact CB-O 3.24Å; S402-N420 WeakPolarHBondContact CB-O 3.1Å; S402-N420 PolarHBondContact OG-O 3.17Å; W405-N420 VanDerWaalsContact C-OD1 3.27Å; W405-N420 PolarHBondContact O-OD1 2.78Å; D406-N420 VanDerWaalsContact CA-OD1 3.23Å; D406-N420 WeakPolarHBondContact CA-OD1 3.43Å; D406-N420 PolarHBondContact N-OD1 3.19Å; A407-N420 PolarHBondContact N-OD1 3.45Å; E418-N420 HydrophobicContact CG-CB 4.49Å; E418-N420 VanDerWaalsContact CG-ND2 3.33Å; E418-N420 WeakPolarHBondContact CG-ND2 3.33Å; E418-N420 PolarHBondContact OE1-ND2 2.93Å; N420-G422 PolarHBondContact O-N 3.13Å; N420-A423 WeakPolarHBondContact O-CB 3.47Å; N420-A423 PolarHBondContact O-N 3.07Å
421	D	95.3	Very high	95	Very high	87 Å²	87	28 Å²	28	47%	0.465	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.1	130.2	-175.1	-177	50.5	0	0	0	112.5	R403 C404 A423	R403-D421 WeakPolarHBondContact CA-OD1 3.5Å; R403-D421 WeakPolarHBondContact CD-OD1 3.37Å; R403-D421 IonicContact NH1-OD1 3.07Å; C404-D421 WeakPolarHBondContact O-CA 3.45Å; C404-D421 WeakPolarHBondContact O-CB 3.49Å; C404-D421 PolarHBondContact O-N 3.34Å; D421-A423 VanDerWaalsContact C-N 3.32Å
422	G	93.2	Very high	94.9	Very high	15 Å²	15	32.8 Å²	32.8	16%	0.155	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	-12.3	-177.4	0	0	0	0	0	115.1	T229 S402 N420	T229-G422 PolarHBondContact N-O 3.31Å; S402-G422 PolarHBondContact O-N 3.12Å; S402-G422 VanDerWaalsContact O-N 3.12Å; N420-G422 PolarHBondContact O-N 3.13Å
423	A	95.4	Very high	94.9	Very high	3 Å²	3	32.2 Å²	32.2	3%	0.025	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	143.2	169.8	0	0	0	0	0	111.3	E227 I231 R401 S402 F419 N420 D421	E227-A423 CarbonylContact O-C 3.54Å; I231-A423 HydrophobicContact CG2-CB 3.94Å; R401-A423 WeakPolarHBondContact CA-O 3.13Å; S402-A423 PolarHBondContact N-O 3.39Å; F419-A423 HydrophobicContact CD2-CB 3.78Å; F419-A423 HydrophobicContact CE2-CB 3.82Å; F419-A423 HydrophobicContact CG-CB 4.4Å; N420-A423 WeakPolarHBondContact O-CB 3.47Å; N420-A423 PolarHBondContact O-N 3.07Å; D421-A423 VanDerWaalsContact C-N 3.32Å
424	I	97.2	Very high	95.2	Very high	24 Å²	24	31.3 Å²	31.3	12%	0.123	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	126.7	177.1	-56.7	173.8	0	0	0	108.6	L226 E227 W300 V400 R401	L226-I424 WeakPolarHBondContact CA-O 3.17Å; E227-I424 HydrophobicContact CG-CB 3.68Å; E227-I424 HydrophobicContact CG-CD1 4.43Å; E227-I424 HydrophobicContact CG-CG2 4.13Å; E227-I424 PolarHBondContact N-O 2.93Å; E227-I424 PolarHBondContact O-N 3Å; W300-I424 HydrophobicContact CH2-CG2 4.5Å; V400-I424 CarbonylContact O-C 3.53Å; V400-I424 VanDerWaalsContact O-CA 3.24Å; V400-I424 WeakPolarHBondContact O-CA 3.46Å; R401-I424 HydrophobicContact CB-CG1 4.1Å; R401-I424 HydrophobicContact CG-CG1 4.01Å
425	A	97.4	Very high	95.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	129.7	173.3	0	0	0	0	0	109.6	Y225 I280 C399 V400 M409 F419 M427	Y225-A425 CarbonylContact O-C 3.49Å; Y225-A425 VanDerWaalsContact O-CA 3.29Å; Y225-A425 WeakPolarHBondContact O-CA 3.39Å; I280-A425 HydrophobicContact CD1-CB 4.44Å; C399-A425 CarbonylContact C-O 3.5Å; C399-A425 WeakPolarHBondContact CA-O 3.26Å; V400-A425 PolarHBondContact N-O 3.36Å; V400-A425 PolarHBondContact O-N 2.9Å; M409-A425 HydrophobicContact SD-CB 3.79Å; F419-A425 HydrophobicContact CD2-CB 4.4Å; F419-A425 HydrophobicContact CE2-CB 3.43Å; F419-A425 VanDerWaalsContact CE2-CB 3.43Å; F419-A425 HydrophobicContact CZ-CB 3.6Å; A425-M427 HydrophobicContact CB-CE 4Å
426	S	97.7	Very high	96	Very high	17 Å²	17	31.6 Å²	31.6	12%	0.119	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	121.6	170.2	-66.8	0	0	0	0	109.7	L224 Y225 C399	L224-S426 WeakPolarHBondContact CA-O 3.49Å; Y225-S426 PolarHBondContact N-O 2.64Å; Y225-S426 PolarHBondContact O-N 3.47Å; C399-S426 PolarHBondContact SG-OG 2.83Å
427	M	98.1	Very high	96.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	127.9	-175.6	-71.6	149.6	-68.4	0	0	110	I222 R223 L224 V278 I280 L310 K397 V398 V400 A425	I222-M427 HydrophobicContact CG2-CB 3.68Å; I222-M427 HydrophobicContact CG2-CG 3.98Å; R223-M427 VanDerWaalsContact O-CA 3.29Å; R223-M427 WeakPolarHBondContact O-CA 3.4Å; L224-M427 HydrophobicContact CD2-CG 3.87Å; L224-M427 HydrophobicContact CD2-SD 4.41Å; L224-M427 HydrophobicContact CG-CG 4.26Å; V278-M427 HydrophobicContact CB-SD 4.33Å; V278-M427 HydrophobicContact CG1-SD 3.97Å; I280-M427 HydrophobicContact CD1-CE 3.97Å; I280-M427 HydrophobicContact CD1-SD 4.06Å; L310-M427 HydrophobicContact CD1-CE 4.35Å; L310-M427 HydrophobicContact CD1-SD 3.7Å; L310-M427 HydrophobicContact CD2-CB 4.31Å; L310-M427 HydrophobicContact CD2-CE 3.93Å; L310-M427 HydrophobicContact CD2-SD 3.67Å; L310-M427 HydrophobicContact CG-SD 4.27Å; K397-M427 CarbonylContact C-O 3.59Å; K397-M427 WeakPolarHBondContact CA-O 3.43Å; V398-M427 HydrophobicContact CG1-CE 4.49Å; V398-M427 PolarHBondContact N-O 3.27Å; V398-M427 WeakPolarHBondContact O-CE 3.34Å; V398-M427 PolarHBondContact O-N 3.25Å; V400-M427 HydrophobicContact CB-CE 4.23Å; V400-M427 HydrophobicContact CG2-CE 3.6Å; A425-M427 HydrophobicContact CB-CE 4Å
428	M	97.6	Very high	96.3	Very high	40 Å²	40	32.2 Å²	32.2	20%	0.197	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	160.7	-176.4	59.7	-169.6	62.4	0	0	112	R223 Y225 S396 K397	R223-M428 HydrophobicContact CB-CG 4.22Å; R223-M428 PolarHBondContact N-O 3.46Å; R223-M428 PolarHBondContact O-N 3.07Å; R223-M428 VanDerWaalsContact O-N 3.07Å; Y225-M428 HydrophobicContact CD2-CE 4.39Å; Y225-M428 HydrophobicContact CE2-CE 4.35Å; Y225-M428 HydrophobicContact CE2-SD 4.01Å; S396-M428 WeakPolarHBondContact O-CA 3.33Å; K397-M428 HydrophobicContact CD-CE 4.3Å; K397-M428 HydrophobicContact CG-CE 4.36Å
429	I	96.6	Very high	96.4	Very high	23 Å²	23	33.1 Å²	33.1	12%	0.118	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	125.2	173.1	-60.1	-61.6	0	0	0	109.8	Q220 R221 I222 P371 I373 S396	Q220-I429 HydrophobicContact CB-CD1 4.32Å; Q220-I429 HydrophobicContact CB-CG2 4.25Å; Q220-I429 HydrophobicContact CG-CG2 4.36Å; R221-I429 WeakPolarHBondContact O-CD1 3.46Å; I222-I429 HydrophobicContact CG1-CD1 4Å; P371-I429 HydrophobicContact CB-CG2 3.96Å; I373-I429 HydrophobicContact CD1-CD1 4.27Å; I373-I429 HydrophobicContact CD1-CG1 4.07Å; I373-I429 HydrophobicContact CG1-CD1 3.81Å; I373-I429 HydrophobicContact CG1-CG1 3.58Å; S396-I429 PolarHBondContact O-N 3.49Å
430	N	95.9	Very high	96.3	Very high	39 Å²	39	33.3 Å²	33.3	21%	0.209	17%	0.168	C	C	.	.			trans	-124	136.9	173.5	-65.7	8.9	0	0	0	110.1	R223 E432 D433	R223-N430 VanDerWaalsContact CZ-ND2 3.34Å; R223-N430 PolarHBondContact NH1-ND2 3.18Å; N430-E432 HydrophobicContact CB-CG 4.08Å; N430-E432 PolarHBondContact O-N 3.12Å; N430-D433 WeakPolarHBondContact CB-OD2 3.14Å; N430-D433 PolarHBondContact O-N 2.89Å
431	K	95.3	Very high	95.5	Very high	151 Å²	151	39.6 Å²	39.6	66%	0.657	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-57	-32.6	179	-173.5	173.7	-175.5	173	0	113.6	D433 E434	K431-D433 PolarHBondContact O-N 3.31Å; K431-E434 WeakPolarHBondContact O-CB 3.49Å; K431-E434 WeakPolarHBondContact O-CG 3.2Å; K431-E434 PolarHBondContact O-N 3.01Å
432	E	96.2	Very high	93.8	Very high	105 Å²	105	45.5 Å²	45.5	49%	0.491	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-70.4	-15.4	178.4	63.2	-172.3	-171.7	0	0	113.8	R223 N430	R223-E432 IonicContact CZ-OE1 3.38Å; R223-E432 IonicContact NH1-OE1 2.75Å; R223-E432 PolarHBondContact NH1-OE1 3.48Å; R223-E432 VanDerWaalsContact NH2-CD 3.31Å; R223-E432 VanDerWaalsContact NH2-CG 3.26Å; R223-E432 IonicContact NH2-OE1 3.1Å; R223-E432 PolarHBondContact NH2-OE1 2.91Å; N430-E432 HydrophobicContact CB-CG 4.08Å; N430-E432 PolarHBondContact O-N 3.12Å
433	D	97.2	Very high	93.8	Very high	6 Å²	6	47 Å²	47	3%	0.032	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-95.9	5.4	174.5	-58.5	-54.6	0	0	0	112.6	R221 R223 R273 N430 K431 L435	R221-D433 VanDerWaalsContact CZ-O 3.24Å; R221-D433 PolarHBondContact NE-O 3.26Å; R221-D433 PolarHBondContact NH2-O 2.89Å; R223-D433 WeakPolarHBondContact CB-OD2 3.45Å; R223-D433 IonicContact CZ-OD1 2.79Å; R223-D433 IonicContact CZ-OD2 3.47Å; R223-D433 IonicContact NE-OD1 2.76Å; R223-D433 IonicContact NE-OD2 3.61Å; R223-D433 PolarHBondContact NE-OD2 2.89Å; R223-D433 IonicContact NH2-OD1 3.63Å; R223-D433 PolarHBondContact NH2-OD1 3.27Å; R223-D433 IonicContact NH2-OD2 3.71Å; R223-D433 PolarHBondContact NH2-OD2 2.84Å; R273-D433 HydrophobicContact CG-CB 4.3Å; R273-D433 IonicContact CZ-OD1 2.67Å; R273-D433 IonicContact NE-OD1 3.66Å; R273-D433 PolarHBondContact NE-OD1 3.49Å; R273-D433 IonicContact NE-OD2 3.99Å; R273-D433 IonicContact NH2-OD1 2.67Å; N430-D433 WeakPolarHBondContact CB-OD2 3.14Å; N430-D433 PolarHBondContact O-N 2.89Å; K431-D433 PolarHBondContact O-N 3.31Å; D433-L435 PolarHBondContact O-N 2.83Å
434	E	97.8	Very high	93.8	Very high	24 Å²	24	49.3 Å²	49.3	11%	0.112	24%	0.235	C	C	.	.			trans	-57	139.5	175.8	-71.6	171.2	162.5	0	0	111.1	R174 W218 R219 Q220 K431	R174-E434 WeakPolarHBondContact CA-O 3.41Å; R174-E434 VanDerWaalsContact CB-O 3.27Å; R174-E434 WeakPolarHBondContact CB-O 3.39Å; W218-E434 HydrophobicContact CE3-CB 4.02Å; R219-E434 CarbonylContact O-C 3.6Å; R219-E434 WeakPolarHBondContact O-CA 3.24Å; Q220-E434 PolarHBondContact NE2-OE1 2.92Å; K431-E434 WeakPolarHBondContact O-CB 3.49Å; K431-E434 WeakPolarHBondContact O-CG 3.2Å; K431-E434 PolarHBondContact O-N 3.01Å
435	L	98.4	Very high	93.6	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	119.1	173.7	-173.5	74.5	0	0	0	109.6	M164 A168 V171 V178 R219 R221 L275 D433 T437	M164-L435 HydrophobicContact CE-CD2 3.7Å; A168-L435 HydrophobicContact CB-CD1 4.45Å; A168-L435 HydrophobicContact CB-CD2 3.6Å; V171-L435 HydrophobicContact CB-CD1 4.18Å; V171-L435 HydrophobicContact CG1-CD1 3.95Å; V178-L435 HydrophobicContact CG2-CD1 3.8Å; V178-L435 HydrophobicContact CG2-CG 4.47Å; R219-L435 HydrophobicContact CB-CB 4.35Å; R219-L435 PolarHBondContact N-O 3.2Å; R219-L435 PolarHBondContact O-N 2.95Å; R221-L435 HydrophobicContact CG-CB 4.26Å; L275-L435 HydrophobicContact CD1-CD2 4.07Å; L275-L435 HydrophobicContact CD2-CD2 3.74Å; D433-L435 PolarHBondContact O-N 2.83Å; L435-T437 HydrophobicContact CD2-CG2 3.93Å; L435-T437 HydrophobicContact CG-CG2 4.1Å; L435-T437 PolarHBondContact O-N 3.15Å
436	R	97.9	Very high	93.3	Very high	40 Å²	40	53.7 Å²	53.7	15%	0.151	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	115.1	175.5	-175.8	164.9	75.6	159.3	9.3	110.8	R174 L175 P177 V178 W216 W218	R174-R436 VanDerWaalsContact O-CB 3.28Å; R174-R436 WeakPolarHBondContact O-CB 3.41Å; L175-R436 PolarHBondContact O-NE 2.96Å; L175-R436 VanDerWaalsContact O-NE 3.13Å; L175-R436 PolarHBondContact O-NH2 2.74Å; P177-R436 WeakPolarHBondContact CA-O 3.31Å; V178-R436 PolarHBondContact N-O 2.9Å; W216-R436 HydrophobicContact CD2-CG 3.94Å; W216-R436 HydrophobicContact CE3-CG 3.4Å; W216-R436 HydrophobicContact CG-CG 4.47Å; W216-R436 HydrophobicContact CZ3-CG 3.89Å; W218-R436 HydrophobicContact CE3-CB 4.1Å; W218-R436 HydrophobicContact CH2-CB 4.17Å; W218-R436 HydrophobicContact CH2-CG 4.16Å; W218-R436 HydrophobicContact CZ2-CG 4.37Å; W218-R436 HydrophobicContact CZ3-CB 3.8Å; W218-R436 HydrophobicContact CZ3-CG 4.26Å
437	T	97.7	Very high	93.1	Very high	4 Å²	4	56 Å²	56	3%	0.025	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	170	174.4	62.3	0	0	0	0	110.9	M164 V178 L217 R219 L435	M164-T437 HydrophobicContact CE-CG2 4.18Å; V178-T437 WeakPolarHBondContact O-CA 3.44Å; V178-T437 WeakPolarHBondContact O-CG2 3.45Å; L217-T437 PolarHBondContact N-O 3.48Å; L217-T437 PolarHBondContact O-N 3.45Å; L217-T437 PolarHBondContact O-OG1 3.02Å; L217-T437 VanDerWaalsContact O-OG1 3.13Å; R219-T437 HydrophobicContact CG-CG2 4.41Å; R219-T437 PolarHBondContact NE-OG1 2.74Å; L435-T437 HydrophobicContact CD2-CG2 3.93Å; L435-T437 HydrophobicContact CG-CG2 4.1Å; L435-T437 PolarHBondContact O-N 3.15Å
438	V	95.6	Very high	92.7	Very high	13 Å²	13	59.7 Å²	59.7	8%	0.079	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	137.7	-179	178.2	0	0	0	0	110.7	I179 L194 F209 F214 W216 L440	I179-V438 HydrophobicContact CD1-CG2 4.18Å; I179-V438 HydrophobicContact CG1-CG2 3.9Å; L194-V438 HydrophobicContact CD2-CB 4.48Å; L194-V438 HydrophobicContact CD2-CG1 4.39Å; F209-V438 HydrophobicContact CD1-CG1 4.15Å; F209-V438 HydrophobicContact CE1-CB 4.41Å; F209-V438 HydrophobicContact CE1-CG1 3.49Å; F209-V438 VanDerWaalsContact CE1-CG1 3.49Å; F209-V438 HydrophobicContact CZ-CG1 4.18Å; F214-V438 HydrophobicContact CB-CG1 3.97Å; F214-V438 HydrophobicContact CD2-CG1 3.68Å; F214-V438 HydrophobicContact CD2-CG2 4.33Å; F214-V438 HydrophobicContact CE2-CG2 4.41Å; F214-V438 HydrophobicContact CG-CG1 4.08Å; W216-V438 HydrophobicContact CE3-CG2 3.96Å; W216-V438 HydrophobicContact CH2-CG2 4.17Å; W216-V438 HydrophobicContact CZ3-CG2 3.42Å; W216-V438 VanDerWaalsContact CZ3-CG2 3.42Å; V438-L440 HydrophobicContact CG1-CG 4.34Å
439	L	94.7	Very high	92.4	Very high	68 Å²	68	61.1 Å²	61.1	36%	0.356	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	124.3	164.7	-168.6	76.4	0	0	0	109.7	R215	R215-L439 HydrophobicContact CG-CB 4.08Å; R215-L439 HydrophobicContact CG-CD2 4.37Å; R215-L439 PolarHBondContact N-O 2.93Å; R215-L439 PolarHBondContact O-N 2.9Å
440	L	92.7	Very high	92	Very high	5 Å²	5	64.1 Å²	64.1	3%	0.026	30%	0.3	C	S	.	.			trans	-102.5	128.9	167.1	-68.9	173.5	0	0	0	108	L194 P195 Y198 A205 K208 F209 E213 F214 V438	L194-L440 HydrophobicContact CD1-CD1 4.32Å; L194-L440 HydrophobicContact CD2-CD1 3.98Å; L194-L440 HydrophobicContact CD2-CG 4.24Å; P195-L440 HydrophobicContact CG-CB 4.49Å; Y198-L440 HydrophobicContact CD1-CD1 4.47Å; Y198-L440 HydrophobicContact CD2-CD1 3.68Å; Y198-L440 HydrophobicContact CE1-CD1 4.26Å; Y198-L440 HydrophobicContact CE2-CB 3.82Å; Y198-L440 HydrophobicContact CE2-CD1 3.4Å; Y198-L440 VanDerWaalsContact CE2-CD1 3.4Å; Y198-L440 HydrophobicContact CE2-CG 4.23Å; Y198-L440 HydrophobicContact CG-CD1 4.2Å; A205-L440 HydrophobicContact CB-CD1 3.93Å; K208-L440 HydrophobicContact CB-CD2 3.91Å; K208-L440 HydrophobicContact CD-CD2 3.96Å; F209-L440 HydrophobicContact CD1-CD2 4.28Å; F209-L440 HydrophobicContact CE1-CD1 3.77Å; F209-L440 HydrophobicContact CE1-CD2 3.88Å; F209-L440 HydrophobicContact CE1-CG 3.95Å; F209-L440 HydrophobicContact CZ-CD1 4.2Å; E213-L440 WeakPolarHBondContact O-CD2 3.33Å; F214-L440 HydrophobicContact CB-CD2 3.56Å; V438-L440 HydrophobicContact CG1-CG 4.34Å
441	E	78.1	Confident	91.7	Very high	167 Å²	167	66.2 Å²	66.2	78%	0.78	31%	0.308	S	S	*	.			trans	-63	143	172	-66.5	-173.9	168.2	0	0	109.8	R197	R197-E441 PolarHBondContact NH2-O 3.04Å
442	Q	59.2	Low	91.4	Very high	210 Å²	210	58.5 Å²	58.5	98%	0.981	28%	0.276	S	S	*	.			trans	-68.8	0	176.3	-72.5	-176.8	8	0	0	110.3	P195 R197	P195-Q442 HydrophobicContact CG-CG 4.43Å; R197-Q442 PolarHBondContact NH1-OXT 3.32Å; R197-Q442 PolarHBondContact NH2-OXT 3.18Å

Retrieved 442 of 442 residues in 134.4 ms (Link to these results)

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