A0A5K4FBN8_SCHMA Loading...

Complement component 1 Q subcomponent-binding protein, mitochondrial

AlphaFold DB , UniProt , Accession A0A5K4FBN8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 239 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34	Very low	37.4	Very low	242 Å²	242	135.2 Å²	135.2	100%	1.192	72%	0.715	S	S	*	*				0	84	0	-65.8	-135	-129.7	0	0	106.1
2	S	34.4	Very low	37.2	Very low	57 Å²	57	131.7 Å²	131.7	40%	0.399	72%	0.719	S	S	.	*			trans	-91.5	107.3	-162.1	-142.7	0	0	0	0	109.1	L4	S2-L4 PolarHBondContact O-N 3.36Å; S2-L4 WeakPolarHBondContact OG-CD1 3.22Å
3	R	40.8	Very low	36.6	Very low	232 Å²	232	139.8 Å²	139.8	88%	0.875	73%	0.733	S	S	*	*			trans	-88.5	85	171.3	-79.4	-179.3	161.2	171.6	-3.8	108	V5	R3-V5 PolarHBondContact O-N 3.07Å
4	L	43.3	Very low	36.7	Very low	61 Å²	61	139.3 Å²	139.3	32%	0.319	73%	0.73	S	S	.	*			trans	-85.5	93.7	170.1	-100.5	116.9	0	0	0	109.8	S2 A6 L125	S2-L4 PolarHBondContact O-N 3.36Å; S2-L4 WeakPolarHBondContact OG-CD1 3.22Å; L4-A6 PolarHBondContact O-N 2.79Å; L4-L125 HydrophobicContact CD2-CB 3.39Å; L4-L125 HydrophobicContact CD2-CD1 3.33Å; L4-L125 HydrophobicContact CD2-CG 3.26Å; L4-L125 HydrophobicContact CG-CG 4.48Å
5	V	44.8	Very low	36.5	Very low	63 Å²	63	138.3 Å²	138.3	38%	0.382	73%	0.732	S	S	.	*			trans	24.1	64.7	149.8	-161.4	0	0	0	0	117.6	R3 R7 V8	R3-V5 PolarHBondContact O-N 3.07Å; V5-R7 PolarHBondContact O-N 2.95Å; V5-V8 HydrophobicContact CG1-CG2 4.34Å
6	A	33.9	Very low	36.6	Very low	69 Å²	69	138.9 Å²	138.9	57%	0.57	73%	0.727	S	S	*	*			trans	-85.7	41.8	157.9	0	0	0	0	0	112.5	L4	L4-A6 PolarHBondContact O-N 2.79Å
7	R	39.9	Very low	36.8	Very low	231 Å²	231	136.8 Å²	136.8	87%	0.872	74%	0.735	S	S	*	*			trans	-128.8	9	-168.3	-104	-175.5	172.4	172.7	-0.8	119.6	V5	V5-R7 PolarHBondContact O-N 2.95Å
8	V	39.9	Very low	36.9	Very low	117 Å²	117	137.8 Å²	137.8	71%	0.709	74%	0.739	S	S	*	*	S	Bend	trans	-102.3	-9.2	-179.4	-177.9	0	0	0	0	114.7	V5	V5-V8 HydrophobicContact CG1-CG2 4.34Å
9	L	35.9	Very low	37.4	Very low	168 Å²	168	141.5 Å²	141.5	88%	0.88	75%	0.748	S	S	*	*	S	Bend	trans	-113.2	-1.6	-174.7	-78.2	163.5	0	0	0	117.9
10	L	33.5	Very low	37.5	Very low	174 Å²	174	137.8 Å²	137.8	91%	0.911	75%	0.746	S	S	*	*	S	Bend	trans	-108.6	86.4	173.2	-100.7	81.8	0	0	0	113.3
11	G	31.3	Very low	37.8	Very low	73 Å²	73	138 Å²	138	75%	0.753	75%	0.752	S	S	*	*			trans	68.6	54.3	132.1	0	0	0	0	0	119.3	R13	G11-R13 VanDerWaalsContact C-N 3.27Å; G11-R13 PolarHBondContact O-N 3.39Å
12	A	34.6	Very low	38.1	Very low	93 Å²	93	135.1 Å²	135.1	77%	0.769	74%	0.735	S	S	*	*			trans	-78.9	77.7	160.7	0	0	0	0	0	110.9	L14	A12-L14 VanDerWaalsContact C-N 3.29Å; A12-L14 PolarHBondContact O-N 2.86Å
13	R	30.1	Very low	38.5	Very low	238 Å²	238	138.5 Å²	138.5	90%	0.898	75%	0.754	S	S	*	*			trans	-71.4	81.5	169.3	-156.5	-179.4	-168.9	-176.7	3.8	108.9	G11 T15	G11-R13 VanDerWaalsContact C-N 3.27Å; G11-R13 PolarHBondContact O-N 3.39Å; R13-T15 PolarHBondContact O-N 2.78Å
14	L	37	Very low	38.4	Very low	132 Å²	132	134.9 Å²	134.9	69%	0.691	75%	0.75	S	S	*	*			trans	-84.8	98.3	175.3	-101.6	143.1	0	0	0	110.5	A12 F16	A12-L14 VanDerWaalsContact C-N 3.29Å; A12-L14 PolarHBondContact O-N 2.86Å; L14-F16 PolarHBondContact O-N 3.02Å
15	T	34.4	Very low	38.3	Very low	125 Å²	125	136.1 Å²	136.1	77%	0.767	76%	0.764	S	S	*	*			trans	-75.3	114	166.1	48.2	0	0	0	0	110	R13	R13-T15 PolarHBondContact O-N 2.78Å
16	F	38.4	Very low	38.5	Very low	148 Å²	148	142.4 Å²	142.4	65%	0.649	79%	0.787	S	S	*	*			trans	-85.5	116.3	169	-87.4	-90.3	0	0	0	110.5	L14	L14-F16 PolarHBondContact O-N 3.02Å
17	A	38.9	Very low	38.9	Very low	103 Å²	103	144.9 Å²	144.9	85%	0.851	80%	0.797	S	S	*	*			trans	-92.7	111.7	167.8	0	0	0	0	0	109.6
18	N	38.8	Very low	39.3	Very low	154 Å²	154	139 Å²	139	82%	0.824	79%	0.791	S	S	*	*			trans	-86.6	123.7	175.9	-172.6	12	0	0	0	110
19	K	47.3	Very low	39.8	Very low	208 Å²	208	138.4 Å²	138.4	90%	0.904	79%	0.788	S	S	*	*			trans	-127.7	97.6	162.7	-80.7	-171.3	178.9	-179.4	0	108.8
20	G	38.2	Very low	40.3	Very low	68 Å²	68	137.3 Å²	137.3	70%	0.701	79%	0.788	S	S	*	*			trans	-86.6	137.6	166.8	0	0	0	0	0	111.3
21	T	43.9	Very low	41.2	Very low	142 Å²	142	137.8 Å²	137.8	87%	0.871	78%	0.783	S	S	*	*			trans	-138.8	119.6	157.3	-40.7	0	0	0	0	107.2
22	Q	40.5	Very low	41.9	Very low	181 Å²	181	142.7 Å²	142.7	85%	0.846	79%	0.786	S	S	*	*			trans	-134.5	168.9	171	-87.5	-94.4	-0.8	0	0	106.7
23	V	44.1	Very low	42.2	Very low	129 Å²	129	146.1 Å²	146.1	78%	0.782	79%	0.791	S	S	*	*			trans	110.3	120.4	179.1	-178.9	0	0	0	0	109.8
24	L	37.5	Very low	43.3	Very low	155 Å²	155	140.3 Å²	140.3	81%	0.812	78%	0.782	S	S	*	*			cis	-158.4	154.2	29.4	-166.9	59.2	0	0	0	113
25	S	40.8	Very low	43.5	Very low	87 Å²	87	140.2 Å²	140.2	61%	0.608	79%	0.787	S	S	*	*			trans	-59.1	160.6	-179	59.4	0	0	0	0	120.4
26	K	49.1	Very low	44.1	Very low	196 Å²	196	138 Å²	138	85%	0.852	78%	0.777	S	S	*	*				-172.4	157.6	104.6	-97.2	-178.6	-176.5	176.9	0	112.5
27	P	43.2	Very low	44.5	Very low	120 Å²	120	136.5 Å²	136.5	78%	0.779	78%	0.779	S	S	*	*			trans	-114.4	160.5	-144.9	40.2	-30.3	0	0	0	114.8
28	S	48.5	Very low	44.8	Very low	109 Å²	109	141.5 Å²	141.5	76%	0.762	78%	0.776	S	S	*	*			trans	-164.2	150.7	146.4	80.1	0	0	0	0	112.4
29	T	50.1	Low	45.5	Very low	104 Å²	104	142.6 Å²	142.6	64%	0.638	77%	0.774	S	S	*	*			trans	98.4	92	162.1	-45.1	0	0	0	0	117	K31	T29-K31 HydrophobicContact CG2-CG 4.47Å; T29-K31 PolarHBondContact O-N 3.49Å
30	T	46.1	Very low	46.1	Very low	144 Å²	144	136.9 Å²	136.9	88%	0.883	76%	0.76	S	S	*	*			trans	-41.4	113.4	157.8	-34.6	0	0	0	0	112.3
31	K	51.7	Low	47.5	Very low	185 Å²	185	134.9 Å²	134.9	80%	0.804	74%	0.735	S	S	*	*			trans	-142	126.3	160.9	-69.2	-171	179.9	178.5	0	109.6	T29	T29-K31 HydrophobicContact CG2-CG 4.47Å; T29-K31 PolarHBondContact O-N 3.49Å
32	H	46.6	Very low	49.6	Very low	175 Å²	175	130.5 Å²	130.5	81%	0.81	71%	0.711	S	S	*	*			trans	-2	112.2	166.9	-113	-97.3	0	0	0	116.4	T34	H32-T34 PolarHBondContact O-N 3.39Å; H32-T34 VanDerWaalsContact O-N 3.07Å
33	L	41.5	Very low	51.9	Low	166 Å²	166	127 Å²	127	87%	0.869	69%	0.694	S	S	*	*			trans	-72	93.4	160.5	-80.4	120.4	0	0	0	108.2
34	T	52.1	Low	54.2	Low	116 Å²	116	125.4 Å²	125.4	71%	0.712	69%	0.685	S	S	*	*			trans	-80.1	114.4	149.8	45.2	0	0	0	0	106.3	H32 S36	H32-T34 PolarHBondContact O-N 3.39Å; H32-T34 VanDerWaalsContact O-N 3.07Å; T34-S36 PolarHBondContact O-N 3.18Å
35	T	42	Very low	57	Low	130 Å²	130	120 Å²	120	80%	0.798	66%	0.657	S	S	*	*			trans	-63.8	85.4	170.4	42.5	0	0	0	0	108.4	T37	T35-T37 PolarHBondContact O-N 2.65Å
36	S	46.5	Very low	59.4	Low	79 Å²	79	122.9 Å²	122.9	55%	0.552	65%	0.654	S	S	*	*			trans	-83	98.9	164.7	-174.7	0	0	0	0	105.6	T34 W38	T34-S36 PolarHBondContact O-N 3.18Å; S36-W38 PolarHBondContact O-N 2.91Å; S36-W38 PolarHBondContact OG-NE1 3.39Å
37	T	46.2	Very low	61.5	Low	115 Å²	115	118.2 Å²	118.2	71%	0.706	64%	0.635	S	S	*	*			trans	-69.6	86	169.9	6.1	0	0	0	0	107.3	T35 F39	T35-T37 PolarHBondContact O-N 2.65Å; T37-F39 VanDerWaalsContact C-N 3.27Å; T37-F39 HydrophobicContact CG2-CE2 4.21Å; T37-F39 PolarHBondContact O-N 3.12Å
38	W	45.5	Very low	64	Low	209 Å²	209	114.8 Å²	114.8	79%	0.792	61%	0.61	S	S	*	*			trans	-72.8	91.1	166.1	-71.1	56.6	0	0	0	106.4	S36 S40	S36-W38 PolarHBondContact O-N 2.91Å; S36-W38 PolarHBondContact OG-NE1 3.39Å; W38-S40 PolarHBondContact O-N 3.19Å
39	F	53.6	Low	66.2	Low	177 Å²	177	111.4 Å²	111.4	78%	0.776	58%	0.584	S	S	*	*			trans	-66.8	79.6	154.3	-81	-87.9	0	0	0	106.4	T37 S41	T37-F39 VanDerWaalsContact C-N 3.27Å; T37-F39 HydrophobicContact CG2-CE2 4.21Å; T37-F39 PolarHBondContact O-N 3.12Å; F39-S41 PolarHBondContact O-N 3.08Å
40	S	59.3	Low	68.3	Low	87 Å²	87	112.7 Å²	112.7	61%	0.608	58%	0.582	S	S	*	*			trans	-77.3	101.6	169.7	-156.6	0	0	0	0	105.5	W38 S42	W38-S40 PolarHBondContact O-N 3.19Å; S40-S42 PolarHBondContact O-N 3.25Å
41	S	69	Low	70.7	Confident	26 Å²	26	111 Å²	111	18%	0.182	56%	0.563	C	S	.	*			trans	-31.9	129.2	165.5	164.8	0	0	0	0	109.9	F39 D45 R46 C237	F39-S41 PolarHBondContact O-N 3.08Å; S41-D45 WeakPolarHBondContact OG-CB 3.34Å; S41-R46 PolarHBondContact O-NE 3.35Å; S41-C237 PolarHBondContact OG-O 3.47Å
42	S	86.8	Confident	72.8	Confident	51 Å²	51	102.5 Å²	102.5	36%	0.357	53%	0.526	S	S	.	.			trans	-59.5	161.4	-171.4	76.1	0	0	0	0	110.2	S40 V44 D45 R46	S40-S42 PolarHBondContact O-N 3.25Å; S42-V44 PolarHBondContact O-N 3.33Å; S42-V44 PolarHBondContact OG-N 3.15Å; S42-D45 VanDerWaalsContact CB-OD2 3.22Å; S42-D45 WeakPolarHBondContact CB-OD2 3.08Å; S42-D45 PolarHBondContact N-OD2 3.4Å; S42-D45 PolarHBondContact O-N 3.2Å; S42-D45 PolarHBondContact OG-N 2.96Å; S42-D45 VanDerWaalsContact OG-N 3.12Å; S42-D45 PolarHBondContact OG-OD1 2.84Å; S42-D45 PolarHBondContact OG-OD2 3.36Å; S42-R46 PolarHBondContact O-N 3.36Å; S42-R46 VanDerWaalsContact O-N 3.08Å
43	Q	90.1	Very high	75.2	Confident	107 Å²	107	97.1 Å²	97.1	50%	0.5	51%	0.506	S	S	.	.	H	α-helix	trans	-56.4	-32.6	173.9	179	175.1	-16	0	0	111.5	Q47	Q43-Q47 WeakPolarHBondContact O-CG 3.42Å; Q43-Q47 PolarHBondContact O-N 3.12Å; Q43-Q47 VanDerWaalsContact O-N 3.15Å
44	V	93	Very high	77.8	Confident	96 Å²	96	93 Å²	93	58%	0.582	49%	0.485	S	S	*	.	H	α-helix	trans	-66.5	-48.6	177.3	-179.9	0	0	0	0	110.3	S42 R46 Q47 L48	S42-V44 PolarHBondContact O-N 3.33Å; S42-V44 PolarHBondContact OG-N 3.15Å; V44-R46 VanDerWaalsContact C-N 3.29Å; V44-R46 PolarHBondContact O-N 2.82Å; V44-Q47 PolarHBondContact O-N 3.43Å; V44-Q47 VanDerWaalsContact O-N 3.12Å; V44-L48 WeakPolarHBondContact O-CB 3.36Å; V44-L48 PolarHBondContact O-N 3.15Å
45	D	94.8	Very high	79.8	Confident	42 Å²	42	88.3 Å²	88.3	23%	0.225	46%	0.455	C	S	.	.	H	α-helix	trans	-60.7	-39.3	-179.9	-58.1	-30.5	0	0	0	111.7	S41 S42 L48 N49 C237	S41-D45 WeakPolarHBondContact OG-CB 3.34Å; S42-D45 VanDerWaalsContact CB-OD2 3.22Å; S42-D45 WeakPolarHBondContact CB-OD2 3.08Å; S42-D45 PolarHBondContact N-OD2 3.4Å; S42-D45 PolarHBondContact O-N 3.2Å; S42-D45 PolarHBondContact OG-N 2.96Å; S42-D45 VanDerWaalsContact OG-N 3.12Å; S42-D45 PolarHBondContact OG-OD1 2.84Å; S42-D45 PolarHBondContact OG-OD2 3.36Å; D45-L48 PolarHBondContact O-N 3.17Å; D45-N49 WeakPolarHBondContact O-CB 3.21Å; D45-N49 PolarHBondContact O-N 3.26Å; D45-C237 HydrophobicContact CB-CB 4.49Å
46	R	92	Very high	82.4	Confident	147 Å²	147	82.7 Å²	82.7	56%	0.555	42%	0.42	S	S	*	.	H	α-helix	trans	-64.8	-41.9	175	-73.9	-175.8	-78	166.2	-3.6	113	S41 S42 V44 Q50	S41-R46 PolarHBondContact O-NE 3.35Å; S42-R46 PolarHBondContact O-N 3.36Å; S42-R46 VanDerWaalsContact O-N 3.08Å; V44-R46 VanDerWaalsContact C-N 3.29Å; V44-R46 PolarHBondContact O-N 2.82Å; R46-Q50 PolarHBondContact O-N 3.21Å; R46-Q50 VanDerWaalsContact O-N 3.15Å
47	Q	93.7	Very high	84.8	Confident	97 Å²	97	86.4 Å²	86.4	45%	0.453	43%	0.426	S	S	.	.	H	α-helix	trans	-66.7	-43.3	176.8	-74.2	178.4	-21.6	0	0	111.1	Q43 V44 Q50 F51	Q43-Q47 WeakPolarHBondContact O-CG 3.42Å; Q43-Q47 PolarHBondContact O-N 3.12Å; Q43-Q47 VanDerWaalsContact O-N 3.15Å; V44-Q47 PolarHBondContact O-N 3.43Å; V44-Q47 VanDerWaalsContact O-N 3.12Å; Q47-Q50 PolarHBondContact O-N 2.93Å; Q47-F51 PolarHBondContact O-N 3.4Å
48	L	95	Very high	87	Confident	49 Å²	49	86.3 Å²	86.3	26%	0.257	42%	0.418	S	S	.	.	H	α-helix	trans	-64.1	-42.2	177.6	-175.3	54.7	0	0	0	111.4	V44 D45 Q50 F51 L52 F233 C237	V44-L48 WeakPolarHBondContact O-CB 3.36Å; V44-L48 PolarHBondContact O-N 3.15Å; D45-L48 PolarHBondContact O-N 3.17Å; L48-Q50 VanDerWaalsContact C-N 3.33Å; L48-Q50 PolarHBondContact O-N 3.03Å; L48-F51 WeakPolarHBondContact O-CB 3.49Å; L48-F51 PolarHBondContact O-N 2.99Å; L48-F51 VanDerWaalsContact O-N 3.16Å; L48-L52 HydrophobicContact CD1-CD1 4.29Å; L48-L52 HydrophobicContact CD1-CG 4.26Å; L48-L52 HydrophobicContact CG-CD1 4Å; L48-L52 HydrophobicContact CG-CG 4.44Å; L48-L52 WeakPolarHBondContact O-CB 3.41Å; L48-L52 VanDerWaalsContact O-CG 3.3Å; L48-L52 WeakPolarHBondContact O-CG 3.3Å; L48-L52 PolarHBondContact O-N 3.31Å; L48-F233 HydrophobicContact CD2-CE2 3.84Å; L48-F233 HydrophobicContact CD2-CZ 3.7Å; L48-C237 VanDerWaalsContact CD2-SG 3.53Å
49	N	94.9	Very high	89.3	Confident	38 Å²	38	77.3 Å²	77.3	20%	0.203	38%	0.384	C	S	.	.	H	α-helix	trans	-59.5	-42.4	174.9	-178.2	-91	0	0	0	112.6	D45 F51 L52 T53 Q234 C237 K238	D45-N49 WeakPolarHBondContact O-CB 3.21Å; D45-N49 PolarHBondContact O-N 3.26Å; N49-F51 VanDerWaalsContact C-N 3.35Å; N49-L52 PolarHBondContact O-N 3.21Å; N49-T53 WeakPolarHBondContact O-CB 3.48Å; N49-T53 PolarHBondContact O-N 2.84Å; N49-T53 PolarHBondContact O-OG1 3.16Å; N49-Q234 VanDerWaalsContact ND2-CG 3.33Å; N49-Q234 WeakPolarHBondContact ND2-CG 3.46Å; N49-Q234 PolarHBondContact ND2-O 2.87Å; N49-C237 HydrophobicContact CB-CB 4.2Å; N49-K238 VanDerWaalsContact ND2-CE 3.3Å; N49-K238 WeakPolarHBondContact ND2-CE 3.46Å; N49-K238 WeakPolarHBondContact ND2-CG 3.1Å
50	Q	94.2	Very high	91.3	Very high	130 Å²	130	74 Å²	74	61%	0.607	37%	0.369	S	S	*	.	H	α-helix	trans	-65.3	-40.2	175.9	-174.7	177.5	4.8	0	0	111.5	R46 Q47 L48 T53 N54	R46-Q50 PolarHBondContact O-N 3.21Å; R46-Q50 VanDerWaalsContact O-N 3.15Å; Q47-Q50 PolarHBondContact O-N 2.93Å; L48-Q50 VanDerWaalsContact C-N 3.33Å; L48-Q50 PolarHBondContact O-N 3.03Å; Q50-T53 PolarHBondContact O-N 3.4Å; Q50-N54 PolarHBondContact O-N 3.39Å; Q50-N54 PolarHBondContact O-ND2 3.4Å
51	F	95.6	Very high	92.9	Very high	110 Å²	110	73.6 Å²	73.6	48%	0.482	37%	0.372	S	S	.	.	H	α-helix	trans	-60.8	-53.8	174.5	179.5	-94.1	0	0	0	111.1	Q47 L48 N49 T53 N54 E55	Q47-F51 PolarHBondContact O-N 3.4Å; L48-F51 WeakPolarHBondContact O-CB 3.49Å; L48-F51 PolarHBondContact O-N 2.99Å; L48-F51 VanDerWaalsContact O-N 3.16Å; N49-F51 VanDerWaalsContact C-N 3.35Å; F51-T53 VanDerWaalsContact C-N 3.26Å; F51-T53 PolarHBondContact O-N 2.95Å; F51-N54 WeakPolarHBondContact O-CB 3.3Å; F51-N54 PolarHBondContact O-N 2.89Å; F51-E55 PolarHBondContact O-N 2.93Å
52	L	97.1	Very high	93.8	Very high	5 Å²	5	76.6 Å²	76.6	3%	0.026	39%	0.386	C	S	.	.	H	α-helix	trans	-57.9	-37.9	178.9	-69	168.8	0	0	0	112	L48 N49 N54 E55 I56 L230 F233 Q234	L48-L52 HydrophobicContact CD1-CD1 4.29Å; L48-L52 HydrophobicContact CD1-CG 4.26Å; L48-L52 HydrophobicContact CG-CD1 4Å; L48-L52 HydrophobicContact CG-CG 4.44Å; L48-L52 WeakPolarHBondContact O-CB 3.41Å; L48-L52 VanDerWaalsContact O-CG 3.3Å; L48-L52 WeakPolarHBondContact O-CG 3.3Å; L48-L52 PolarHBondContact O-N 3.31Å; N49-L52 PolarHBondContact O-N 3.21Å; L52-N54 VanDerWaalsContact C-N 3.3Å; L52-N54 PolarHBondContact O-N 3.48Å; L52-E55 PolarHBondContact O-N 3.48Å; L52-I56 HydrophobicContact CB-CD1 4.48Å; L52-I56 WeakPolarHBondContact O-CB 3.46Å; L52-I56 VanDerWaalsContact O-CD1 3.29Å; L52-I56 WeakPolarHBondContact O-CD1 3.43Å; L52-I56 WeakPolarHBondContact O-CG1 3.42Å; L52-I56 PolarHBondContact O-N 2.75Å; L52-L230 HydrophobicContact CD2-CD2 3.81Å; L52-F233 HydrophobicContact CD1-CB 4.25Å; L52-F233 HydrophobicContact CD1-CD1 4.21Å; L52-F233 HydrophobicContact CD1-CD2 4.4Å; L52-F233 HydrophobicContact CD1-CG 4.01Å; L52-F233 HydrophobicContact CD2-CD1 4.07Å; L52-Q234 HydrophobicContact CB-CB 4.11Å; L52-Q234 HydrophobicContact CB-CG 4.14Å; L52-Q234 HydrophobicContact CD1-CB 4.1Å
53	T	96.2	Very high	93.9	Very high	62 Å²	62	75.7 Å²	75.7	38%	0.38	38%	0.381	S	S	.	.	H	α-helix	trans	-58	-42.8	174.6	-58.9	0	0	0	0	112.4	N49 Q50 F51 K57 Q234	N49-T53 WeakPolarHBondContact O-CB 3.48Å; N49-T53 PolarHBondContact O-N 2.84Å; N49-T53 PolarHBondContact O-OG1 3.16Å; Q50-T53 PolarHBondContact O-N 3.4Å; F51-T53 VanDerWaalsContact C-N 3.26Å; F51-T53 PolarHBondContact O-N 2.95Å; T53-K57 WeakPolarHBondContact O-CB 3.33Å; T53-K57 PolarHBondContact O-N 3.37Å; T53-Q234 PolarHBondContact OG1-NE2 2.82Å
54	N	95.9	Very high	93.7	Very high	80 Å²	80	74.9 Å²	74.9	43%	0.428	38%	0.376	S	S	.	.	H	α-helix	trans	-72.1	-40.5	178.3	-68.1	-33.6	0	0	0	111.2	Q50 F51 L52 K57 Q58	Q50-N54 PolarHBondContact O-N 3.39Å; Q50-N54 PolarHBondContact O-ND2 3.4Å; F51-N54 WeakPolarHBondContact O-CB 3.3Å; F51-N54 PolarHBondContact O-N 2.89Å; L52-N54 VanDerWaalsContact C-N 3.3Å; L52-N54 PolarHBondContact O-N 3.48Å; N54-K57 PolarHBondContact O-N 3.11Å; N54-Q58 WeakPolarHBondContact O-CG 3.49Å; N54-Q58 PolarHBondContact O-N 2.99Å
55	E	94.6	Very high	93.6	Very high	18 Å²	18	77.6 Å²	77.6	8%	0.084	38%	0.381	C	S	.	.	H	α-helix	trans	-61	-54.4	178.8	-163.1	69.7	178.8	0	0	111	F51 L52 K57 Q58 E59 L230	F51-E55 PolarHBondContact O-N 2.93Å; L52-E55 PolarHBondContact O-N 3.48Å; E55-K57 PolarHBondContact O-N 3.09Å; E55-K57 VanDerWaalsContact O-N 3.14Å; E55-Q58 PolarHBondContact O-N 3.29Å; E55-E59 HydrophobicContact CG-CG 4.44Å; E55-E59 WeakPolarHBondContact O-CG 3.32Å; E55-E59 PolarHBondContact O-N 3.44Å; E55-L230 HydrophobicContact CB-CD1 4.41Å; E55-L230 HydrophobicContact CG-CD1 3.82Å; E55-L230 HydrophobicContact CG-CD2 4.26Å
56	I	96.6	Very high	93.6	Very high	11 Å²	11	77.2 Å²	77.2	6%	0.056	38%	0.381	C	S	.	.	H	α-helix	trans	-54.1	-40.1	177.3	-68.1	158.9	0	0	0	111.2	L52 K60 L230 D231 Q234	L52-I56 HydrophobicContact CB-CD1 4.48Å; L52-I56 WeakPolarHBondContact O-CB 3.46Å; L52-I56 VanDerWaalsContact O-CD1 3.29Å; L52-I56 WeakPolarHBondContact O-CD1 3.43Å; L52-I56 WeakPolarHBondContact O-CG1 3.42Å; L52-I56 PolarHBondContact O-N 2.75Å; I56-K60 HydrophobicContact CG2-CD 3.75Å; I56-K60 HydrophobicContact CG2-CG 4.4Å; I56-K60 VanDerWaalsContact CG2-NZ 3.28Å; I56-K60 VanDerWaalsContact O-CB 3.29Å; I56-K60 WeakPolarHBondContact O-CB 3.47Å; I56-K60 VanDerWaalsContact O-CG 3.24Å; I56-K60 WeakPolarHBondContact O-CG 3.17Å; I56-K60 PolarHBondContact O-N 3.26Å; I56-L230 HydrophobicContact CD1-CB 4.15Å; I56-L230 HydrophobicContact CG1-CB 3.55Å; I56-L230 HydrophobicContact CG1-CD1 4.17Å; I56-D231 WeakPolarHBondContact CD1-OD1 3.37Å; I56-Q234 HydrophobicContact CD1-CB 4.06Å; I56-Q234 HydrophobicContact CD1-CG 4.41Å
57	K	96.3	Very high	93.9	Very high	158 Å²	158	76.7 Å²	76.7	69%	0.687	39%	0.389	S	S	*	.	H	α-helix	trans	-66.2	-40.6	178	179.7	-179	176.3	-176.3	0	112	T53 N54 E55 A61	T53-K57 WeakPolarHBondContact O-CB 3.33Å; T53-K57 PolarHBondContact O-N 3.37Å; N54-K57 PolarHBondContact O-N 3.11Å; E55-K57 PolarHBondContact O-N 3.09Å; E55-K57 VanDerWaalsContact O-N 3.14Å; K57-A61 PolarHBondContact O-N 3.38Å
58	Q	94.2	Very high	94	Very high	113 Å²	113	73.7 Å²	73.7	53%	0.528	38%	0.378	S	S	.	.	H	α-helix	trans	-69.3	-46.5	178.3	-71.2	178.6	22.1	0	0	110.7	N54 E55 K60 A61 N62	N54-Q58 WeakPolarHBondContact O-CG 3.49Å; N54-Q58 PolarHBondContact O-N 2.99Å; E55-Q58 PolarHBondContact O-N 3.29Å; Q58-K60 PolarHBondContact O-N 3.25Å; Q58-A61 WeakPolarHBondContact O-CB 3.29Å; Q58-A61 PolarHBondContact O-N 3.48Å; Q58-N62 PolarHBondContact O-N 2.86Å; Q58-N62 VanDerWaalsContact O-N 3.13Å; Q58-N62 PolarHBondContact O-ND2 3.44Å
59	E	93.3	Very high	94.2	Very high	19 Å²	19	71.5 Å²	71.5	9%	0.089	37%	0.366	C	S	.	.	H	α-helix	trans	-62.4	-41.9	178.9	-68.6	-54.3	139	0	0	112.4	E55 A61 N62 A63 H223 Y226 L227 L230	E55-E59 HydrophobicContact CG-CG 4.44Å; E55-E59 WeakPolarHBondContact O-CG 3.32Å; E55-E59 PolarHBondContact O-N 3.44Å; E59-A61 PolarHBondContact O-N 3.26Å; E59-N62 CarbonylContact O-C 3.41Å; E59-N62 PolarHBondContact O-N 2.94Å; E59-N62 VanDerWaalsContact O-N 3.08Å; E59-A63 PolarHBondContact O-N 3.32Å; E59-A63 VanDerWaalsContact O-N 3.08Å; E59-H223 IonicContact OE2-CD2 3.41Å; E59-H223 IonicContact OE2-CE1 2.71Å; E59-H223 IonicContact OE2-NE2 3.05Å; E59-H223 PolarHBondContact OE2-NE2 2.82Å; E59-Y226 HydrophobicContact CG-CD1 4.27Å; E59-Y226 HydrophobicContact CG-CE1 3.77Å; E59-L227 HydrophobicContact CB-CD2 3.44Å; E59-L227 VanDerWaalsContact CB-CD2 3.44Å; E59-L227 HydrophobicContact CB-CG 4.3Å; E59-L230 HydrophobicContact CG-CD1 4Å
60	K	94.6	Very high	94.2	Very high	107 Å²	107	77 Å²	77	47%	0.465	39%	0.391	S	S	.	.	H	α-helix	trans	-63	-30.7	174.3	-75.5	174.4	178	160.4	0	112.7	I56 Q58 N62 A63 L227 D231	I56-K60 HydrophobicContact CG2-CD 3.75Å; I56-K60 HydrophobicContact CG2-CG 4.4Å; I56-K60 VanDerWaalsContact CG2-NZ 3.28Å; I56-K60 VanDerWaalsContact O-CB 3.29Å; I56-K60 WeakPolarHBondContact O-CB 3.47Å; I56-K60 VanDerWaalsContact O-CG 3.24Å; I56-K60 WeakPolarHBondContact O-CG 3.17Å; I56-K60 PolarHBondContact O-N 3.26Å; Q58-K60 PolarHBondContact O-N 3.25Å; K60-N62 VanDerWaalsContact C-N 3.31Å; K60-A63 WeakPolarHBondContact O-CB 3.3Å; K60-L227 HydrophobicContact CG-CD1 4.28Å; K60-L227 HydrophobicContact CG-CD2 3.76Å; K60-D231 IonicContact NZ-OD1 2.7Å; K60-D231 PolarHBondContact NZ-OD1 2.97Å; K60-D231 IonicContact NZ-OD2 3.52Å; K60-D231 PolarHBondContact NZ-OD2 3.43Å
61	A	93.4	Very high	94.3	Very high	80 Å²	80	73.1 Å²	73.1	66%	0.661	39%	0.386	S	S	*	.	H	α-helix	trans	-75.2	-24	176.3	0	0	0	0	0	112.7	K57 Q58 E59	K57-A61 PolarHBondContact O-N 3.38Å; Q58-A61 WeakPolarHBondContact O-CB 3.29Å; Q58-A61 PolarHBondContact O-N 3.48Å; E59-A61 PolarHBondContact O-N 3.26Å
62	N	88	Confident	94.5	Very high	89 Å²	89	68.6 Å²	68.6	48%	0.476	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	13.5	178.4	-61.5	-29.1	0	0	0	112.5	Q58 E59 K60 F64	Q58-N62 PolarHBondContact O-N 2.86Å; Q58-N62 VanDerWaalsContact O-N 3.13Å; Q58-N62 PolarHBondContact O-ND2 3.44Å; E59-N62 CarbonylContact O-C 3.41Å; E59-N62 PolarHBondContact O-N 2.94Å; E59-N62 VanDerWaalsContact O-N 3.08Å; K60-N62 VanDerWaalsContact C-N 3.31Å; N62-F64 PolarHBondContact O-N 2.85Å
63	A	88	Confident	94.5	Very high	32 Å²	32	75.8 Å²	75.8	26%	0.264	40%	0.397	S	S	.	.			trans	-55.7	124.3	-174.7	0	0	0	0	0	111.8	E59 K60 F65	E59-A63 PolarHBondContact O-N 3.32Å; E59-A63 VanDerWaalsContact O-N 3.08Å; K60-A63 WeakPolarHBondContact O-CB 3.3Å; A63-F65 HydrophobicContact CB-CD2 4.37Å; A63-F65 HydrophobicContact CB-CE2 3.54Å; A63-F65 HydrophobicContact CB-CZ 3.81Å
64	F	85.9	Confident	94.6	Very high	89 Å²	89	75.8 Å²	75.8	39%	0.39	40%	0.397	S	S	.	.			trans	-101.7	124	176.3	179.5	-114.8	0	0	0	110.1	N62 C66 N216 T219 S220 H223	N62-F64 PolarHBondContact O-N 2.85Å; F64-C66 HydrophobicContact CE1-CB 4.06Å; F64-C66 HydrophobicContact CZ-CB 4.24Å; F64-N216 HydrophobicContact CE1-CB 4.44Å; F64-N216 WeakPolarHBondContact CE1-O 3.39Å; F64-N216 HydrophobicContact CZ-CB 4.38Å; F64-T219 HydrophobicContact CD1-CG2 4.32Å; F64-S220 WeakPolarHBondContact O-CB 3.4Å; F64-S220 PolarHBondContact O-OG 3.38Å; F64-H223 PolarHBondContact N-ND1 2.5Å
65	F	91.7	Very high	94.7	Very high	154 Å²	154	75.5 Å²	75.5	68%	0.675	40%	0.398	S	S	*	.			trans	-117.2	120.1	-179.2	-63.9	-76.6	0	0	0	110.4	A63 S220	A63-F65 HydrophobicContact CB-CD2 4.37Å; A63-F65 HydrophobicContact CB-CE2 3.54Å; A63-F65 HydrophobicContact CB-CZ 3.81Å; F65-S220 VanDerWaalsContact CA-OG 3.29Å; F65-S220 WeakPolarHBondContact CA-OG 3.44Å
66	C	95.4	Very high	94.8	Very high	33 Å²	33	79.5 Å²	79.5	22%	0.223	42%	0.415	C	S	.	.			trans	-128.1	144.1	173	-167.3	0	0	0	0	110	F64 N216 S220	F64-C66 HydrophobicContact CE1-CB 4.06Å; F64-C66 HydrophobicContact CZ-CB 4.24Å; C66-N216 HydrophobicContact CB-CB 4.27Å; C66-N216 WeakPolarHBondContact CB-O 3.43Å; C66-N216 VanDerWaalsContact SG-CB 3.53Å; C66-S220 PolarHBondContact N-OG 3.49Å
67	N	96.5	Very high	94.8	Very high	136 Å²	136	83.1 Å²	83.1	73%	0.727	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-86.5	160.1	174.6	-68.4	-47.4	0	0	0	109.7
68	P	97.5	Very high	94.8	Very high	35 Å²	35	80.3 Å²	80.3	23%	0.227	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-55.7	156.3	169	-21.3	31	0	0	0	112	F72 V74 I84 F217	P68-F72 HydrophobicContact CB-CB 4.42Å; P68-V74 HydrophobicContact CG-CG2 3.57Å; P68-I84 HydrophobicContact CB-CG2 4.36Å; P68-F217 HydrophobicContact CB-CD2 4.38Å; P68-F217 HydrophobicContact CB-CE2 4.32Å; P68-F217 HydrophobicContact CG-CD2 4.11Å; P68-F217 HydrophobicContact CG-CE2 3.68Å; P68-F217 HydrophobicContact CG-CZ 4.03Å
69	P	97.6	Very high	94.9	Very high	2 Å²	2	76.8 Å²	76.8	1%	0.013	42%	0.424	C	S	.	.	S	Bend	trans	-52.5	156.5	176.6	-27.8	34.6	0	0	0	114.6	G71 F72 I84 F210 E213 L214	P69-G71 PolarHBondContact O-N 2.93Å; P69-F72 HydrophobicContact CB-CD2 3.97Å; P69-F72 WeakPolarHBondContact O-CB 3.41Å; P69-F72 PolarHBondContact O-N 3.33Å; P69-I84 HydrophobicContact CG-CD1 4.25Å; P69-F210 HydrophobicContact CB-CD2 3.63Å; P69-F210 HydrophobicContact CB-CE2 3.89Å; P69-F210 HydrophobicContact CG-CD2 3.94Å; P69-F210 HydrophobicContact CG-CE2 3.81Å; P69-E213 WeakPolarHBondContact CA-OE2 3.45Å; P69-E213 HydrophobicContact CB-CB 3.91Å; P69-E213 WeakPolarHBondContact CB-OE2 3.46Å; P69-E213 HydrophobicContact CG-CB 3.95Å; P69-L214 HydrophobicContact CG-CB 3.97Å; P69-L214 HydrophobicContact CG-CD1 4.29Å
70	E	96.3	Very high	95	Very high	155 Å²	155	78.2 Å²	78.2	72%	0.724	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	122.5	-171.3	-167.2	-175.5	168.3	0	0	113.1	F72 K86 E213	E70-F72 VanDerWaalsContact C-N 3.26Å; E70-F72 PolarHBondContact O-N 3.32Å; E70-K86 PolarHBondContact O-NZ 3.14Å; E70-E213 PolarHBondContact N-OE2 2.99Å
71	G	96.6	Very high	95.2	Very high	48 Å²	48	76.3 Å²	76.3	50%	0.495	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	83	-6.6	-179.8	0	0	0	0	0	114.6	P69	P69-G71 PolarHBondContact O-N 2.93Å
72	F	98.3	Very high	95.4	Very high	14 Å²	14	72.7 Å²	72.7	6%	0.061	40%	0.4	C	S	.	.			trans	-83.4	147.9	170.1	-73.6	-97.2	0	0	0	111.2	P68 P69 E70 I84 R85 K86 V94 V96 L206 F210	P68-F72 HydrophobicContact CB-CB 4.42Å; P69-F72 HydrophobicContact CB-CD2 3.97Å; P69-F72 WeakPolarHBondContact O-CB 3.41Å; P69-F72 PolarHBondContact O-N 3.33Å; E70-F72 VanDerWaalsContact C-N 3.26Å; E70-F72 PolarHBondContact O-N 3.32Å; F72-I84 HydrophobicContact CB-CB 4.24Å; F72-I84 HydrophobicContact CB-CD1 4.08Å; F72-I84 HydrophobicContact CB-CG1 4.43Å; F72-I84 HydrophobicContact CD1-CB 4.28Å; F72-I84 HydrophobicContact CD1-CD1 3.9Å; F72-I84 HydrophobicContact CD1-CG1 3.87Å; F72-I84 HydrophobicContact CG-CD1 4.06Å; F72-I84 HydrophobicContact CG-CG1 4.43Å; F72-R85 CarbonylContact C-O 3.57Å; F72-R85 WeakPolarHBondContact CA-O 3.38Å; F72-K86 HydrophobicContact CD1-CB 3.67Å; F72-K86 HydrophobicContact CD2-CB 4.04Å; F72-K86 HydrophobicContact CD2-CD 3.75Å; F72-K86 HydrophobicContact CE1-CB 3.6Å; F72-K86 HydrophobicContact CE2-CB 3.99Å; F72-K86 HydrophobicContact CE2-CD 3.56Å; F72-K86 HydrophobicContact CE2-CG 4.46Å; F72-K86 HydrophobicContact CG-CB 3.89Å; F72-K86 HydrophobicContact CG-CD 4.4Å; F72-K86 HydrophobicContact CZ-CB 3.76Å; F72-K86 HydrophobicContact CZ-CD 4.05Å; F72-V94 HydrophobicContact CE1-CB 4.27Å; F72-V94 HydrophobicContact CE1-CG1 4Å; F72-V94 HydrophobicContact CZ-CB 4.48Å; F72-V94 HydrophobicContact CZ-CG1 4.13Å; F72-V96 HydrophobicContact CE1-CG2 3.93Å; F72-L206 HydrophobicContact CZ-CD2 3.96Å; F72-F210 HydrophobicContact CD2-CD2 4.19Å; F72-F210 AromaticContact CD2-CE2 3.98Å; F72-F210 HydrophobicContact CD2-CE2 3.98Å; F72-F210 HydrophobicContact CE1-CE2 4.29Å; F72-F210 AromaticContact CE2-CD2 3.63Å; F72-F210 HydrophobicContact CE2-CD2 3.63Å; F72-F210 AromaticContact CE2-CE2 3.49Å; F72-F210 HydrophobicContact CE2-CE2 3.49Å; F72-F210 VanDerWaalsContact CE2-CE2 3.49Å; F72-F210 HydrophobicContact CZ-CD2 4.18Å; F72-F210 AromaticContact CZ-CE2 3.67Å; F72-F210 HydrophobicContact CZ-CE2 3.67Å; F72-F210 HydrophobicContact CZ-CZ 4.43Å
73	K	98.1	Very high	95.9	Very high	156 Å²	156	69.3 Å²	69.3	68%	0.678	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.4	139.6	174.6	-62.3	178.2	-175.4	173.1	0	109.5	V75 I84 R85	K73-V75 PolarHBondContact O-N 2.99Å; K73-I84 CarbonylContact O-C 3.59Å; K73-I84 VanDerWaalsContact O-CA 3.26Å; K73-I84 WeakPolarHBondContact O-CA 3.19Å; K73-R85 PolarHBondContact N-O 3.03Å; K73-R85 PolarHBondContact O-N 2.95Å
74	V	98.2	Very high	96.4	Very high	63 Å²	63	67.8 Å²	67.8	38%	0.382	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	119.8	169.8	-172	0	0	0	0	108.9	P68 T77 I82 I84 F217	P68-V74 HydrophobicContact CG-CG2 3.57Å; V74-T77 WeakPolarHBondContact CG1-OG1 3.37Å; V74-I82 HydrophobicContact CG1-CG2 4.23Å; V74-I84 HydrophobicContact CG2-CG2 4.1Å; V74-F217 HydrophobicContact CG2-CE2 4.48Å; V74-F217 HydrophobicContact CG2-CZ 4Å
75	V	98	Very high	97	Very high	74 Å²	74	67.7 Å²	67.7	45%	0.448	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	-19.8	178.3	-65.8	0	0	0	0	112.8	K73 V83 R85	K73-V75 PolarHBondContact O-N 2.99Å; V75-V83 HydrophobicContact CG2-CB 3.87Å; V75-V83 HydrophobicContact CG2-CG1 3.68Å; V75-V83 WeakPolarHBondContact CG2-O 3.29Å; V75-V83 PolarHBondContact N-O 3.16Å; V75-R85 HydrophobicContact CG1-CB 3.7Å; V75-R85 HydrophobicContact CG2-CB 4.05Å
76	K	97.4	Very high	97.4	Very high	101 Å²	101	62.9 Å²	62.9	44%	0.439	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	139	175.3	-172.9	-173.2	174	-161.3	0	110.1	I82 V83	K76-I82 WeakPolarHBondContact O-CA 3.24Å; K76-V83 HydrophobicContact CB-CB 3.98Å; K76-V83 HydrophobicContact CB-CG2 4.01Å; K76-V83 HydrophobicContact CD-CG2 4.24Å; K76-V83 PolarHBondContact N-O 3.36Å; K76-V83 PolarHBondContact O-N 2.91Å
77	T	96.6	Very high	97.5	Very high	88 Å²	88	68.4 Å²	68.4	54%	0.54	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	117.5	167.2	-53.9	0	0	0	0	107.4	V74 D81 I82	V74-T77 WeakPolarHBondContact CG1-OG1 3.37Å; T77-D81 WeakPolarHBondContact CA-O 3.49Å; T77-I82 HydrophobicContact CG2-CG1 4.39Å
78	D	95.8	Very high	97.5	Very high	99 Å²	99	64.2 Å²	64.2	53%	0.529	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	103.9	-179.5	-173.1	12.8	0	0	0	110.1	C80 D81	D78-C80 PolarHBondContact O-N 2.98Å; D78-C80 VanDerWaalsContact O-N 3.13Å; D78-D81 PolarHBondContact N-O 3.33Å; D78-D81 WeakPolarHBondContact O-CB 3.41Å; D78-D81 PolarHBondContact O-N 3.31Å
79	G	95	Very high	97.5	Very high	39 Å²	39	72.5 Å²	72.5	40%	0.402	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	-119.5	-173.7	0	0	0	0	0	111.4	L225	G79-L225 WeakPolarHBondContact O-CD2 3.18Å
80	C	96.7	Very high	97.4	Very high	48 Å²	48	76.5 Å²	76.5	32%	0.324	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-7.4	178.2	-55.9	0	0	0	0	113.3	D78 N99 L100 A101 L225	D78-C80 PolarHBondContact O-N 2.98Å; D78-C80 VanDerWaalsContact O-N 3.13Å; C80-N99 WeakPolarHBondContact O-CA 3.45Å; C80-L100 PolarHBondContact O-N 3.19Å; C80-A101 HydrophobicContact CB-CB 4.11Å; C80-L225 HydrophobicContact CB-CD1 4.41Å
81	D	97.9	Very high	97.5	Very high	67 Å²	67	71.2 Å²	71.2	36%	0.358	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	125.8	-177.2	-61.7	-52.5	0	0	0	111.1	T77 D78 I98 N99	T77-D81 WeakPolarHBondContact CA-O 3.49Å; D78-D81 PolarHBondContact N-O 3.33Å; D78-D81 WeakPolarHBondContact O-CB 3.41Å; D78-D81 PolarHBondContact O-N 3.31Å; D81-I98 CarbonylContact C-O 3.59Å; D81-I98 WeakPolarHBondContact CA-O 3.48Å; D81-N99 PolarHBondContact OD1-ND2 3.34Å
82	I	98.4	Very high	97.5	Very high	4 Å²	4	69.3 Å²	69.3	2%	0.021	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	140.1	176.8	-57.1	-178.8	0	0	0	108.9	V74 K76 T77 I84 E97 I98 L100 F217 E221	V74-I82 HydrophobicContact CG1-CG2 4.23Å; K76-I82 WeakPolarHBondContact O-CA 3.24Å; T77-I82 HydrophobicContact CG2-CG1 4.39Å; I82-I84 HydrophobicContact CG2-CG2 4.22Å; I82-E97 WeakPolarHBondContact O-CA 3.49Å; I82-I98 HydrophobicContact CB-CB 4.39Å; I82-I98 PolarHBondContact N-O 3.3Å; I82-I98 PolarHBondContact O-N 2.98Å; I82-L100 HydrophobicContact CD1-CD1 3.64Å; I82-L100 HydrophobicContact CG1-CD1 4.47Å; I82-F217 HydrophobicContact CG2-CE1 4.19Å; I82-F217 HydrophobicContact CG2-CZ 4.32Å; I82-E221 HydrophobicContact CD1-CB 3.66Å; I82-E221 HydrophobicContact CD1-CG 3.64Å
83	V	98.6	Very high	97.5	Very high	19 Å²	19	69.7 Å²	69.7	12%	0.115	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	122.5	169.3	-172.3	0	0	0	0	109.2	V75 K76 D95 V96 E97	V75-V83 HydrophobicContact CG2-CB 3.87Å; V75-V83 HydrophobicContact CG2-CG1 3.68Å; V75-V83 WeakPolarHBondContact CG2-O 3.29Å; V75-V83 PolarHBondContact N-O 3.16Å; K76-V83 HydrophobicContact CB-CB 3.98Å; K76-V83 HydrophobicContact CB-CG2 4.01Å; K76-V83 HydrophobicContact CD-CG2 4.24Å; K76-V83 PolarHBondContact N-O 3.36Å; K76-V83 PolarHBondContact O-N 2.91Å; V83-D95 HydrophobicContact CG1-CB 4.16Å; V83-V96 WeakPolarHBondContact CA-O 3.44Å; V83-E97 HydrophobicContact CG1-CG 4.22Å; V83-E97 HydrophobicContact CG2-CB 4.45Å; V83-E97 HydrophobicContact CG2-CG 4Å
84	I	98.7	Very high	97.5	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	143.2	169.7	64.3	172.2	0	0	0	109.9	P68 P69 F72 K73 V74 I82 D95 V96 L214 F217	P68-I84 HydrophobicContact CB-CG2 4.36Å; P69-I84 HydrophobicContact CG-CD1 4.25Å; F72-I84 HydrophobicContact CB-CB 4.24Å; F72-I84 HydrophobicContact CB-CD1 4.08Å; F72-I84 HydrophobicContact CB-CG1 4.43Å; F72-I84 HydrophobicContact CD1-CB 4.28Å; F72-I84 HydrophobicContact CD1-CD1 3.9Å; F72-I84 HydrophobicContact CD1-CG1 3.87Å; F72-I84 HydrophobicContact CG-CD1 4.06Å; F72-I84 HydrophobicContact CG-CG1 4.43Å; K73-I84 CarbonylContact O-C 3.59Å; K73-I84 VanDerWaalsContact O-CA 3.26Å; K73-I84 WeakPolarHBondContact O-CA 3.19Å; V74-I84 HydrophobicContact CG2-CG2 4.1Å; I82-I84 HydrophobicContact CG2-CG2 4.22Å; I84-D95 CarbonylContact O-C 3.59Å; I84-D95 WeakPolarHBondContact O-CA 3.35Å; I84-V96 HydrophobicContact CD1-CB 4.18Å; I84-V96 HydrophobicContact CG1-CB 3.68Å; I84-V96 HydrophobicContact CG1-CG1 4.49Å; I84-V96 HydrophobicContact CG1-CG2 4.27Å; I84-V96 PolarHBondContact N-O 2.92Å; I84-V96 PolarHBondContact O-N 3.05Å; I84-L214 HydrophobicContact CD1-CD1 3.87Å; I84-F217 HydrophobicContact CG2-CE1 3.87Å; I84-F217 HydrophobicContact CG2-CZ 4.23Å
85	R	98.7	Very high	97.6	Very high	87 Å²	87	60 Å²	60	33%	0.328	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	140.6	-176.2	175.7	175.1	-67.3	164.7	2.9	112.3	F72 K73 V75 E87 V94 D95	F72-R85 CarbonylContact C-O 3.57Å; F72-R85 WeakPolarHBondContact CA-O 3.38Å; K73-R85 PolarHBondContact N-O 3.03Å; K73-R85 PolarHBondContact O-N 2.95Å; V75-R85 HydrophobicContact CG1-CB 3.7Å; V75-R85 HydrophobicContact CG2-CB 4.05Å; R85-E87 HydrophobicContact CG-CG 4.32Å; R85-V94 CarbonylContact C-O 3.5Å; R85-V94 VanDerWaalsContact CA-O 3.26Å; R85-V94 WeakPolarHBondContact CA-O 3.48Å; R85-D95 WeakPolarHBondContact CD-OD1 3.33Å; R85-D95 VanDerWaalsContact CG-OD1 3.25Å; R85-D95 WeakPolarHBondContact CG-OD1 3.22Å; R85-D95 IonicContact CZ-OD1 2.74Å; R85-D95 IonicContact CZ-OD2 2.79Å; R85-D95 IonicContact NE-OD1 2.84Å; R85-D95 PolarHBondContact NE-OD1 3.41Å; R85-D95 IonicContact NE-OD2 3.05Å; R85-D95 IonicContact NH2-OD1 3.99Å; R85-D95 PolarHBondContact NH2-OD1 2.86Å; R85-D95 IonicContact NH2-OD2 3.27Å; R85-D95 PolarHBondContact NH2-OD2 2.96Å
86	K	98.4	Very high	97.6	Very high	52 Å²	52	56.4 Å²	56.4	23%	0.226	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	135.5	165.8	-174.6	164.8	173.9	174.1	0	110.3	E70 F72 Y88 S93 V94	E70-K86 PolarHBondContact O-NZ 3.14Å; F72-K86 HydrophobicContact CD1-CB 3.67Å; F72-K86 HydrophobicContact CD2-CB 4.04Å; F72-K86 HydrophobicContact CD2-CD 3.75Å; F72-K86 HydrophobicContact CE1-CB 3.6Å; F72-K86 HydrophobicContact CE2-CB 3.99Å; F72-K86 HydrophobicContact CE2-CD 3.56Å; F72-K86 HydrophobicContact CE2-CG 4.46Å; F72-K86 HydrophobicContact CG-CB 3.89Å; F72-K86 HydrophobicContact CG-CD 4.4Å; F72-K86 HydrophobicContact CZ-CB 3.76Å; F72-K86 HydrophobicContact CZ-CD 4.05Å; K86-Y88 HydrophobicContact CB-CE2 4.1Å; K86-Y88 HydrophobicContact CD-CE2 4.25Å; K86-Y88 VanDerWaalsContact CD-OH 3.27Å; K86-Y88 WeakPolarHBondContact CD-OH 3.39Å; K86-Y88 WeakPolarHBondContact CE-OH 3.41Å; K86-Y88 HydrophobicContact CG-CE2 3.75Å; K86-S93 WeakPolarHBondContact O-CA 3.44Å; K86-V94 PolarHBondContact N-O 2.98Å; K86-V94 PolarHBondContact O-N 3.03Å
87	E	97.7	Very high	97.6	Very high	149 Å²	149	54.6 Å²	54.6	70%	0.696	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.2	136.5	178.1	-67.2	179.2	179.3	0	0	109.8	R85	R85-E87 HydrophobicContact CG-CG 4.32Å
88	Y	97.3	Very high	97.7	Very high	48 Å²	48	50.6 Å²	50.6	19%	0.188	27%	0.27	C	S	.	.			trans	-106.1	156.9	-175.5	-66.5	-104.1	0	0	0	110.6	K86 D90 G91 V92 V94 R204	K86-Y88 HydrophobicContact CB-CE2 4.1Å; K86-Y88 HydrophobicContact CD-CE2 4.25Å; K86-Y88 VanDerWaalsContact CD-OH 3.27Å; K86-Y88 WeakPolarHBondContact CD-OH 3.39Å; K86-Y88 WeakPolarHBondContact CE-OH 3.41Å; K86-Y88 HydrophobicContact CG-CE2 3.75Å; Y88-D90 WeakPolarHBondContact CB-OD1 3.38Å; Y88-D90 PolarHBondContact O-N 3.33Å; Y88-G91 WeakPolarHBondContact O-CA 3.45Å; Y88-G91 PolarHBondContact O-N 2.81Å; Y88-V92 WeakPolarHBondContact CB-O 3.45Å; Y88-V92 WeakPolarHBondContact CD2-O 3.34Å; Y88-V92 PolarHBondContact N-O 3.39Å; Y88-V94 HydrophobicContact CD2-CG2 4.01Å; Y88-V94 HydrophobicContact CE2-CB 4.14Å; Y88-V94 HydrophobicContact CE2-CG2 3.32Å; Y88-R204 VanDerWaalsContact CZ-O 3.27Å; Y88-R204 PolarHBondContact OH-O 3.12Å
89	Q	96.3	Very high	97.8	Very high	210 Å²	210	49.1 Å²	49.1	98%	0.981	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-25.8	-177.2	-65.2	-179.6	-6.7	0	0	113.4	G91	Q89-G91 PolarHBondContact O-N 3.21Å
90	D	96.9	Very high	97.8	Very high	85 Å²	85	47.5 Å²	47.5	46%	0.455	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	2.5	174.1	68.8	-14	0	0	0	113.1	Y88 V92 P138 R204	Y88-D90 WeakPolarHBondContact CB-OD1 3.38Å; Y88-D90 PolarHBondContact O-N 3.33Å; D90-V92 VanDerWaalsContact C-N 3.3Å; D90-V92 WeakPolarHBondContact OD1-CB 3.41Å; D90-V92 PolarHBondContact OD1-N 3.5Å; D90-P138 VanDerWaalsContact O-CG 3.22Å; D90-P138 WeakPolarHBondContact O-CG 3.41Å; D90-R204 VanDerWaalsContact CG-NH1 3.33Å; D90-R204 IonicContact OD1-NH1 3.83Å; D90-R204 PolarHBondContact OD1-NH1 3.44Å; D90-R204 IonicContact OD2-CZ 3.93Å; D90-R204 VanDerWaalsContact OD2-CZ 3.27Å; D90-R204 IonicContact OD2-NH1 3.09Å; D90-R204 PolarHBondContact OD2-NH1 3.49Å; D90-R204 IonicContact OD2-NH2 2.61Å; D90-R204 PolarHBondContact OD2-NH2 2.99Å
91	G	97.3	Very high	97.7	Very high	44 Å²	44	48.2 Å²	48.2	45%	0.454	25%	0.254	S	S	.	.	S	Bend	trans	79.2	8.2	179	0	0	0	0	0	114.3	Y88 Q89	Y88-G91 WeakPolarHBondContact O-CA 3.45Å; Y88-G91 PolarHBondContact O-N 2.81Å; Q89-G91 PolarHBondContact O-N 3.21Å
92	V	97.8	Very high	97.4	Very high	9 Å²	9	49 Å²	49	6%	0.055	28%	0.277	C	S	.	.			trans	-75	140.3	168.2	175.8	0	0	0	0	109.1	Y88 D90 T136 K137	Y88-V92 WeakPolarHBondContact CB-O 3.45Å; Y88-V92 WeakPolarHBondContact CD2-O 3.34Å; Y88-V92 PolarHBondContact N-O 3.39Å; D90-V92 VanDerWaalsContact C-N 3.3Å; D90-V92 WeakPolarHBondContact OD1-CB 3.41Å; D90-V92 PolarHBondContact OD1-N 3.5Å; V92-T136 CarbonylContact C-O 3.58Å; V92-T136 VanDerWaalsContact CA-O 3.25Å; V92-T136 WeakPolarHBondContact CA-O 3.47Å; V92-T136 WeakPolarHBondContact CG1-O 3.48Å; V92-K137 HydrophobicContact CG2-CG 4.45Å
93	S	98.2	Very high	97.2	Very high	22 Å²	22	49.1 Å²	49.1	15%	0.154	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	147.1	169.7	72.3	0	0	0	0	111	K86 T136	K86-S93 WeakPolarHBondContact O-CA 3.44Å; S93-T136 PolarHBondContact N-O 3.13Å; S93-T136 PolarHBondContact O-N 2.59Å
94	V	98.6	Very high	96.8	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	116.4	176.4	-176.4	0	0	0	0	107.4	F72 R85 K86 Y88 V96 I133 K134 L135 R204 L206	F72-V94 HydrophobicContact CE1-CB 4.27Å; F72-V94 HydrophobicContact CE1-CG1 4Å; F72-V94 HydrophobicContact CZ-CB 4.48Å; F72-V94 HydrophobicContact CZ-CG1 4.13Å; R85-V94 CarbonylContact C-O 3.5Å; R85-V94 VanDerWaalsContact CA-O 3.26Å; R85-V94 WeakPolarHBondContact CA-O 3.48Å; K86-V94 PolarHBondContact N-O 2.98Å; K86-V94 PolarHBondContact O-N 3.03Å; Y88-V94 HydrophobicContact CD2-CG2 4.01Å; Y88-V94 HydrophobicContact CE2-CB 4.14Å; Y88-V94 HydrophobicContact CE2-CG2 3.32Å; V94-V96 HydrophobicContact CG1-CG2 4.3Å; V94-I133 HydrophobicContact CG1-CG2 4.11Å; V94-K134 WeakPolarHBondContact CA-O 3.35Å; V94-L135 HydrophobicContact CB-CD2 4.16Å; V94-L135 HydrophobicContact CG1-CD2 3.94Å; V94-L135 HydrophobicContact CG2-CD2 3.5Å; V94-L135 VanDerWaalsContact CG2-CD2 3.5Å; V94-R204 HydrophobicContact CG2-CB 4.27Å; V94-L206 HydrophobicContact CG1-CD1 4.25Å; V94-L206 HydrophobicContact CG1-CD2 4.2Å
95	D	98.6	Very high	95.8	Very high	14 Å²	14	54.5 Å²	54.5	8%	0.075	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	131.4	170.8	-66.1	-4.8	0	0	0	108.4	V83 I84 R85 I133 K134	V83-D95 HydrophobicContact CG1-CB 4.16Å; I84-D95 CarbonylContact O-C 3.59Å; I84-D95 WeakPolarHBondContact O-CA 3.35Å; R85-D95 WeakPolarHBondContact CD-OD1 3.33Å; R85-D95 VanDerWaalsContact CG-OD1 3.25Å; R85-D95 WeakPolarHBondContact CG-OD1 3.22Å; R85-D95 IonicContact CZ-OD1 2.74Å; R85-D95 IonicContact CZ-OD2 2.79Å; R85-D95 IonicContact NE-OD1 2.84Å; R85-D95 PolarHBondContact NE-OD1 3.41Å; R85-D95 IonicContact NE-OD2 3.05Å; R85-D95 IonicContact NH2-OD1 3.99Å; R85-D95 PolarHBondContact NH2-OD1 2.86Å; R85-D95 IonicContact NH2-OD2 3.27Å; R85-D95 PolarHBondContact NH2-OD2 2.96Å; D95-I133 CarbonylContact O-C 3.57Å; D95-I133 WeakPolarHBondContact O-CA 3.36Å; D95-K134 HydrophobicContact CB-CB 4.3Å; D95-K134 PolarHBondContact N-O 2.85Å; D95-K134 PolarHBondContact O-N 3.25Å
96	V	98.5	Very high	94.3	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	110.3	172.8	-175.5	0	0	0	0	106.6	F72 V83 I84 V94 I98 L131 I133 F210 L214	F72-V96 HydrophobicContact CE1-CG2 3.93Å; V83-V96 WeakPolarHBondContact CA-O 3.44Å; I84-V96 HydrophobicContact CD1-CB 4.18Å; I84-V96 HydrophobicContact CG1-CB 3.68Å; I84-V96 HydrophobicContact CG1-CG1 4.49Å; I84-V96 HydrophobicContact CG1-CG2 4.27Å; I84-V96 PolarHBondContact N-O 2.92Å; I84-V96 PolarHBondContact O-N 3.05Å; V94-V96 HydrophobicContact CG1-CG2 4.3Å; V96-I98 HydrophobicContact CG1-CD1 4.44Å; V96-I98 HydrophobicContact CG1-CG1 4.05Å; V96-L131 HydrophobicContact CG1-CD2 4.49Å; V96-I133 HydrophobicContact CG1-CG1 4.29Å; V96-I133 HydrophobicContact CG2-CG1 4.3Å; V96-F210 HydrophobicContact CG2-CZ 4.01Å; V96-L214 HydrophobicContact CG1-CD2 4.36Å
97	E	98.4	Very high	92.2	Very high	62 Å²	62	55.8 Å²	55.8	29%	0.29	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	128.1	177.1	-55.2	175	-171.3	0	0	108.3	I82 V83 R132	I82-E97 WeakPolarHBondContact O-CA 3.49Å; V83-E97 HydrophobicContact CG1-CG 4.22Å; V83-E97 HydrophobicContact CG2-CB 4.45Å; V83-E97 HydrophobicContact CG2-CG 4Å; E97-R132 HydrophobicContact CB-CB 4.15Å; E97-R132 PolarHBondContact N-O 3.09Å; E97-R132 PolarHBondContact O-N 3.13Å; E97-R132 IonicContact OE1-NH1 2.74Å; E97-R132 PolarHBondContact OE1-NH1 3.42Å; E97-R132 WeakPolarHBondContact OE2-CD 3.46Å; E97-R132 IonicContact OE2-CZ 3.69Å; E97-R132 IonicContact OE2-NE 3.74Å; E97-R132 IonicContact OE2-NH1 3.67Å; E97-R132 PolarHBondContact OE2-NH1 3.26Å
98	I	98.3	Very high	90	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.021	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	130.6	-170.6	-54	163.4	0	0	0	107.4	D81 I82 V96 L100 P129 L131 L214 F217	D81-I98 CarbonylContact C-O 3.59Å; D81-I98 WeakPolarHBondContact CA-O 3.48Å; I82-I98 HydrophobicContact CB-CB 4.39Å; I82-I98 PolarHBondContact N-O 3.3Å; I82-I98 PolarHBondContact O-N 2.98Å; V96-I98 HydrophobicContact CG1-CD1 4.44Å; V96-I98 HydrophobicContact CG1-CG1 4.05Å; I98-L100 HydrophobicContact CG2-CD2 3.9Å; I98-L100 HydrophobicContact CG2-CG 4.18Å; I98-P129 HydrophobicContact CG2-CB 3.97Å; I98-P129 HydrophobicContact CG2-CG 3.68Å; I98-L131 HydrophobicContact CG1-CD2 4Å; I98-L131 HydrophobicContact CG2-CD2 4.43Å; I98-L214 HydrophobicContact CD1-CD1 3.74Å; I98-F217 HydrophobicContact CD1-CD1 4.46Å; I98-F217 HydrophobicContact CD1-CE1 4.29Å
99	N	96.8	Very high	87.8	Confident	69 Å²	69	56.9 Å²	56.9	37%	0.369	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	117	167.9	-172.4	-62.3	0	0	0	109.4	C80 D81 A101 P129	C80-N99 WeakPolarHBondContact O-CA 3.45Å; D81-N99 PolarHBondContact OD1-ND2 3.34Å; N99-A101 WeakPolarHBondContact OD1-CB 3.4Å; N99-A101 PolarHBondContact OD1-N 3.29Å; N99-P129 WeakPolarHBondContact O-CB 3.19Å
100	L	96.5	Very high	85.4	Confident	5 Å²	5	54.8 Å²	54.8	3%	0.026	35%	0.35	C	S	.	.			trans	-86.1	-5.4	-174.9	-66.1	171.2	0	0	0	114	C80 I82 I98 G102 S103 P129 C218 E221 L225	C80-L100 PolarHBondContact O-N 3.19Å; I82-L100 HydrophobicContact CD1-CD1 3.64Å; I82-L100 HydrophobicContact CG1-CD1 4.47Å; I98-L100 HydrophobicContact CG2-CD2 3.9Å; I98-L100 HydrophobicContact CG2-CG 4.18Å; L100-G102 PolarHBondContact O-N 2.95Å; L100-S103 WeakPolarHBondContact O-CB 3.48Å; L100-S103 PolarHBondContact O-N 2.72Å; L100-S103 PolarHBondContact O-OG 3.23Å; L100-P129 HydrophobicContact CD2-CB 4.47Å; L100-P129 HydrophobicContact CD2-CG 4.19Å; L100-C218 HydrophobicContact CD2-CB 3.87Å; L100-E221 HydrophobicContact CD1-CB 3.49Å; L100-E221 VanDerWaalsContact CD1-CB 3.49Å; L100-L225 HydrophobicContact CB-CD1 3.84Å; L100-L225 HydrophobicContact CD1-CD1 3.76Å; L100-L225 HydrophobicContact CG-CD1 4.45Å
101	A	94.3	Very high	82.9	Confident	63 Å²	63	58.4 Å²	58.4	52%	0.521	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	122.1	-177.8	0	0	0	0	0	110.4	C80 N99 S103	C80-A101 HydrophobicContact CB-CB 4.11Å; N99-A101 WeakPolarHBondContact OD1-CB 3.4Å; N99-A101 PolarHBondContact OD1-N 3.29Å; A101-S103 PolarHBondContact O-N 2.95Å
102	G	91.6	Very high	80.2	Confident	82 Å²	82	61.7 Å²	61.7	85%	0.845	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	13.9	-179.1	0	0	0	0	0	114.4	L100 V104	L100-G102 PolarHBondContact O-N 2.95Å; G102-V104 PolarHBondContact O-N 2.91Å
103	S	93.4	Very high	77.6	Confident	8 Å²	8	68.8 Å²	68.8	6%	0.056	42%	0.42	C	S	.	.			trans	-71.4	-15.7	-178.1	59.8	0	0	0	0	114.1	L100 A101 H128	L100-S103 WeakPolarHBondContact O-CB 3.48Å; L100-S103 PolarHBondContact O-N 2.72Å; L100-S103 PolarHBondContact O-OG 3.23Å; A101-S103 PolarHBondContact O-N 2.95Å; S103-H128 PolarHBondContact O-N 3.3Å
104	V	90.5	Very high	75	Confident	38 Å²	38	72.2 Å²	72.2	23%	0.23	44%	0.444	C	S	.	.			trans	-103.2	114.3	176.6	177.3	0	0	0	0	108.8	G102 L125 A127 E222	G102-V104 PolarHBondContact O-N 2.91Å; V104-L125 HydrophobicContact CG1-CB 3.95Å; V104-L125 HydrophobicContact CG1-CD1 4.13Å; V104-L125 HydrophobicContact CG1-CD2 4.11Å; V104-L125 HydrophobicContact CG1-CG 4.29Å; V104-A127 HydrophobicContact CG2-CB 3.98Å; V104-E222 HydrophobicContact CG2-CG 3.79Å
105	S	77.7	Confident	72.2	Confident	94 Å²	94	75.8 Å²	75.8	66%	0.657	47%	0.473	S	S	*	.			trans	-99.6	130.3	170.6	-172.8	0	0	0	0	109.6	S107	S105-S107 PolarHBondContact O-N 3.2Å
106	P	66.7	Low	69.2	Low	87 Å²	87	80.7 Å²	80.7	57%	0.565	51%	0.506	S	S	*	.			trans	-62	125.1	167.1	27.4	-31.4	0	0	0	107.8	I108	P106-I108 PolarHBondContact O-N 2.85Å
107	S	55.9	Low	66.4	Low	79 Å²	79	88.3 Å²	88.3	55%	0.552	54%	0.542	S	S	*	.			trans	-64.5	99.3	169.8	41.4	0	0	0	0	108	S105 P109	S105-S107 PolarHBondContact O-N 3.2Å; S107-P109 WeakPolarHBondContact O-CD 3.5Å
108	I	49.6	Very low	63.5	Low	120 Å²	120	94 Å²	94	62%	0.615	57%	0.566	S	S	*	*			trans	-86.6	113.7	165.3	-58.3	172.5	0	0	0	104.4	P106 E110	P106-I108 PolarHBondContact O-N 2.85Å; I108-E110 VanDerWaalsContact C-N 3.3Å; I108-E110 HydrophobicContact CG2-CG 4.4Å; I108-E110 PolarHBondContact O-N 2.74Å
109	P	51.5	Low	60.7	Low	99 Å²	99	103.2 Å²	103.2	64%	0.643	61%	0.611	S	S	*	*			trans	-64.3	97.6	170.5	24.1	-29.2	0	0	0	108	S107	S107-P109 WeakPolarHBondContact O-CD 3.5Å
110	E	47.3	Very low	57.8	Low	166 Å²	166	108 Å²	108	78%	0.776	63%	0.631	S	S	*	*			trans	-78.6	125.1	162.4	-56.6	-149.9	163.9	0	0	106.2	I108	I108-E110 VanDerWaalsContact C-N 3.3Å; I108-E110 HydrophobicContact CG2-CG 4.4Å; I108-E110 PolarHBondContact O-N 2.74Å
111	D	43.3	Very low	55.5	Low	162 Å²	162	113.3 Å²	113.3	87%	0.866	66%	0.659	S	S	*	*	S	Bend	trans	81.3	80.2	-176.2	-58.1	-27.2	0	0	0	118
112	D	40.8	Very low	53.4	Low	112 Å²	112	116.2 Å²	116.2	60%	0.599	67%	0.666	S	S	*	*				-169.3	102.3	113.5	-156.4	-8.8	0	0	0	111.4	S114	D112-S114 PolarHBondContact O-N 3.08Å; D112-S114 WeakPolarHBondContact OD1-CB 3.41Å; D112-S114 PolarHBondContact OD1-N 3.08Å; D112-S114 VanDerWaalsContact OD1-N 3.13Å; D112-S114 PolarHBondContact OD1-OG 3.3Å
113	V	43.6	Very low	51.9	Low	159 Å²	159	114.5 Å²	114.5	96%	0.964	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	22.1	173.8	-154.4	0	0	0	0	111.4
114	S	42.5	Very low	50.8	Low	94 Å²	94	117.7 Å²	117.7	66%	0.657	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.8	31.1	-165.9	-0.5	0	0	0	0	115.6	D112	D112-S114 PolarHBondContact O-N 3.08Å; D112-S114 WeakPolarHBondContact OD1-CB 3.41Å; D112-S114 PolarHBondContact OD1-N 3.08Å; D112-S114 VanDerWaalsContact OD1-N 3.13Å; D112-S114 PolarHBondContact OD1-OG 3.3Å
115	A	40.6	Very low	50.4	Low	74 Å²	74	119.1 Å²	119.1	61%	0.612	67%	0.67	S	S	*	*			trans	-150.3	106.6	163.2	0	0	0	0	0	112.3
116	P	35.5	Very low	51	Low	117 Å²	117	117 Å²	117	76%	0.76	65%	0.65	S	S	*	*			trans	-76.7	125.2	157.6	32.6	-24.8	0	0	0	106.6
117	E	39.7	Very low	52.2	Low	160 Å²	160	112.9 Å²	112.9	75%	0.748	62%	0.623	S	S	*	*	S	Bend	trans	143.3	96.5	146.2	-73.6	174.6	-155.9	0	0	113.3
118	K	38.7	Very low	54	Low	183 Å²	183	111.3 Å²	111.3	80%	0.796	61%	0.607	S	S	*	*	S	Bend	trans	68.5	72.8	139.1	-56.6	171.7	-176.5	160.9	0	117.4
119	M	39	Very low	56.2	Low	197 Å²	197	105.8 Å²	105.8	97%	0.97	58%	0.579	S	S	*	*			trans	-160.8	26.7	153.9	-109.8	169.4	-144.2	0	0	114.2
120	E	36.2	Very low	58.2	Low	168 Å²	168	106.5 Å²	106.5	79%	0.785	58%	0.578	S	S	*	*			trans	-108.8	115.1	-178.3	-65.3	173.7	166.2	0	0	109.4
121	D	46.4	Very low	60.5	Low	118 Å²	118	98.9 Å²	98.9	63%	0.631	54%	0.542	S	S	*	.	S	Bend	trans	155.6	1.6	143	-102	-7.7	0	0	0	116.9
122	D	52.1	Low	63.1	Low	124 Å²	124	94.4 Å²	94.4	66%	0.663	51%	0.513	S	S	*	.			trans	-108.3	10.9	-173	-90.5	-12.2	0	0	0	115.3	P124	D122-P124 WeakPolarHBondContact O-CD 3.47Å
123	A	60	Low	65.9	Low	46 Å²	46	89.1 Å²	89.1	38%	0.38	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-67	123.9	173.9	0	0	0	0	0	109.3	L125	A123-L125 PolarHBondContact O-N 3.37Å
124	P	69.4	Low	68.5	Low	74 Å²	74	83.2 Å²	83.2	48%	0.481	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-60.1	136.6	175.3	24.1	-30	0	0	0	109.5	D122 E126	D122-P124 WeakPolarHBondContact O-CD 3.47Å; P124-E126 PolarHBondContact O-N 3.13Å
125	L	82	Confident	71.1	Confident	68 Å²	68	79.3 Å²	79.3	36%	0.356	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-70.5	120.5	169.1	-68.7	178.1	0	0	0	107.6	L4 V104 A123 T219	L4-L125 HydrophobicContact CD2-CB 3.39Å; L4-L125 HydrophobicContact CD2-CD1 3.33Å; L4-L125 HydrophobicContact CD2-CG 3.26Å; L4-L125 HydrophobicContact CG-CG 4.48Å; V104-L125 HydrophobicContact CG1-CB 3.95Å; V104-L125 HydrophobicContact CG1-CD1 4.13Å; V104-L125 HydrophobicContact CG1-CD2 4.11Å; V104-L125 HydrophobicContact CG1-CG 4.29Å; A123-L125 PolarHBondContact O-N 3.37Å; L125-T219 WeakPolarHBondContact O-CG2 3.44Å
126	E	89.5	Confident	73.9	Confident	51 Å²	51	77.1 Å²	77.1	24%	0.238	40%	0.397	C	S	.	.			trans	-113.2	143.9	179.7	-68.4	176.3	178.1	0	0	109.4	P124 H128 Q215	P124-E126 PolarHBondContact O-N 3.13Å; E126-H128 PolarHBondContact O-CD2 3.06Å; E126-H128 IonicContact OE2-NE2 2.9Å; E126-Q215 PolarHBondContact OE2-NE2 2.93Å
127	A	92.9	Very high	76.8	Confident	0 Å²	0	76.7 Å²	76.7	0%	0	38%	0.383	C	S	.	.			trans	-88.3	125.8	175.5	0	0	0	0	0	110.3	V104 P129 C218 T219 E222	V104-A127 HydrophobicContact CG2-CB 3.98Å; A127-P129 WeakPolarHBondContact O-CD 3.33Å; A127-C218 HydrophobicContact CB-CB 4.05Å; A127-T219 PolarHBondContact N-OG1 3.44Å; A127-E222 HydrophobicContact CB-CB 4.15Å
128	H	93.6	Very high	79.6	Confident	46 Å²	46	73.4 Å²	73.4	21%	0.213	38%	0.376	C	S	.	.			trans	-120.1	67.8	176	-64.1	-101.6	0	0	0	110.4	S103 E126 L149 P150 Q215	S103-H128 PolarHBondContact O-N 3.3Å; E126-H128 PolarHBondContact O-CD2 3.06Å; E126-H128 IonicContact OE2-NE2 2.9Å; H128-L149 HydrophobicContact CB-CB 4.36Å; H128-P150 PolarHBondContact CE1-O 3.48Å; H128-P150 PolarHBondContact ND1-O 3.46Å; H128-Q215 PolarHBondContact CE1-NE2 2.74Å; H128-Q215 PolarHBondContact NE2-NE2 3.35Å
129	P	94.9	Very high	82.3	Confident	3 Å²	3	67.9 Å²	67.9	2%	0.019	36%	0.36	C	S	.	.			trans	-68.9	151.3	175.6	30.9	-36.3	0	0	0	111.1	I98 N99 L100 A127 L131 C218	I98-P129 HydrophobicContact CG2-CB 3.97Å; I98-P129 HydrophobicContact CG2-CG 3.68Å; N99-P129 WeakPolarHBondContact O-CB 3.19Å; L100-P129 HydrophobicContact CD2-CB 4.47Å; L100-P129 HydrophobicContact CD2-CG 4.19Å; A127-P129 WeakPolarHBondContact O-CD 3.33Å; P129-L131 HydrophobicContact CG-CD2 4.11Å; P129-C218 HydrophobicContact CG-CB 4.1Å
130	D	94.1	Very high	85	Confident	115 Å²	115	61 Å²	61	62%	0.615	34%	0.339	S	S	*	.			trans	-65.4	141.1	160.3	-70	-35.7	0	0	0	109.4	S148	D130-S148 PolarHBondContact OD1-OG 2.91Å
131	L	96.5	Very high	87.9	Confident	6 Å²	6	58.8 Å²	58.8	3%	0.031	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	139	-173.7	-56.4	175.5	0	0	0	110.2	V96 I98 P129 N146 C147 L149 L214	V96-L131 HydrophobicContact CG1-CD2 4.49Å; I98-L131 HydrophobicContact CG1-CD2 4Å; I98-L131 HydrophobicContact CG2-CD2 4.43Å; P129-L131 HydrophobicContact CG-CD2 4.11Å; L131-N146 WeakPolarHBondContact O-CA 3.4Å; L131-C147 HydrophobicContact CB-CB 4.27Å; L131-C147 PolarHBondContact N-O 3.38Å; L131-C147 PolarHBondContact O-N 3.24Å; L131-L149 HydrophobicContact CD1-CD1 4.28Å; L131-L149 HydrophobicContact CD1-CD2 3.87Å; L131-L149 HydrophobicContact CD1-CG 3.9Å; L131-L149 HydrophobicContact CG-CG 4.39Å; L131-L214 HydrophobicContact CD1-CD2 3.43Å; L131-L214 VanDerWaalsContact CD1-CD2 3.43Å; L131-L214 HydrophobicContact CD2-CD2 3.92Å; L131-L214 HydrophobicContact CG-CD2 4.33Å
132	R	97.9	Very high	90.3	Very high	68 Å²	68	53.5 Å²	53.5	26%	0.257	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	105.8	170.9	-179.9	174.7	-176	-83.9	-5.1	110	E97 V144 F145 E175	E97-R132 HydrophobicContact CB-CB 4.15Å; E97-R132 PolarHBondContact N-O 3.09Å; E97-R132 PolarHBondContact O-N 3.13Å; E97-R132 IonicContact OE1-NH1 2.74Å; E97-R132 PolarHBondContact OE1-NH1 3.42Å; E97-R132 WeakPolarHBondContact OE2-CD 3.46Å; E97-R132 IonicContact OE2-CZ 3.69Å; E97-R132 IonicContact OE2-NE 3.74Å; E97-R132 IonicContact OE2-NH1 3.67Å; E97-R132 PolarHBondContact OE2-NH1 3.26Å; R132-V144 HydrophobicContact CG-CG1 3.45Å; R132-V144 VanDerWaalsContact CG-CG1 3.45Å; R132-V144 VanDerWaalsContact NE-CG1 3.32Å; R132-F145 CarbonylContact C-O 3.57Å; R132-F145 WeakPolarHBondContact CA-O 3.38Å; R132-E175 IonicContact NH2-OE2 3.48Å
133	I	98.3	Very high	92.5	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	115.7	-176.6	-56	-179.8	0	0	0	109.4	V94 D95 V96 L135 V144 F145 L201 L206	V94-I133 HydrophobicContact CG1-CG2 4.11Å; D95-I133 CarbonylContact O-C 3.57Å; D95-I133 WeakPolarHBondContact O-CA 3.36Å; V96-I133 HydrophobicContact CG1-CG1 4.29Å; V96-I133 HydrophobicContact CG2-CG1 4.3Å; I133-L135 HydrophobicContact CG2-CD2 4.48Å; I133-V144 CarbonylContact O-C 3.56Å; I133-V144 VanDerWaalsContact O-CA 3.31Å; I133-V144 WeakPolarHBondContact O-CA 3.46Å; I133-F145 HydrophobicContact CB-CB 4.35Å; I133-F145 PolarHBondContact N-O 3.39Å; I133-F145 WeakPolarHBondContact O-CD2 3.5Å; I133-F145 PolarHBondContact O-N 3.22Å; I133-L201 HydrophobicContact CG2-CD2 4.44Å; I133-L206 HydrophobicContact CD1-CD1 4.15Å; I133-L206 HydrophobicContact CG2-CD1 3.73Å
134	K	98.3	Very high	94.3	Very high	35 Å²	35	48 Å²	48	15%	0.152	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	114.4	176.7	-178.2	178.6	-176	170.9	0	111	V94 D95 S142 L143 V144 E177	V94-K134 WeakPolarHBondContact CA-O 3.35Å; D95-K134 HydrophobicContact CB-CB 4.3Å; D95-K134 PolarHBondContact N-O 2.85Å; D95-K134 PolarHBondContact O-N 3.25Å; K134-S142 VanDerWaalsContact CE-CB 3.4Å; K134-S142 VanDerWaalsContact CE-OG 3.3Å; K134-S142 WeakPolarHBondContact CE-OG 3.2Å; K134-L143 CarbonylContact C-O 3.59Å; K134-L143 WeakPolarHBondContact CA-O 3.48Å; K134-V144 HydrophobicContact CB-CG2 4.27Å; K134-V144 HydrophobicContact CG-CG2 4.07Å; K134-E177 WeakPolarHBondContact CE-OE2 3.42Å; K134-E177 IonicContact NZ-OE1 2.66Å; K134-E177 PolarHBondContact NZ-OE1 2.8Å; K134-E177 IonicContact NZ-OE2 3.45Å; K134-E177 PolarHBondContact NZ-OE2 2.97Å; K134-E177 VanDerWaalsContact NZ-OE2 3.09Å
135	L	98.4	Very high	95.7	Very high	12 Å²	12	44.6 Å²	44.6	6%	0.063	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	116.1	170.2	-62	-172.9	0	0	0	110	V94 I133 S142 L143 F145 L200 L201 R204	V94-L135 HydrophobicContact CB-CD2 4.16Å; V94-L135 HydrophobicContact CG1-CD2 3.94Å; V94-L135 HydrophobicContact CG2-CD2 3.5Å; V94-L135 VanDerWaalsContact CG2-CD2 3.5Å; I133-L135 HydrophobicContact CG2-CD2 4.48Å; L135-S142 CarbonylContact O-C 3.38Å; L135-S142 WeakPolarHBondContact O-CA 3.1Å; L135-S142 WeakPolarHBondContact O-CB 3.35Å; L135-L143 PolarHBondContact N-O 3.42Å; L135-L143 PolarHBondContact O-N 2.97Å; L135-F145 HydrophobicContact CB-CE2 4.3Å; L135-F145 HydrophobicContact CD1-CD2 4.48Å; L135-F145 HydrophobicContact CD1-CE2 3.6Å; L135-F145 HydrophobicContact CD1-CZ 4.23Å; L135-F145 HydrophobicContact CG-CD2 4.3Å; L135-F145 HydrophobicContact CG-CE2 3.72Å; L135-L200 HydrophobicContact CD1-CD1 4.5Å; L135-L200 HydrophobicContact CD1-CD2 3.98Å; L135-L200 HydrophobicContact CD1-CG 3.96Å; L135-L201 HydrophobicContact CD1-CD2 4.16Å; L135-R204 HydrophobicContact CD1-CG 4.42Å; L135-R204 HydrophobicContact CD2-CB 4.49Å; L135-R204 HydrophobicContact CD2-CG 4.25Å
136	T	98.3	Very high	96.4	Very high	28 Å²	28	43.1 Å²	43.1	17%	0.172	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	120.4	179.5	-57	0	0	0	0	111	V92 S93 S142	V92-T136 CarbonylContact C-O 3.58Å; V92-T136 VanDerWaalsContact CA-O 3.25Å; V92-T136 WeakPolarHBondContact CA-O 3.47Å; V92-T136 WeakPolarHBondContact CG1-O 3.48Å; S93-T136 PolarHBondContact N-O 3.13Å; S93-T136 PolarHBondContact O-N 2.59Å; T136-S142 WeakPolarHBondContact CA-OG 3.39Å; T136-S142 VanDerWaalsContact CB-OG 3.31Å; T136-S142 WeakPolarHBondContact CB-OG 3.44Å; T136-S142 VanDerWaalsContact CG2-OG 3.3Å; T136-S142 WeakPolarHBondContact CG2-OG 3.48Å; T136-S142 PolarHBondContact OG1-OG 2.78Å
137	K	97.6	Very high	96.8	Very high	109 Å²	109	40.8 Å²	40.8	47%	0.474	22%	0.219	S	C	.	.			trans	-79.3	158.1	175.4	-67.5	-175.7	178.1	-178.6	0	111.4	V92 S139 G140 R141	V92-K137 HydrophobicContact CG2-CG 4.45Å; K137-S139 PolarHBondContact O-N 3.05Å; K137-G140 PolarHBondContact O-N 2.84Å; K137-R141 PolarHBondContact N-O 3.33Å
138	P	97.2	Very high	96.9	Very high	91 Å²	91	42.4 Å²	42.4	59%	0.591	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-28.6	175	-27.1	31.3	0	0	0	114.8	D90 G140	D90-P138 VanDerWaalsContact O-CG 3.22Å; D90-P138 WeakPolarHBondContact O-CG 3.41Å; P138-G140 PolarHBondContact O-N 3.22Å; P138-G140 VanDerWaalsContact O-N 3.13Å
139	S	96.2	Very high	96.8	Very high	66 Å²	66	41.1 Å²	41.1	46%	0.462	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-1.3	174.6	63.7	0	0	0	0	114.9	K137 R141	K137-S139 PolarHBondContact O-N 3.05Å; S139-R141 VanDerWaalsContact C-N 3.29Å; S139-R141 PolarHBondContact O-N 3.44Å; S139-R141 PolarHBondContact OG-NE 2.9Å
140	G	95.5	Very high	96.3	Very high	52 Å²	52	41.8 Å²	41.8	54%	0.536	23%	0.229	S	C	.	.	S	Bend	trans	72.1	19.1	-172.3	0	0	0	0	0	113.9	K137 P138	K137-G140 PolarHBondContact O-N 2.84Å; P138-G140 PolarHBondContact O-N 3.22Å; P138-G140 VanDerWaalsContact O-N 3.13Å
141	R	95.9	Very high	95.3	Very high	123 Å²	123	38.2 Å²	38.2	46%	0.464	22%	0.22	S	C	.	.			trans	-96.1	135.1	175.7	-73.8	-169.2	-69.5	165.6	-2.5	109.2	K137 S139	K137-R141 PolarHBondContact N-O 3.33Å; S139-R141 VanDerWaalsContact C-N 3.29Å; S139-R141 PolarHBondContact O-N 3.44Å; S139-R141 PolarHBondContact OG-NE 2.9Å
142	S	97.6	Very high	93.7	Very high	6 Å²	6	41.5 Å²	41.5	4%	0.042	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	145.4	-179.5	-49.9	0	0	0	0	113.7	K134 L135 T136 E177	K134-S142 VanDerWaalsContact CE-CB 3.4Å; K134-S142 VanDerWaalsContact CE-OG 3.3Å; K134-S142 WeakPolarHBondContact CE-OG 3.2Å; L135-S142 CarbonylContact O-C 3.38Å; L135-S142 WeakPolarHBondContact O-CA 3.1Å; L135-S142 WeakPolarHBondContact O-CB 3.35Å; T136-S142 WeakPolarHBondContact CA-OG 3.39Å; T136-S142 VanDerWaalsContact CB-OG 3.31Å; T136-S142 WeakPolarHBondContact CB-OG 3.44Å; T136-S142 VanDerWaalsContact CG2-OG 3.3Å; T136-S142 WeakPolarHBondContact CG2-OG 3.48Å; T136-S142 PolarHBondContact OG1-OG 2.78Å; S142-E177 WeakPolarHBondContact CB-OE2 3.44Å; S142-E177 PolarHBondContact O-N 2.83Å; S142-E177 PolarHBondContact OG-OE2 3.24Å
143	L	97.9	Very high	91.7	Very high	54 Å²	54	43.9 Å²	43.9	28%	0.283	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	144.1	162.9	-64.6	178.4	0	0	0	107.7	K134 L135 F145 E175 V176 L200	K134-L143 CarbonylContact C-O 3.59Å; K134-L143 WeakPolarHBondContact CA-O 3.48Å; L135-L143 PolarHBondContact N-O 3.42Å; L135-L143 PolarHBondContact O-N 2.97Å; L143-F145 HydrophobicContact CB-CE2 3.7Å; L143-F145 HydrophobicContact CB-CZ 3.73Å; L143-F145 HydrophobicContact CD1-CZ 3.91Å; L143-F145 HydrophobicContact CG-CZ 4.48Å; L143-E175 WeakPolarHBondContact CA-O 3.26Å; L143-V176 HydrophobicContact CD2-CB 4.28Å; L143-V176 HydrophobicContact CD2-CG1 4.29Å; L143-V176 HydrophobicContact CD2-CG2 3.71Å; L143-L200 HydrophobicContact CD1-CD2 4.34Å
144	V	98.3	Very high	89.6	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	131.4	175.7	179.8	0	0	0	0	107.4	R132 I133 K134 V174 E175	R132-V144 HydrophobicContact CG-CG1 3.45Å; R132-V144 VanDerWaalsContact CG-CG1 3.45Å; R132-V144 VanDerWaalsContact NE-CG1 3.32Å; I133-V144 CarbonylContact O-C 3.56Å; I133-V144 VanDerWaalsContact O-CA 3.31Å; I133-V144 WeakPolarHBondContact O-CA 3.46Å; K134-V144 HydrophobicContact CB-CG2 4.27Å; K134-V144 HydrophobicContact CG-CG2 4.07Å; V144-V174 CarbonylContact O-C 3.53Å; V144-V174 WeakPolarHBondContact O-CA 3.39Å; V144-E175 HydrophobicContact CB-CB 4.1Å; V144-E175 PolarHBondContact N-O 3.14Å; V144-E175 PolarHBondContact O-N 3.03Å
145	F	98.4	Very high	87.4	Confident	3 Å²	3	47.4 Å²	47.4	1%	0.013	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	121.2	177.7	-53.5	-87.3	0	0	0	107	R132 I133 L135 L143 V171 V174 T197 L200 L201	R132-F145 CarbonylContact C-O 3.57Å; R132-F145 WeakPolarHBondContact CA-O 3.38Å; I133-F145 HydrophobicContact CB-CB 4.35Å; I133-F145 PolarHBondContact N-O 3.39Å; I133-F145 WeakPolarHBondContact O-CD2 3.5Å; I133-F145 PolarHBondContact O-N 3.22Å; L135-F145 HydrophobicContact CB-CE2 4.3Å; L135-F145 HydrophobicContact CD1-CD2 4.48Å; L135-F145 HydrophobicContact CD1-CE2 3.6Å; L135-F145 HydrophobicContact CD1-CZ 4.23Å; L135-F145 HydrophobicContact CG-CD2 4.3Å; L135-F145 HydrophobicContact CG-CE2 3.72Å; L143-F145 HydrophobicContact CB-CE2 3.7Å; L143-F145 HydrophobicContact CB-CZ 3.73Å; L143-F145 HydrophobicContact CD1-CZ 3.91Å; L143-F145 HydrophobicContact CG-CZ 4.48Å; F145-V171 HydrophobicContact CB-CG1 4.12Å; F145-V171 HydrophobicContact CD1-CG1 4.01Å; F145-V174 HydrophobicContact CD1-CB 4.5Å; F145-V174 HydrophobicContact CD1-CG1 4.1Å; F145-V174 HydrophobicContact CD1-CG2 3.78Å; F145-V174 HydrophobicContact CE1-CG1 3.87Å; F145-V174 HydrophobicContact CE1-CG2 4.04Å; F145-T197 HydrophobicContact CD1-CG2 3.93Å; F145-T197 HydrophobicContact CE1-CG2 3.57Å; F145-L200 HydrophobicContact CZ-CD2 4.13Å; F145-L201 HydrophobicContact CD2-CD2 3.73Å; F145-L201 HydrophobicContact CE2-CD2 3.93Å; F145-L201 HydrophobicContact CG-CD2 4.06Å; F145-L201 HydrophobicContact CZ-CD2 4.4Å
146	N	97.9	Very high	85	Confident	37 Å²	37	54.4 Å²	54.4	20%	0.198	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	124.5	169	-57.9	-58.6	0	0	0	106.5	L131 D172 S173 E175	L131-N146 WeakPolarHBondContact O-CA 3.4Å; N146-D172 PolarHBondContact O-N 2.84Å; N146-S173 WeakPolarHBondContact CB-OG 3.4Å; N146-S173 PolarHBondContact N-O 3.38Å; N146-S173 PolarHBondContact ND2-OG 3.19Å; N146-S173 PolarHBondContact O-N 2.98Å; N146-E175 PolarHBondContact ND2-OE1 3.07Å
147	C	97.2	Very high	82.3	Confident	1 Å²	1	61 Å²	61	1%	0.007	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	145.2	-170.8	-51.9	0	0	0	0	110.8	L131 Y169 S170 D172	L131-C147 HydrophobicContact CB-CB 4.27Å; L131-C147 PolarHBondContact N-O 3.38Å; L131-C147 PolarHBondContact O-N 3.24Å; C147-Y169 HydrophobicContact CB-CD2 4.11Å; C147-S170 WeakPolarHBondContact CA-O 3.48Å; C147-S170 WeakPolarHBondContact CB-O 3.26Å; C147-D172 VanDerWaalsContact C-OD2 3.27Å; C147-D172 WeakPolarHBondContact CA-OD2 3.33Å
148	S	94.2	Very high	80	Confident	35 Å²	35	61 Å²	61	25%	0.245	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	133.9	172.4	-69.5	0	0	0	0	110.7	D130 Y169 S170 D172	D130-S148 PolarHBondContact OD1-OG 2.91Å; S148-Y169 WeakPolarHBondContact O-CA 3.39Å; S148-Y169 WeakPolarHBondContact O-CB 3.4Å; S148-S170 PolarHBondContact N-O 3.1Å; S148-S170 PolarHBondContact O-N 2.99Å; S148-D172 PolarHBondContact N-OD2 2.91Å; S148-D172 VanDerWaalsContact N-OD2 3.07Å; S148-D172 PolarHBondContact OG-OD2 2.97Å; S148-D172 VanDerWaalsContact OG-OD2 3.14Å
149	L	91.8	Very high	77.3	Confident	18 Å²	18	61.3 Å²	61.3	9%	0.094	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-72.3	144.5	170.4	-68.3	172.8	0	0	0	109.4	H128 L131 Q211	H128-L149 HydrophobicContact CB-CB 4.36Å; L131-L149 HydrophobicContact CD1-CD1 4.28Å; L131-L149 HydrophobicContact CD1-CD2 3.87Å; L131-L149 HydrophobicContact CD1-CG 3.9Å; L131-L149 HydrophobicContact CG-CG 4.39Å; L149-Q211 HydrophobicContact CD2-CG 3.81Å
150	P	84.5	Confident	75.1	Confident	17 Å²	17	66.9 Å²	66.9	11%	0.11	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-59.6	143.5	174.9	30.1	-38.4	0	0	0	109.9	H128 A154 D155 T168	H128-P150 PolarHBondContact CE1-O 3.48Å; H128-P150 PolarHBondContact ND1-O 3.46Å; P150-A154 HydrophobicContact CB-CB 3.97Å; P150-D155 WeakPolarHBondContact CG-OD1 3.29Å; P150-T168 WeakPolarHBondContact CG-OG1 3.48Å
151	G	73.9	Confident	72.8	Confident	41 Å²	41	71.3 Å²	71.3	42%	0.423	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-72.2	159.3	165.8	0	0	0	0	0	110.8	D153 A154	G151-D153 PolarHBondContact O-N 3.46Å; G151-A154 WeakPolarHBondContact O-CB 3.37Å; G151-A154 PolarHBondContact O-N 3.23Å
152	H	62.9	Low	70.4	Confident	74 Å²	74	74.1 Å²	74.1	34%	0.343	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-26.8	179.1	179.1	-83.4	0	0	0	114.2
153	D	54.4	Low	68.2	Low	118 Å²	118	77 Å²	77	63%	0.631	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-24	177.9	-62.6	-34.6	0	0	0	113.4	G151	G151-D153 PolarHBondContact O-N 3.46Å
154	A	54.8	Low	66.6	Low	43 Å²	43	81.8 Å²	81.8	36%	0.355	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-31	178.2	0	0	0	0	0	112.2	P150 G151 K156 Q157	P150-A154 HydrophobicContact CB-CB 3.97Å; G151-A154 WeakPolarHBondContact O-CB 3.37Å; G151-A154 PolarHBondContact O-N 3.23Å; A154-K156 PolarHBondContact O-N 3.33Å; A154-Q157 PolarHBondContact O-N 2.9Å; A154-Q157 VanDerWaalsContact O-N 3.16Å
155	D	52	Low	65.5	Low	66 Å²	66	85.2 Å²	85.2	35%	0.353	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-21.9	-179.9	-69.5	-30.1	0	0	0	113	P150 Q157	P150-D155 WeakPolarHBondContact CG-OD1 3.29Å; D155-Q157 VanDerWaalsContact C-N 3.33Å; D155-Q157 PolarHBondContact O-N 2.74Å
156	K	47.7	Very low	64.8	Low	160 Å²	160	89.7 Å²	89.7	70%	0.696	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-14.3	177.3	-68.8	-177.4	-176	171.7	0	114.1	A154	A154-K156 PolarHBondContact O-N 3.33Å
157	Q	43.2	Very low	64.3	Low	165 Å²	165	88.6 Å²	88.6	77%	0.771	48%	0.478	S	S	*	.	S	Bend	trans	-96.4	-8.4	-174.6	-76.1	-173.3	-32.4	0	0	114.2	A154 D155 S159	A154-Q157 PolarHBondContact O-N 2.9Å; A154-Q157 VanDerWaalsContact O-N 3.16Å; D155-Q157 VanDerWaalsContact C-N 3.33Å; D155-Q157 PolarHBondContact O-N 2.74Å; Q157-S159 PolarHBondContact O-N 2.85Å
158	L	48.4	Very low	63.9	Low	109 Å²	109	91.3 Å²	91.3	57%	0.571	50%	0.495	S	S	*	.			trans	-91	96.1	-178.3	-64.5	171.8	0	0	0	110.2	T168	L158-T168 HydrophobicContact CD1-CG2 3.36Å
159	S	40.7	Very low	63.8	Low	98 Å²	98	90 Å²	90	69%	0.685	49%	0.485	S	S	*	.			trans	-56.8	137.7	169.1	47.7	0	0	0	0	111.5	Q157 D161	Q157-S159 PolarHBondContact O-N 2.85Å; S159-D161 PolarHBondContact O-N 2.84Å
160	E	49.9	Very low	63.9	Low	183 Å²	183	91.1 Å²	91.1	86%	0.855	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	9.5	-173.4	-64	178.5	152.5	0	0	117.2
161	D	46.5	Very low	64.5	Low	145 Å²	145	90.4 Å²	90.4	78%	0.775	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	-2.4	-159.8	-77.9	-33.9	0	0	0	116.7	S159	S159-D161 PolarHBondContact O-N 2.84Å
162	E	46.7	Very low	65.6	Low	182 Å²	182	90.9 Å²	90.9	85%	0.85	48%	0.482	S	S	*	.	S	Bend	trans	-126.7	96.3	176.5	-73.4	-164.7	137.3	0	0	114
163	S	51.7	Low	67.3	Low	67 Å²	67	87.8 Å²	87.8	47%	0.469	47%	0.469	S	S	.	.			trans	66.4	92.3	163.6	75	0	0	0	0	117.3	N165 L166	S163-N165 PolarHBondContact O-N 2.96Å; S163-L166 PolarHBondContact O-N 2.7Å; S163-L166 WeakPolarHBondContact OG-CD1 3.35Å; S163-L166 VanDerWaalsContact OG-CG 3.27Å; S163-L166 WeakPolarHBondContact OG-CG 3.32Å
164	N	63.3	Low	69.4	Low	155 Å²	155	83 Å²	83	83%	0.829	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	6	-177.7	-66.1	-0.5	0	0	0	117.8
165	N	76	Confident	71.4	Confident	73 Å²	73	83.2 Å²	83.2	39%	0.39	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.6	-2	-177.8	-161.1	38.3	0	0	0	114.1	S163 N207	S163-N165 PolarHBondContact O-N 2.96Å; N165-N207 WeakPolarHBondContact O-CB 3.3Å; N165-N207 WeakPolarHBondContact OD1-CB 3.25Å; N165-N207 PolarHBondContact OD1-ND2 2.77Å
166	L	84.2	Confident	73.6	Confident	96 Å²	96	83 Å²	83	50%	0.503	44%	0.439	S	S	.	.			trans	-76.7	132.1	171.6	-72.3	-178.1	0	0	0	109.2	S163 V202	S163-L166 PolarHBondContact O-N 2.7Å; S163-L166 WeakPolarHBondContact OG-CD1 3.35Å; S163-L166 VanDerWaalsContact OG-CG 3.27Å; S163-L166 WeakPolarHBondContact OG-CG 3.32Å; L166-V202 HydrophobicContact CD2-CG2 4.18Å
167	P	86.2	Confident	75.7	Confident	14 Å²	14	79.9 Å²	79.9	9%	0.091	43%	0.427	C	S	.	.			trans	-69.7	159.9	172.9	31.7	-34.6	0	0	0	110.9	Y169 M198 V202	P167-Y169 HydrophobicContact CB-CD1 3.38Å; P167-Y169 HydrophobicContact CB-CE1 3.18Å; P167-Y169 HydrophobicContact CB-CG 4.25Å; P167-Y169 HydrophobicContact CG-CD1 3.96Å; P167-Y169 HydrophobicContact CG-CE1 3.37Å; P167-Y169 HydrophobicContact CG-CE2 4.32Å; P167-M198 HydrophobicContact CG-CE 3.82Å; P167-V202 HydrophobicContact CG-CG2 4.47Å
168	T	88.8	Confident	78	Confident	59 Å²	59	80.1 Å²	80.1	36%	0.362	42%	0.421	S	S	.	.	S	Bend	trans	-99.4	-5.7	179	62.4	0	0	0	0	113.1	P150 L158 Q211	P150-T168 WeakPolarHBondContact CG-OG1 3.48Å; L158-T168 HydrophobicContact CD1-CG2 3.36Å; T168-Q211 PolarHBondContact OG1-NE2 2.9Å; T168-Q211 PolarHBondContact OG1-OE1 2.61Å
169	Y	92	Very high	80.3	Confident	6 Å²	6	79.3 Å²	79.3	2%	0.024	42%	0.416	C	S	.	.			trans	-65.9	148.9	170.4	70.1	-106.4	0	0	0	112.1	C147 S148 P167 V171 M198 L201 L206 Q211	C147-Y169 HydrophobicContact CB-CD2 4.11Å; S148-Y169 WeakPolarHBondContact O-CA 3.39Å; S148-Y169 WeakPolarHBondContact O-CB 3.4Å; P167-Y169 HydrophobicContact CB-CD1 3.38Å; P167-Y169 HydrophobicContact CB-CE1 3.18Å; P167-Y169 HydrophobicContact CB-CG 4.25Å; P167-Y169 HydrophobicContact CG-CD1 3.96Å; P167-Y169 HydrophobicContact CG-CE1 3.37Å; P167-Y169 HydrophobicContact CG-CE2 4.32Å; Y169-V171 HydrophobicContact CE2-CG2 4.33Å; Y169-M198 HydrophobicContact CD2-CE 4.41Å; Y169-M198 HydrophobicContact CE2-CE 3.86Å; Y169-L201 HydrophobicContact CE2-CD1 4.1Å; Y169-L206 PolarHBondContact OH-O 3.01Å; Y169-Q211 HydrophobicContact CD1-CB 4.26Å; Y169-Q211 HydrophobicContact CD1-CG 4.24Å; Y169-Q211 VanDerWaalsContact N-OE1 3.14Å
170	S	94.3	Very high	82.7	Confident	43 Å²	43	80.4 Å²	80.4	30%	0.301	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	151.9	171.9	56	0	0	0	0	111.1	C147 S148 D172	C147-S170 WeakPolarHBondContact CA-O 3.48Å; C147-S170 WeakPolarHBondContact CB-O 3.26Å; S148-S170 PolarHBondContact N-O 3.1Å; S148-S170 PolarHBondContact O-N 2.99Å; S170-D172 PolarHBondContact OG-OD1 3.08Å
171	V	97.2	Very high	84.7	Confident	1 Å²	1	75.5 Å²	75.5	1%	0.006	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	115.6	159.8	178.4	0	0	0	0	106.1	F145 Y169 V174 T186 Y194 M198 L201	F145-V171 HydrophobicContact CB-CG1 4.12Å; F145-V171 HydrophobicContact CD1-CG1 4.01Å; Y169-V171 HydrophobicContact CE2-CG2 4.33Å; V171-V174 HydrophobicContact CG1-CG2 4.02Å; V171-T186 HydrophobicContact CB-CG2 4.18Å; V171-T186 HydrophobicContact CG1-CG2 3.73Å; V171-T186 VanDerWaalsContact O-CB 3.26Å; V171-T186 WeakPolarHBondContact O-CB 3.36Å; V171-T186 WeakPolarHBondContact O-CG2 3.17Å; V171-T186 PolarHBondContact O-OG1 3.13Å; V171-Y194 HydrophobicContact CB-CE2 4.41Å; V171-Y194 PolarHBondContact N-OH 2.7Å; V171-M198 HydrophobicContact CB-SD 4.4Å; V171-M198 HydrophobicContact CG2-SD 3.51Å; V171-M198 VanDerWaalsContact CG2-SD 3.51Å; V171-L201 HydrophobicContact CG2-CD1 3.55Å
172	D	97.5	Very high	87.1	Confident	51 Å²	51	75.3 Å²	75.3	27%	0.273	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-33.1	-173.6	-41.5	-58.3	0	0	0	111.4	N146 C147 S148 S170 Y185 T186	N146-D172 PolarHBondContact O-N 2.84Å; C147-D172 VanDerWaalsContact C-OD2 3.27Å; C147-D172 WeakPolarHBondContact CA-OD2 3.33Å; S148-D172 PolarHBondContact N-OD2 2.91Å; S148-D172 VanDerWaalsContact N-OD2 3.07Å; S148-D172 PolarHBondContact OG-OD2 2.97Å; S148-D172 VanDerWaalsContact OG-OD2 3.14Å; S170-D172 PolarHBondContact OG-OD1 3.08Å; D172-Y185 WeakPolarHBondContact O-CA 3.33Å; D172-T186 PolarHBondContact O-N 2.74Å; D172-T186 PolarHBondContact O-OG1 3.29Å
173	S	98.1	Very high	89.5	Confident	9 Å²	9	70.9 Å²	70.9	6%	0.063	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	157.4	175.6	62	0	0	0	0	113.5	N146 V184	N146-S173 WeakPolarHBondContact CB-OG 3.4Å; N146-S173 PolarHBondContact N-O 3.38Å; N146-S173 PolarHBondContact ND2-OG 3.19Å; N146-S173 PolarHBondContact O-N 2.98Å; S173-V184 CarbonylContact C-O 3.55Å; S173-V184 WeakPolarHBondContact CA-O 3.26Å; S173-V184 WeakPolarHBondContact CB-O 3.13Å
174	V	98.2	Very high	91.7	Very high	17 Å²	17	69.4 Å²	69.4	10%	0.103	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	131.9	178.2	-172.3	0	0	0	0	110.6	V144 F145 V171 F183 V184 T186 F189	V144-V174 CarbonylContact O-C 3.53Å; V144-V174 WeakPolarHBondContact O-CA 3.39Å; F145-V174 HydrophobicContact CD1-CB 4.5Å; F145-V174 HydrophobicContact CD1-CG1 4.1Å; F145-V174 HydrophobicContact CD1-CG2 3.78Å; F145-V174 HydrophobicContact CE1-CG1 3.87Å; F145-V174 HydrophobicContact CE1-CG2 4.04Å; V171-V174 HydrophobicContact CG1-CG2 4.02Å; V174-F183 WeakPolarHBondContact O-CA 3.16Å; V174-V184 PolarHBondContact N-O 2.94Å; V174-V184 PolarHBondContact O-N 2.8Å; V174-T186 HydrophobicContact CG2-CG2 4.03Å; V174-F189 HydrophobicContact CB-CZ 4.08Å; V174-F189 HydrophobicContact CG2-CE2 3.83Å; V174-F189 HydrophobicContact CG2-CZ 3.74Å
175	E	97.7	Very high	93.4	Very high	48 Å²	48	68.3 Å²	68.3	22%	0.224	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	145.9	171	-61.2	158.5	-142.8	0	0	111	R132 L143 V144 N146 F183	R132-E175 IonicContact NH2-OE2 3.48Å; L143-E175 WeakPolarHBondContact CA-O 3.26Å; V144-E175 HydrophobicContact CB-CB 4.1Å; V144-E175 PolarHBondContact N-O 3.14Å; V144-E175 PolarHBondContact O-N 3.03Å; N146-E175 PolarHBondContact ND2-OE1 3.07Å; E175-F183 HydrophobicContact CG-CB 3.44Å; E175-F183 VanDerWaalsContact CG-CB 3.44Å
176	V	96.7	Very high	94.4	Very high	63 Å²	63	65.3 Å²	65.3	38%	0.382	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	113.4	166.8	-174.7	0	0	0	0	107.1	L143 R178 I179	L143-V176 HydrophobicContact CD2-CB 4.28Å; L143-V176 HydrophobicContact CD2-CG1 4.29Å; L143-V176 HydrophobicContact CD2-CG2 3.71Å; V176-R178 HydrophobicContact CG1-CB 4.42Å; V176-R178 PolarHBondContact O-N 3.2Å; V176-I179 PolarHBondContact O-N 2.8Å
177	E	92.6	Very high	95	Very high	93 Å²	93	68 Å²	68	44%	0.435	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-23.5	-172.1	-173.1	174.4	-143.9	0	0	113.6	K134 S142 I179	K134-E177 WeakPolarHBondContact CE-OE2 3.42Å; K134-E177 IonicContact NZ-OE1 2.66Å; K134-E177 PolarHBondContact NZ-OE1 2.8Å; K134-E177 IonicContact NZ-OE2 3.45Å; K134-E177 PolarHBondContact NZ-OE2 2.97Å; K134-E177 VanDerWaalsContact NZ-OE2 3.09Å; S142-E177 WeakPolarHBondContact CB-OE2 3.44Å; S142-E177 PolarHBondContact O-N 2.83Å; S142-E177 PolarHBondContact OG-OE2 3.24Å; E177-I179 PolarHBondContact O-N 2.84Å
178	R	92.3	Very high	95.6	Very high	170 Å²	170	73.7 Å²	73.7	64%	0.642	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-6.8	174.8	-75.4	-166	173.8	-177.4	3.9	114.9	V176	V176-R178 HydrophobicContact CG1-CB 4.42Å; V176-R178 PolarHBondContact O-N 3.2Å
179	I	95.3	Very high	96	Very high	93 Å²	93	72.3 Å²	72.3	48%	0.477	38%	0.377	S	S	.	.	S	Bend	trans	-121.3	80.8	175.2	-49.5	177.9	0	0	0	107	V176 E177 G181 Y182	V176-I179 PolarHBondContact O-N 2.8Å; E177-I179 PolarHBondContact O-N 2.84Å; I179-G181 PolarHBondContact O-N 2.99Å; I179-Y182 HydrophobicContact CG2-CD1 4.47Å; I179-Y182 HydrophobicContact CG2-CG 4.27Å; I179-Y182 PolarHBondContact O-N 2.95Å
180	P	91.7	Very high	96.2	Very high	121 Å²	121	76.8 Å²	76.8	79%	0.786	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	130	-169.3	-24.9	34.9	0	0	0	112.8	Y182	P180-Y182 VanDerWaalsContact C-N 3.26Å; P180-Y182 PolarHBondContact O-N 2.83Å
181	G	92.3	Very high	96.3	Very high	79 Å²	79	81 Å²	81	81%	0.814	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	0.9	176.5	0	0	0	0	0	115.3	I179	I179-G181 PolarHBondContact O-N 2.99Å
182	Y	97	Very high	96.3	Very high	141 Å²	141	86.4 Å²	86.4	55%	0.553	45%	0.45	S	S	*	.			trans	-98.7	125.7	174.6	-171.8	-101.6	0	0	0	111	I179 P180 V184	I179-Y182 HydrophobicContact CG2-CD1 4.47Å; I179-Y182 HydrophobicContact CG2-CG 4.27Å; I179-Y182 PolarHBondContact O-N 2.95Å; P180-Y182 VanDerWaalsContact C-N 3.26Å; P180-Y182 PolarHBondContact O-N 2.83Å; Y182-V184 HydrophobicContact CD1-CG2 4.22Å; Y182-V184 HydrophobicContact CE1-CG2 3.33Å
183	F	97.2	Very high	96.3	Very high	90 Å²	90	88.1 Å²	88.1	40%	0.395	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	157.2	171.6	66.5	-88.7	0	0	0	109.4	V174 E175 Y185	V174-F183 WeakPolarHBondContact O-CA 3.16Å; E175-F183 HydrophobicContact CG-CB 3.44Å; E175-F183 VanDerWaalsContact CG-CB 3.44Å; F183-Y185 HydrophobicContact CE2-CD1 4.43Å; F183-Y185 HydrophobicContact CE2-CD2 4.15Å; F183-Y185 AromaticContact CE2-CE1 3.92Å; F183-Y185 HydrophobicContact CE2-CE1 3.92Å; F183-Y185 AromaticContact CE2-CE2 3.62Å; F183-Y185 HydrophobicContact CE2-CE2 3.62Å; F183-Y185 AromaticContact CE2-CZ 3.49Å; F183-Y185 VanDerWaalsContact CE2-CZ 3.49Å; F183-Y185 HydrophobicContact CZ-CE2 4.32Å
184	V	97.9	Very high	96.2	Very high	36 Å²	36	90.9 Å²	90.9	22%	0.218	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	127.4	175.4	-174.3	0	0	0	0	108	S173 V174 Y182 L188 F189	S173-V184 CarbonylContact C-O 3.55Å; S173-V184 WeakPolarHBondContact CA-O 3.26Å; S173-V184 WeakPolarHBondContact CB-O 3.13Å; V174-V184 PolarHBondContact N-O 2.94Å; V174-V184 PolarHBondContact O-N 2.8Å; Y182-V184 HydrophobicContact CD1-CG2 4.22Å; Y182-V184 HydrophobicContact CE1-CG2 3.33Å; V184-L188 HydrophobicContact CG1-CB 4.22Å; V184-L188 HydrophobicContact CG1-CD1 4.15Å; V184-F189 HydrophobicContact CB-CE1 4.15Å; V184-F189 HydrophobicContact CG1-CD1 4.33Å; V184-F189 HydrophobicContact CG1-CE1 3.75Å
185	Y	98.2	Very high	96.1	Very high	131 Å²	131	94.6 Å²	94.6	51%	0.514	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	136.5	168.9	-68.4	-71.2	0	0	0	109.9	D172 F183 D187 L188	D172-Y185 WeakPolarHBondContact O-CA 3.33Å; F183-Y185 HydrophobicContact CE2-CD1 4.43Å; F183-Y185 HydrophobicContact CE2-CD2 4.15Å; F183-Y185 AromaticContact CE2-CE1 3.92Å; F183-Y185 HydrophobicContact CE2-CE1 3.92Å; F183-Y185 AromaticContact CE2-CE2 3.62Å; F183-Y185 HydrophobicContact CE2-CE2 3.62Å; F183-Y185 AromaticContact CE2-CZ 3.49Å; F183-Y185 VanDerWaalsContact CE2-CZ 3.49Å; F183-Y185 HydrophobicContact CZ-CE2 4.32Å; Y185-D187 PolarHBondContact O-N 3.04Å; Y185-L188 WeakPolarHBondContact O-CB 3.46Å; Y185-L188 PolarHBondContact O-N 2.92Å; Y185-L188 VanDerWaalsContact O-N 3.1Å
186	T	97.4	Very high	96	Very high	10 Å²	10	98.2 Å²	98.2	6%	0.061	50%	0.502	C	S	.	.	G	3₁₀ helix	trans	-68.5	-20	-179.7	48.9	0	0	0	0	113.2	V171 D172 V174 L188 F189 Y194	V171-T186 HydrophobicContact CB-CG2 4.18Å; V171-T186 HydrophobicContact CG1-CG2 3.73Å; V171-T186 VanDerWaalsContact O-CB 3.26Å; V171-T186 WeakPolarHBondContact O-CB 3.36Å; V171-T186 WeakPolarHBondContact O-CG2 3.17Å; V171-T186 PolarHBondContact O-OG1 3.13Å; D172-T186 PolarHBondContact O-N 2.74Å; D172-T186 PolarHBondContact O-OG1 3.29Å; V174-T186 HydrophobicContact CG2-CG2 4.03Å; T186-L188 PolarHBondContact O-N 3.47Å; T186-F189 HydrophobicContact CG2-CD2 4.11Å; T186-F189 HydrophobicContact CG2-CE2 3.89Å; T186-F189 HydrophobicContact CG2-CZ 4.35Å; T186-F189 VanDerWaalsContact O-CB 3.26Å; T186-F189 WeakPolarHBondContact O-CB 3.35Å; T186-F189 PolarHBondContact O-N 3.23Å; T186-Y194 HydrophobicContact CG2-CD2 4.32Å; T186-Y194 HydrophobicContact CG2-CE2 4.29Å
187	D	96.9	Very high	96	Very high	153 Å²	153	96.1 Å²	96.1	82%	0.818	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-56.2	-18.5	168	-69.3	0.4	0	0	0	113.5	Y185	Y185-D187 PolarHBondContact O-N 3.04Å
188	L	97.4	Very high	96.1	Very high	133 Å²	133	92.5 Å²	92.5	70%	0.696	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-92.2	-5.2	175.6	-59.8	175.3	0	0	0	113.2	V184 Y185 T186	V184-L188 HydrophobicContact CG1-CB 4.22Å; V184-L188 HydrophobicContact CG1-CD1 4.15Å; Y185-L188 WeakPolarHBondContact O-CB 3.46Å; Y185-L188 PolarHBondContact O-N 2.92Å; Y185-L188 VanDerWaalsContact O-N 3.1Å; T186-L188 PolarHBondContact O-N 3.47Å
189	F	97.4	Very high	96.3	Very high	30 Å²	30	88.9 Å²	88.9	13%	0.132	46%	0.463	C	S	.	.	S	Bend	trans	-79	151	174	-66.4	2.7	0	0	0	109.3	V174 V184 T186 M193	V174-F189 HydrophobicContact CB-CZ 4.08Å; V174-F189 HydrophobicContact CG2-CE2 3.83Å; V174-F189 HydrophobicContact CG2-CZ 3.74Å; V184-F189 HydrophobicContact CB-CE1 4.15Å; V184-F189 HydrophobicContact CG1-CD1 4.33Å; V184-F189 HydrophobicContact CG1-CE1 3.75Å; T186-F189 HydrophobicContact CG2-CD2 4.11Å; T186-F189 HydrophobicContact CG2-CE2 3.89Å; T186-F189 HydrophobicContact CG2-CZ 4.35Å; T186-F189 VanDerWaalsContact O-CB 3.26Å; T186-F189 WeakPolarHBondContact O-CB 3.35Å; T186-F189 PolarHBondContact O-N 3.23Å; F189-M193 HydrophobicContact CB-CB 4.16Å; F189-M193 HydrophobicContact CB-CG 4.13Å; F189-M193 HydrophobicContact CB-SD 4Å; F189-M193 HydrophobicContact CD1-CE 3.46Å; F189-M193 VanDerWaalsContact CD1-CE 3.46Å; F189-M193 HydrophobicContact CD1-CG 4.48Å; F189-M193 HydrophobicContact CD1-SD 3.57Å; F189-M193 VanDerWaalsContact CD1-SD 3.57Å; F189-M193 HydrophobicContact CD2-CE 3.7Å; F189-M193 HydrophobicContact CD2-CG 3.76Å; F189-M193 HydrophobicContact CD2-SD 3.92Å; F189-M193 HydrophobicContact CE1-CE 3.2Å; F189-M193 HydrophobicContact CE1-SD 3.99Å; F189-M193 HydrophobicContact CE2-CE 3.44Å; F189-M193 VanDerWaalsContact CE2-CE 3.44Å; F189-M193 HydrophobicContact CE2-CG 4.27Å; F189-M193 HydrophobicContact CE2-SD 4.29Å; F189-M193 HydrophobicContact CG-CB 4.45Å; F189-M193 HydrophobicContact CG-CE 3.72Å; F189-M193 HydrophobicContact CG-CG 3.88Å; F189-M193 HydrophobicContact CG-SD 3.55Å; F189-M193 VanDerWaalsContact CG-SD 3.55Å; F189-M193 HydrophobicContact CZ-CE 3.19Å; F189-M193 HydrophobicContact CZ-SD 4.33Å
190	D	97.3	Very high	96.4	Very high	101 Å²	101	87.1 Å²	87.1	54%	0.54	45%	0.454	S	S	.	.			trans	-76	162.5	160.7	59.1	44.5	0	0	0	110.2	D192 M193 Y194	D190-D192 PolarHBondContact O-N 3.4Å; D190-D192 PolarHBondContact OD1-N 3.32Å; D190-M193 PolarHBondContact O-N 2.82Å; D190-M193 VanDerWaalsContact O-N 3.16Å; D190-M193 WeakPolarHBondContact OD1-CB 3.43Å; D190-M193 PolarHBondContact OD1-N 3.04Å; D190-Y194 PolarHBondContact O-N 3.25Å
191	D	95.4	Very high	96.6	Very high	131 Å²	131	81.3 Å²	81.3	70%	0.701	42%	0.417	S	S	*	.	H	α-helix	trans	-55.9	-38.6	-176.9	-61.1	-17.2	0	0	0	111.9	Y194 N195	D191-Y194 PolarHBondContact O-N 3.2Å; D191-N195 VanDerWaalsContact O-CB 3.27Å; D191-N195 WeakPolarHBondContact O-CB 3.47Å; D191-N195 PolarHBondContact O-N 2.82Å; D191-N195 PolarHBondContact O-ND2 3.33Å
192	D	96.9	Very high	96.8	Very high	115 Å²	115	79.1 Å²	79.1	62%	0.615	39%	0.387	S	S	*	.	H	α-helix	trans	-65.1	-44.7	-179.9	-74.7	-20.4	0	0	0	111.5	D190 N195 H196	D190-D192 PolarHBondContact O-N 3.4Å; D190-D192 PolarHBondContact OD1-N 3.32Å; D192-N195 PolarHBondContact O-N 2.92Å; D192-H196 PolarHBondContact O-CD2 2.84Å; D192-H196 PolarHBondContact O-N 3.2Å
193	M	97.6	Very high	96.7	Very high	87 Å²	87	78.7 Å²	78.7	43%	0.429	39%	0.391	S	S	.	.	H	α-helix	trans	-65.8	-40.6	177.1	-179	-178.7	172.9	0	0	111.6	F189 D190 T197	F189-M193 HydrophobicContact CB-CB 4.16Å; F189-M193 HydrophobicContact CB-CG 4.13Å; F189-M193 HydrophobicContact CB-SD 4Å; F189-M193 HydrophobicContact CD1-CE 3.46Å; F189-M193 VanDerWaalsContact CD1-CE 3.46Å; F189-M193 HydrophobicContact CD1-CG 4.48Å; F189-M193 HydrophobicContact CD1-SD 3.57Å; F189-M193 VanDerWaalsContact CD1-SD 3.57Å; F189-M193 HydrophobicContact CD2-CE 3.7Å; F189-M193 HydrophobicContact CD2-CG 3.76Å; F189-M193 HydrophobicContact CD2-SD 3.92Å; F189-M193 HydrophobicContact CE1-CE 3.2Å; F189-M193 HydrophobicContact CE1-SD 3.99Å; F189-M193 HydrophobicContact CE2-CE 3.44Å; F189-M193 VanDerWaalsContact CE2-CE 3.44Å; F189-M193 HydrophobicContact CE2-CG 4.27Å; F189-M193 HydrophobicContact CE2-SD 4.29Å; F189-M193 HydrophobicContact CG-CB 4.45Å; F189-M193 HydrophobicContact CG-CE 3.72Å; F189-M193 HydrophobicContact CG-CG 3.88Å; F189-M193 HydrophobicContact CG-SD 3.55Å; F189-M193 VanDerWaalsContact CG-SD 3.55Å; F189-M193 HydrophobicContact CZ-CE 3.19Å; F189-M193 HydrophobicContact CZ-SD 4.33Å; D190-M193 PolarHBondContact O-N 2.82Å; D190-M193 VanDerWaalsContact O-N 3.16Å; D190-M193 WeakPolarHBondContact OD1-CB 3.43Å; D190-M193 PolarHBondContact OD1-N 3.04Å; M193-T197 WeakPolarHBondContact O-CB 3.31Å; M193-T197 PolarHBondContact O-N 2.92Å; M193-T197 PolarHBondContact O-OG1 3.01Å
194	Y	97	Very high	96.7	Very high	67 Å²	67	76.3 Å²	76.3	26%	0.263	38%	0.379	S	S	.	.	H	α-helix	trans	-63	-48.3	174.1	-172.6	-94.3	0	0	0	111.3	V171 T186 D190 D191 H196 T197 M198	V171-Y194 HydrophobicContact CB-CE2 4.41Å; V171-Y194 PolarHBondContact N-OH 2.7Å; T186-Y194 HydrophobicContact CG2-CD2 4.32Å; T186-Y194 HydrophobicContact CG2-CE2 4.29Å; D190-Y194 PolarHBondContact O-N 3.25Å; D191-Y194 PolarHBondContact O-N 3.2Å; Y194-H196 PolarHBondContact O-N 3.31Å; Y194-T197 WeakPolarHBondContact O-CA 3.41Å; Y194-T197 VanDerWaalsContact O-CB 3.29Å; Y194-T197 WeakPolarHBondContact O-CB 3.4Å; Y194-T197 PolarHBondContact O-N 3.09Å; Y194-M198 HydrophobicContact CD1-CG 4.04Å; Y194-M198 HydrophobicContact CE1-CG 3.6Å; Y194-M198 HydrophobicContact CE1-SD 4.31Å; Y194-M198 PolarHBondContact O-N 3.28Å
195	N	94.9	Very high	96.5	Very high	94 Å²	94	75.9 Å²	75.9	50%	0.503	38%	0.381	S	S	.	.	H	α-helix	trans	-58.3	-45	178.5	-73.3	-27.3	0	0	0	112.3	D191 D192 T197 M198 Q199	D191-N195 VanDerWaalsContact O-CB 3.27Å; D191-N195 WeakPolarHBondContact O-CB 3.47Å; D191-N195 PolarHBondContact O-N 2.82Å; D191-N195 PolarHBondContact O-ND2 3.33Å; D192-N195 PolarHBondContact O-N 2.92Å; N195-T197 VanDerWaalsContact C-N 3.29Å; N195-T197 PolarHBondContact O-N 3.01Å; N195-M198 PolarHBondContact O-N 3.16Å; N195-Q199 WeakPolarHBondContact O-CB 3.37Å; N195-Q199 PolarHBondContact O-N 2.85Å
196	H	96.4	Very high	96.5	Very high	124 Å²	124	69.6 Å²	69.6	57%	0.574	36%	0.357	S	S	*	.	H	α-helix	trans	-67	-30.1	175.3	-76	-48.5	0	0	0	113.3	D192 Y194 Q199 L200	D192-H196 PolarHBondContact O-CD2 2.84Å; D192-H196 PolarHBondContact O-N 3.2Å; Y194-H196 PolarHBondContact O-N 3.31Å; H196-Q199 PolarHBondContact ND1-OE1 2.85Å; H196-L200 WeakPolarHBondContact O-CB 3.31Å; H196-L200 PolarHBondContact O-N 3.03Å
197	T	96.8	Very high	96.3	Very high	19 Å²	19	70.5 Å²	70.5	12%	0.117	36%	0.361	C	S	.	.	H	α-helix	trans	-66.2	-47.7	173.2	-62.3	0	0	0	0	110.9	F145 M193 Y194 N195 Q199 L200 L201	F145-T197 HydrophobicContact CD1-CG2 3.93Å; F145-T197 HydrophobicContact CE1-CG2 3.57Å; M193-T197 WeakPolarHBondContact O-CB 3.31Å; M193-T197 PolarHBondContact O-N 2.92Å; M193-T197 PolarHBondContact O-OG1 3.01Å; Y194-T197 WeakPolarHBondContact O-CA 3.41Å; Y194-T197 VanDerWaalsContact O-CB 3.29Å; Y194-T197 WeakPolarHBondContact O-CB 3.4Å; Y194-T197 PolarHBondContact O-N 3.09Å; N195-T197 VanDerWaalsContact C-N 3.29Å; N195-T197 PolarHBondContact O-N 3.01Å; T197-Q199 PolarHBondContact O-N 2.84Å; T197-L200 WeakPolarHBondContact O-CB 3.14Å; T197-L200 PolarHBondContact O-N 2.71Å; T197-L201 PolarHBondContact O-N 3.45Å
198	M	95.8	Very high	96.2	Very high	17 Å²	17	64.6 Å²	64.6	8%	0.084	33%	0.334	C	S	.	.	H	α-helix	trans	-62.6	-42.5	175.3	-67.4	-53.9	-66	0	0	112	P167 Y169 V171 Y194 N195 L200 L201 V202	P167-M198 HydrophobicContact CG-CE 3.82Å; Y169-M198 HydrophobicContact CD2-CE 4.41Å; Y169-M198 HydrophobicContact CE2-CE 3.86Å; V171-M198 HydrophobicContact CB-SD 4.4Å; V171-M198 HydrophobicContact CG2-SD 3.51Å; V171-M198 VanDerWaalsContact CG2-SD 3.51Å; Y194-M198 HydrophobicContact CD1-CG 4.04Å; Y194-M198 HydrophobicContact CE1-CG 3.6Å; Y194-M198 HydrophobicContact CE1-SD 4.31Å; Y194-M198 PolarHBondContact O-N 3.28Å; N195-M198 PolarHBondContact O-N 3.16Å; M198-L200 VanDerWaalsContact C-N 3.3Å; M198-L200 PolarHBondContact O-N 3.1Å; M198-L201 PolarHBondContact O-N 3.33Å; M198-L201 VanDerWaalsContact O-N 3.1Å; M198-L201 HydrophobicContact SD-CD1 4.31Å; M198-V202 WeakPolarHBondContact O-CG2 3.11Å; M198-V202 PolarHBondContact O-N 3.27Å
199	Q	95.6	Very high	96	Very high	95 Å²	95	63.2 Å²	63.2	44%	0.444	33%	0.327	S	S	.	.	H	α-helix	trans	-59.2	-41.1	176.2	-174.1	179.2	5.2	0	0	111.9	N195 H196 T197 L201 V202 E203	N195-Q199 WeakPolarHBondContact O-CB 3.37Å; N195-Q199 PolarHBondContact O-N 2.85Å; H196-Q199 PolarHBondContact ND1-OE1 2.85Å; T197-Q199 PolarHBondContact O-N 2.84Å; Q199-L201 VanDerWaalsContact C-N 3.3Å; Q199-L201 PolarHBondContact O-N 2.71Å; Q199-V202 PolarHBondContact O-N 3.49Å; Q199-E203 HydrophobicContact CG-CG 4.46Å; Q199-E203 PolarHBondContact NE2-OE1 2.87Å; Q199-E203 WeakPolarHBondContact O-CB 3.45Å; Q199-E203 WeakPolarHBondContact O-CG 3.3Å; Q199-E203 PolarHBondContact O-N 3.21Å
200	L	96.5	Very high	96	Very high	55 Å²	55	62.1 Å²	62.1	29%	0.288	32%	0.322	S	S	.	.	H	α-helix	trans	-59.1	-40.5	175.4	174.4	66	0	0	0	111.8	L135 L143 F145 H196 T197 M198 R204	L135-L200 HydrophobicContact CD1-CD1 4.5Å; L135-L200 HydrophobicContact CD1-CD2 3.98Å; L135-L200 HydrophobicContact CD1-CG 3.96Å; L143-L200 HydrophobicContact CD1-CD2 4.34Å; F145-L200 HydrophobicContact CZ-CD2 4.13Å; H196-L200 WeakPolarHBondContact O-CB 3.31Å; H196-L200 PolarHBondContact O-N 3.03Å; T197-L200 WeakPolarHBondContact O-CB 3.14Å; T197-L200 PolarHBondContact O-N 2.71Å; M198-L200 VanDerWaalsContact C-N 3.3Å; M198-L200 PolarHBondContact O-N 3.1Å; L200-R204 VanDerWaalsContact O-CG 3.31Å; L200-R204 WeakPolarHBondContact O-CG 3.38Å; L200-R204 PolarHBondContact O-N 2.83Å
201	L	97.2	Very high	95.9	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-68.9	-44.8	177.5	-62.7	175.8	0	0	0	111.3	I133 L135 F145 Y169 V171 T197 M198 Q199 E203 R204 G205 L206	I133-L201 HydrophobicContact CG2-CD2 4.44Å; L135-L201 HydrophobicContact CD1-CD2 4.16Å; F145-L201 HydrophobicContact CD2-CD2 3.73Å; F145-L201 HydrophobicContact CE2-CD2 3.93Å; F145-L201 HydrophobicContact CG-CD2 4.06Å; F145-L201 HydrophobicContact CZ-CD2 4.4Å; Y169-L201 HydrophobicContact CE2-CD1 4.1Å; V171-L201 HydrophobicContact CG2-CD1 3.55Å; T197-L201 PolarHBondContact O-N 3.45Å; M198-L201 PolarHBondContact O-N 3.33Å; M198-L201 VanDerWaalsContact O-N 3.1Å; M198-L201 HydrophobicContact SD-CD1 4.31Å; Q199-L201 VanDerWaalsContact C-N 3.3Å; Q199-L201 PolarHBondContact O-N 2.71Å; L201-E203 PolarHBondContact O-N 2.56Å; L201-R204 CarbonylContact O-C 3.53Å; L201-R204 WeakPolarHBondContact O-CA 3.37Å; L201-R204 WeakPolarHBondContact O-CB 3.26Å; L201-R204 PolarHBondContact O-N 3.06Å; L201-G205 PolarHBondContact O-N 2.81Å; L201-L206 HydrophobicContact CB-CB 4.14Å; L201-L206 HydrophobicContact CB-CD1 4.01Å; L201-L206 HydrophobicContact CD2-CD1 3.63Å; L201-L206 HydrophobicContact CG-CD1 4.39Å; L201-L206 WeakPolarHBondContact O-CB 3.49Å; L201-L206 PolarHBondContact O-N 2.9Å; L201-L206 VanDerWaalsContact O-N 3.08Å
202	V	96	Very high	95.7	Very high	32 Å²	32	56.4 Å²	56.4	19%	0.194	29%	0.288	C	S	.	.	H	α-helix	trans	-62.5	-40.6	177.9	172.9	0	0	0	0	111.8	L166 P167 M198 Q199 R204 G205 N207	L166-V202 HydrophobicContact CD2-CG2 4.18Å; P167-V202 HydrophobicContact CG-CG2 4.47Å; M198-V202 WeakPolarHBondContact O-CG2 3.11Å; M198-V202 PolarHBondContact O-N 3.27Å; Q199-V202 PolarHBondContact O-N 3.49Å; V202-R204 PolarHBondContact O-N 3.42Å; V202-G205 WeakPolarHBondContact O-CA 3.36Å; V202-G205 PolarHBondContact O-N 3.05Å; V202-N207 HydrophobicContact CG1-CB 4.5Å
203	E	95.1	Very high	95.7	Very high	133 Å²	133	54.4 Å²	54.4	62%	0.621	28%	0.275	S	S	*	.	H	α-helix	trans	-62.2	-23.7	173.7	-77.9	-176.8	-175.8	0	0	112.7	Q199 L201 G205	Q199-E203 HydrophobicContact CG-CG 4.46Å; Q199-E203 PolarHBondContact NE2-OE1 2.87Å; Q199-E203 WeakPolarHBondContact O-CB 3.45Å; Q199-E203 WeakPolarHBondContact O-CG 3.3Å; Q199-E203 PolarHBondContact O-N 3.21Å; L201-E203 PolarHBondContact O-N 2.56Å; E203-G205 VanDerWaalsContact C-N 3.28Å
204	R	96.3	Very high	95.7	Very high	40 Å²	40	50.3 Å²	50.3	15%	0.151	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	14.3	171.4	-59.9	-65.2	169.8	176.1	-6.2	112.3	Y88 D90 V94 L135 L200 L201 V202 L206	Y88-R204 VanDerWaalsContact CZ-O 3.27Å; Y88-R204 PolarHBondContact OH-O 3.12Å; D90-R204 VanDerWaalsContact CG-NH1 3.33Å; D90-R204 IonicContact OD1-NH1 3.83Å; D90-R204 PolarHBondContact OD1-NH1 3.44Å; D90-R204 IonicContact OD2-CZ 3.93Å; D90-R204 VanDerWaalsContact OD2-CZ 3.27Å; D90-R204 IonicContact OD2-NH1 3.09Å; D90-R204 PolarHBondContact OD2-NH1 3.49Å; D90-R204 IonicContact OD2-NH2 2.61Å; D90-R204 PolarHBondContact OD2-NH2 2.99Å; V94-R204 HydrophobicContact CG2-CB 4.27Å; L135-R204 HydrophobicContact CD1-CG 4.42Å; L135-R204 HydrophobicContact CD2-CB 4.49Å; L135-R204 HydrophobicContact CD2-CG 4.25Å; L200-R204 VanDerWaalsContact O-CG 3.31Å; L200-R204 WeakPolarHBondContact O-CG 3.38Å; L200-R204 PolarHBondContact O-N 2.83Å; L201-R204 CarbonylContact O-C 3.53Å; L201-R204 WeakPolarHBondContact O-CA 3.37Å; L201-R204 WeakPolarHBondContact O-CB 3.26Å; L201-R204 PolarHBondContact O-N 3.06Å; V202-R204 PolarHBondContact O-N 3.42Å; R204-L206 VanDerWaalsContact C-N 3.29Å; R204-L206 PolarHBondContact O-N 2.92Å
205	G	95.5	Very high	95.5	Very high	26 Å²	26	47.7 Å²	47.7	27%	0.268	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.8	23.5	176.5	0	0	0	0	0	113.8	L201 V202 E203 N207 F210	L201-G205 PolarHBondContact O-N 2.81Å; V202-G205 WeakPolarHBondContact O-CA 3.36Å; V202-G205 PolarHBondContact O-N 3.05Å; E203-G205 VanDerWaalsContact C-N 3.28Å; G205-N207 PolarHBondContact O-N 2.85Å; G205-F210 VanDerWaalsContact O-CB 3.28Å; G205-F210 WeakPolarHBondContact O-CB 3.49Å
206	L	96.6	Very high	95.5	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.234	C	C	.	.			trans	-94.8	53.8	173	-55.9	167.9	0	0	0	109.6	F72 V94 I133 Y169 L201 R204 F210	F72-L206 HydrophobicContact CZ-CD2 3.96Å; V94-L206 HydrophobicContact CG1-CD1 4.25Å; V94-L206 HydrophobicContact CG1-CD2 4.2Å; I133-L206 HydrophobicContact CD1-CD1 4.15Å; I133-L206 HydrophobicContact CG2-CD1 3.73Å; Y169-L206 PolarHBondContact OH-O 3.01Å; L201-L206 HydrophobicContact CB-CB 4.14Å; L201-L206 HydrophobicContact CB-CD1 4.01Å; L201-L206 HydrophobicContact CD2-CD1 3.63Å; L201-L206 HydrophobicContact CG-CD1 4.39Å; L201-L206 WeakPolarHBondContact O-CB 3.49Å; L201-L206 PolarHBondContact O-N 2.9Å; L201-L206 VanDerWaalsContact O-N 3.08Å; R204-L206 VanDerWaalsContact C-N 3.29Å; R204-L206 PolarHBondContact O-N 2.92Å; L206-F210 HydrophobicContact CB-CD1 4.15Å; L206-F210 HydrophobicContact CB-CE1 4.43Å; L206-F210 HydrophobicContact CD2-CD1 3.79Å; L206-F210 HydrophobicContact CD2-CD2 4.14Å; L206-F210 HydrophobicContact CD2-CE1 3.49Å; L206-F210 VanDerWaalsContact CD2-CE1 3.49Å; L206-F210 HydrophobicContact CD2-CE2 3.86Å; L206-F210 HydrophobicContact CD2-CG 4.12Å; L206-F210 HydrophobicContact CD2-CZ 3.53Å
207	N	94.8	Very high	95.5	Very high	28 Å²	28	39.9 Å²	39.9	15%	0.15	21%	0.207	C	C	.	.	S	Bend	trans	-93.6	-171.3	-175.7	63.9	-9.9	0	0	0	112.1	N165 V202 G205 D209 F210 Q211	N165-N207 WeakPolarHBondContact O-CB 3.3Å; N165-N207 WeakPolarHBondContact OD1-CB 3.25Å; N165-N207 PolarHBondContact OD1-ND2 2.77Å; V202-N207 HydrophobicContact CG1-CB 4.5Å; G205-N207 PolarHBondContact O-N 2.85Å; N207-D209 VanDerWaalsContact C-N 3.35Å; N207-D209 PolarHBondContact O-N 2.84Å; N207-F210 PolarHBondContact O-N 2.74Å; N207-F210 PolarHBondContact OD1-N 2.86Å; N207-F210 VanDerWaalsContact OD1-N 3.09Å; N207-Q211 PolarHBondContact O-N 3.48Å
208	A	93.4	Very high	95.5	Very high	29 Å²	29	39 Å²	39	24%	0.24	20%	0.202	C	C	.	.	H	α-helix	trans	-57.5	-42.2	177.5	0	0	0	0	0	113.3	F210 Q211 Q212	A208-F210 PolarHBondContact O-N 2.96Å; A208-Q211 WeakPolarHBondContact O-CB 3.29Å; A208-Q211 PolarHBondContact O-N 3.13Å; A208-Q212 PolarHBondContact O-N 3.29Å
209	D	94.3	Very high	95.5	Very high	105 Å²	105	39.2 Å²	39.2	56%	0.561	21%	0.205	S	C	*	.	H	α-helix	trans	-61	-47.1	177.4	-65.2	-27.7	0	0	0	111.3	N207 Q211 Q212 E213	N207-D209 VanDerWaalsContact C-N 3.35Å; N207-D209 PolarHBondContact O-N 2.84Å; D209-Q211 VanDerWaalsContact C-N 3.3Å; D209-Q211 PolarHBondContact O-N 2.81Å; D209-Q212 PolarHBondContact O-N 3.5Å; D209-E213 WeakPolarHBondContact O-CG 3.44Å; D209-E213 PolarHBondContact O-N 3.16Å
210	F	96.2	Very high	95.5	Very high	7 Å²	7	34.7 Å²	34.7	3%	0.031	18%	0.183	C	C	.	.	H	α-helix	trans	-57.6	-43.2	174.7	165.4	-93.1	0	0	0	112	P69 F72 V96 G205 L206 N207 A208 Q212 E213 L214	P69-F210 HydrophobicContact CB-CD2 3.63Å; P69-F210 HydrophobicContact CB-CE2 3.89Å; P69-F210 HydrophobicContact CG-CD2 3.94Å; P69-F210 HydrophobicContact CG-CE2 3.81Å; F72-F210 HydrophobicContact CD2-CD2 4.19Å; F72-F210 AromaticContact CD2-CE2 3.98Å; F72-F210 HydrophobicContact CD2-CE2 3.98Å; F72-F210 HydrophobicContact CE1-CE2 4.29Å; F72-F210 AromaticContact CE2-CD2 3.63Å; F72-F210 HydrophobicContact CE2-CD2 3.63Å; F72-F210 AromaticContact CE2-CE2 3.49Å; F72-F210 HydrophobicContact CE2-CE2 3.49Å; F72-F210 VanDerWaalsContact CE2-CE2 3.49Å; F72-F210 HydrophobicContact CZ-CD2 4.18Å; F72-F210 AromaticContact CZ-CE2 3.67Å; F72-F210 HydrophobicContact CZ-CE2 3.67Å; F72-F210 HydrophobicContact CZ-CZ 4.43Å; V96-F210 HydrophobicContact CG2-CZ 4.01Å; G205-F210 VanDerWaalsContact O-CB 3.28Å; G205-F210 WeakPolarHBondContact O-CB 3.49Å; L206-F210 HydrophobicContact CB-CD1 4.15Å; L206-F210 HydrophobicContact CB-CE1 4.43Å; L206-F210 HydrophobicContact CD2-CD1 3.79Å; L206-F210 HydrophobicContact CD2-CD2 4.14Å; L206-F210 HydrophobicContact CD2-CE1 3.49Å; L206-F210 VanDerWaalsContact CD2-CE1 3.49Å; L206-F210 HydrophobicContact CD2-CE2 3.86Å; L206-F210 HydrophobicContact CD2-CG 4.12Å; L206-F210 HydrophobicContact CD2-CZ 3.53Å; N207-F210 PolarHBondContact O-N 2.74Å; N207-F210 PolarHBondContact OD1-N 2.86Å; N207-F210 VanDerWaalsContact OD1-N 3.09Å; A208-F210 PolarHBondContact O-N 2.96Å; F210-Q212 PolarHBondContact O-N 2.85Å; F210-E213 PolarHBondContact O-N 2.92Å; F210-L214 HydrophobicContact CE1-CB 4.4Å; F210-L214 HydrophobicContact CE1-CD2 3.76Å; F210-L214 HydrophobicContact CZ-CB 4.3Å; F210-L214 HydrophobicContact CZ-CD1 4.49Å; F210-L214 HydrophobicContact CZ-CD2 3.73Å; F210-L214 HydrophobicContact CZ-CG 4.4Å; F210-L214 WeakPolarHBondContact O-CB 3.42Å; F210-L214 PolarHBondContact O-N 2.82Å
211	Q	95	Very high	95.5	Very high	15 Å²	15	33.5 Å²	33.5	7%	0.07	18%	0.176	C	C	.	.	H	α-helix	trans	-59.4	-47.5	178.3	178.9	-175.1	-33.8	0	0	111.2	L149 T168 Y169 N207 A208 D209 L214 Q215	L149-Q211 HydrophobicContact CD2-CG 3.81Å; T168-Q211 PolarHBondContact OG1-NE2 2.9Å; T168-Q211 PolarHBondContact OG1-OE1 2.61Å; Y169-Q211 HydrophobicContact CD1-CB 4.26Å; Y169-Q211 HydrophobicContact CD1-CG 4.24Å; Y169-Q211 VanDerWaalsContact N-OE1 3.14Å; N207-Q211 PolarHBondContact O-N 3.48Å; A208-Q211 WeakPolarHBondContact O-CB 3.29Å; A208-Q211 PolarHBondContact O-N 3.13Å; D209-Q211 VanDerWaalsContact C-N 3.3Å; D209-Q211 PolarHBondContact O-N 2.81Å; Q211-L214 PolarHBondContact O-N 2.66Å; Q211-Q215 WeakPolarHBondContact O-CB 3.44Å; Q211-Q215 PolarHBondContact O-N 2.88Å
212	Q	92.9	Very high	95.4	Very high	97 Å²	97	35.9 Å²	35.9	45%	0.453	19%	0.188	S	C	.	.	H	α-helix	trans	-64.7	-43.1	-179.8	-176.1	62.6	82.4	0	0	112.1	A208 D209 F210 L214 Q215 N216	A208-Q212 PolarHBondContact O-N 3.29Å; D209-Q212 PolarHBondContact O-N 3.5Å; F210-Q212 PolarHBondContact O-N 2.85Å; Q212-L214 VanDerWaalsContact C-N 3.32Å; Q212-Q215 PolarHBondContact O-N 2.79Å; Q212-N216 PolarHBondContact O-N 3.38Å; Q212-N216 VanDerWaalsContact O-N 3.12Å; Q212-N216 PolarHBondContact O-ND2 3.22Å
213	E	95.9	Very high	95.3	Very high	73 Å²	73	35.4 Å²	35.4	34%	0.341	18%	0.183	S	C	.	.	H	α-helix	trans	-62.1	-41.9	174.8	-71.3	-179.4	172.1	0	0	111.4	P69 E70 D209 F210 N216 F217	P69-E213 WeakPolarHBondContact CA-OE2 3.45Å; P69-E213 HydrophobicContact CB-CB 3.91Å; P69-E213 WeakPolarHBondContact CB-OE2 3.46Å; P69-E213 HydrophobicContact CG-CB 3.95Å; E70-E213 PolarHBondContact N-OE2 2.99Å; D209-E213 WeakPolarHBondContact O-CG 3.44Å; D209-E213 PolarHBondContact O-N 3.16Å; F210-E213 PolarHBondContact O-N 2.92Å; E213-N216 PolarHBondContact O-N 3.02Å; E213-F217 WeakPolarHBondContact O-CB 3.32Å; E213-F217 PolarHBondContact O-N 3.28Å
214	L	96.7	Very high	95.3	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-65.3	-43.7	179.6	-179.8	65	0	0	0	111.2	P69 I84 V96 I98 L131 F210 Q211 Q212 F217 C218	P69-L214 HydrophobicContact CG-CB 3.97Å; P69-L214 HydrophobicContact CG-CD1 4.29Å; I84-L214 HydrophobicContact CD1-CD1 3.87Å; V96-L214 HydrophobicContact CG1-CD2 4.36Å; I98-L214 HydrophobicContact CD1-CD1 3.74Å; L131-L214 HydrophobicContact CD1-CD2 3.43Å; L131-L214 VanDerWaalsContact CD1-CD2 3.43Å; L131-L214 HydrophobicContact CD2-CD2 3.92Å; L131-L214 HydrophobicContact CG-CD2 4.33Å; F210-L214 HydrophobicContact CE1-CB 4.4Å; F210-L214 HydrophobicContact CE1-CD2 3.76Å; F210-L214 HydrophobicContact CZ-CB 4.3Å; F210-L214 HydrophobicContact CZ-CD1 4.49Å; F210-L214 HydrophobicContact CZ-CD2 3.73Å; F210-L214 HydrophobicContact CZ-CG 4.4Å; F210-L214 WeakPolarHBondContact O-CB 3.42Å; F210-L214 PolarHBondContact O-N 2.82Å; Q211-L214 PolarHBondContact O-N 2.66Å; Q212-L214 VanDerWaalsContact C-N 3.32Å; L214-F217 HydrophobicContact CD1-CD1 4.4Å; L214-F217 WeakPolarHBondContact O-CB 3.42Å; L214-F217 PolarHBondContact O-N 3.49Å; L214-C218 WeakPolarHBondContact O-CB 3.5Å; L214-C218 PolarHBondContact O-N 3.42Å; L214-C218 PolarHBondContact O-SG 2.76Å
215	Q	94.1	Very high	95.3	Very high	12 Å²	12	32.9 Å²	32.9	6%	0.056	17%	0.173	C	C	.	.	H	α-helix	trans	-61.6	-46.2	177.6	-168.4	-171.1	16.1	0	0	111	E126 H128 Q211 Q212 F217 C218 T219	E126-Q215 PolarHBondContact OE2-NE2 2.93Å; H128-Q215 PolarHBondContact CE1-NE2 2.74Å; H128-Q215 PolarHBondContact NE2-NE2 3.35Å; Q211-Q215 WeakPolarHBondContact O-CB 3.44Å; Q211-Q215 PolarHBondContact O-N 2.88Å; Q212-Q215 PolarHBondContact O-N 2.79Å; Q215-F217 VanDerWaalsContact C-N 3.32Å; Q215-F217 PolarHBondContact O-N 3.04Å; Q215-C218 PolarHBondContact O-N 2.81Å; Q215-T219 PolarHBondContact O-N 3.04Å; Q215-T219 PolarHBondContact O-OG1 3.2Å
216	N	94.4	Very high	95.3	Very high	51 Å²	51	34.7 Å²	34.7	27%	0.273	17%	0.172	S	C	.	.	H	α-helix	trans	-60.4	-41.8	175	-73.4	-41.1	0	0	0	112	F64 C66 Q212 E213 S220	F64-N216 HydrophobicContact CE1-CB 4.44Å; F64-N216 WeakPolarHBondContact CE1-O 3.39Å; F64-N216 HydrophobicContact CZ-CB 4.38Å; C66-N216 HydrophobicContact CB-CB 4.27Å; C66-N216 WeakPolarHBondContact CB-O 3.43Å; C66-N216 VanDerWaalsContact SG-CB 3.53Å; Q212-N216 PolarHBondContact O-N 3.38Å; Q212-N216 VanDerWaalsContact O-N 3.12Å; Q212-N216 PolarHBondContact O-ND2 3.22Å; E213-N216 PolarHBondContact O-N 3.02Å; N216-S220 WeakPolarHBondContact O-CB 3.36Å; N216-S220 PolarHBondContact O-N 3.01Å
217	F	97.1	Very high	95.2	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.009	18%	0.178	C	C	.	.	H	α-helix	trans	-61.4	-47.4	174.7	175.6	-109.5	0	0	0	111.9	P68 V74 I82 I84 I98 E213 L214 Q215 T219 S220 E221	P68-F217 HydrophobicContact CB-CD2 4.38Å; P68-F217 HydrophobicContact CB-CE2 4.32Å; P68-F217 HydrophobicContact CG-CD2 4.11Å; P68-F217 HydrophobicContact CG-CE2 3.68Å; P68-F217 HydrophobicContact CG-CZ 4.03Å; V74-F217 HydrophobicContact CG2-CE2 4.48Å; V74-F217 HydrophobicContact CG2-CZ 4Å; I82-F217 HydrophobicContact CG2-CE1 4.19Å; I82-F217 HydrophobicContact CG2-CZ 4.32Å; I84-F217 HydrophobicContact CG2-CE1 3.87Å; I84-F217 HydrophobicContact CG2-CZ 4.23Å; I98-F217 HydrophobicContact CD1-CD1 4.46Å; I98-F217 HydrophobicContact CD1-CE1 4.29Å; E213-F217 WeakPolarHBondContact O-CB 3.32Å; E213-F217 PolarHBondContact O-N 3.28Å; L214-F217 HydrophobicContact CD1-CD1 4.4Å; L214-F217 WeakPolarHBondContact O-CB 3.42Å; L214-F217 PolarHBondContact O-N 3.49Å; Q215-F217 VanDerWaalsContact C-N 3.32Å; Q215-F217 PolarHBondContact O-N 3.04Å; F217-T219 PolarHBondContact O-N 3.26Å; F217-S220 WeakPolarHBondContact O-CB 3.28Å; F217-S220 PolarHBondContact O-N 3.39Å; F217-E221 HydrophobicContact CD2-CG 4.15Å; F217-E221 HydrophobicContact CE1-CG 4.07Å; F217-E221 HydrophobicContact CE2-CG 3.61Å; F217-E221 HydrophobicContact CZ-CG 3.57Å; F217-E221 WeakPolarHBondContact O-CG 3.27Å; F217-E221 PolarHBondContact O-N 3.31Å
218	C	96.3	Very high	95.3	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.007	20%	0.198	C	C	.	.	H	α-helix	trans	-60.2	-45.9	178.2	-66.5	0	0	0	0	111.5	L100 A127 P129 L214 Q215 S220 E221 E222	L100-C218 HydrophobicContact CD2-CB 3.87Å; A127-C218 HydrophobicContact CB-CB 4.05Å; P129-C218 HydrophobicContact CG-CB 4.1Å; L214-C218 WeakPolarHBondContact O-CB 3.5Å; L214-C218 PolarHBondContact O-N 3.42Å; L214-C218 PolarHBondContact O-SG 2.76Å; Q215-C218 PolarHBondContact O-N 2.81Å; C218-S220 VanDerWaalsContact C-N 3.3Å; C218-S220 PolarHBondContact O-N 3.28Å; C218-E221 PolarHBondContact O-N 3.5Å; C218-E222 WeakPolarHBondContact O-CB 3.45Å; C218-E222 PolarHBondContact O-N 3.38Å
219	T	94.9	Very high	95.4	Very high	22 Å²	22	45.9 Å²	45.9	14%	0.135	21%	0.211	C	C	.	.	H	α-helix	trans	-60.4	-39.8	176.6	-58.5	0	0	0	0	111.7	F64 L125 A127 Q215 F217 H223	F64-T219 HydrophobicContact CD1-CG2 4.32Å; L125-T219 WeakPolarHBondContact O-CG2 3.44Å; A127-T219 PolarHBondContact N-OG1 3.44Å; Q215-T219 PolarHBondContact O-N 3.04Å; Q215-T219 PolarHBondContact O-OG1 3.2Å; F217-T219 PolarHBondContact O-N 3.26Å; T219-H223 PolarHBondContact O-N 3.38Å; T219-H223 VanDerWaalsContact O-N 3.1Å
220	S	95.6	Very high	95.6	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.4	-42.8	175.8	-176.9	0	0	0	0	112.9	F64 F65 C66 N216 F217 C218 H223 K224	F64-S220 WeakPolarHBondContact O-CB 3.4Å; F64-S220 PolarHBondContact O-OG 3.38Å; F65-S220 VanDerWaalsContact CA-OG 3.29Å; F65-S220 WeakPolarHBondContact CA-OG 3.44Å; C66-S220 PolarHBondContact N-OG 3.49Å; N216-S220 WeakPolarHBondContact O-CB 3.36Å; N216-S220 PolarHBondContact O-N 3.01Å; F217-S220 WeakPolarHBondContact O-CB 3.28Å; F217-S220 PolarHBondContact O-N 3.39Å; C218-S220 VanDerWaalsContact C-N 3.3Å; C218-S220 PolarHBondContact O-N 3.28Å; S220-H223 PolarHBondContact O-N 3.08Å; S220-K224 WeakPolarHBondContact O-CG 3.47Å; S220-K224 PolarHBondContact O-N 3.27Å
221	E	96.9	Very high	95.6	Very high	29 Å²	29	43.3 Å²	43.3	14%	0.136	20%	0.197	C	C	.	.	H	α-helix	trans	-71.2	-36.9	179.1	-69.5	-62.3	133.2	0	0	112.2	I82 L100 F217 C218 H223 K224 L225	I82-E221 HydrophobicContact CD1-CB 3.66Å; I82-E221 HydrophobicContact CD1-CG 3.64Å; L100-E221 HydrophobicContact CD1-CB 3.49Å; L100-E221 VanDerWaalsContact CD1-CB 3.49Å; F217-E221 HydrophobicContact CD2-CG 4.15Å; F217-E221 HydrophobicContact CE1-CG 4.07Å; F217-E221 HydrophobicContact CE2-CG 3.61Å; F217-E221 HydrophobicContact CZ-CG 3.57Å; F217-E221 WeakPolarHBondContact O-CG 3.27Å; F217-E221 PolarHBondContact O-N 3.31Å; C218-E221 PolarHBondContact O-N 3.5Å; E221-H223 VanDerWaalsContact C-N 3.32Å; E221-H223 PolarHBondContact O-N 3.45Å; E221-K224 WeakPolarHBondContact O-CB 3.45Å; E221-K224 PolarHBondContact O-N 2.95Å; E221-K224 IonicContact OE1-NZ 3.51Å; E221-K224 PolarHBondContact OE1-NZ 3.09Å; E221-L225 PolarHBondContact O-N 3.42Å; E221-L225 VanDerWaalsContact O-N 3.09Å
222	E	95.6	Very high	95.7	Very high	51 Å²	51	47.9 Å²	47.9	24%	0.238	22%	0.219	C	C	.	.	H	α-helix	trans	-59.2	-46.6	172.3	-166.4	-70.4	145.9	0	0	110	V104 A127 C218 K224 L225 Y226	V104-E222 HydrophobicContact CG2-CG 3.79Å; A127-E222 HydrophobicContact CB-CB 4.15Å; C218-E222 WeakPolarHBondContact O-CB 3.45Å; C218-E222 PolarHBondContact O-N 3.38Å; E222-K224 PolarHBondContact O-N 3.43Å; E222-L225 CarbonylContact O-C 3.55Å; E222-L225 WeakPolarHBondContact O-CA 3.22Å; E222-L225 WeakPolarHBondContact O-CB 3.25Å; E222-L225 PolarHBondContact O-N 2.99Å; E222-Y226 PolarHBondContact O-N 3.45Å
223	H	94.3	Very high	95.9	Very high	22 Å²	22	46.8 Å²	46.8	10%	0.102	21%	0.213	C	C	.	.	H	α-helix	trans	-61	-34.4	-179.9	-169.3	-154.2	0	0	0	112.6	E59 F64 T219 S220 E221 Y226 L227	E59-H223 IonicContact OE2-CD2 3.41Å; E59-H223 IonicContact OE2-CE1 2.71Å; E59-H223 IonicContact OE2-NE2 3.05Å; E59-H223 PolarHBondContact OE2-NE2 2.82Å; F64-H223 PolarHBondContact N-ND1 2.5Å; T219-H223 PolarHBondContact O-N 3.38Å; T219-H223 VanDerWaalsContact O-N 3.1Å; S220-H223 PolarHBondContact O-N 3.08Å; E221-H223 VanDerWaalsContact C-N 3.32Å; E221-H223 PolarHBondContact O-N 3.45Å; H223-Y226 PolarHBondContact O-N 2.96Å; H223-L227 PolarHBondContact O-N 2.78Å
224	K	95.3	Very high	95.9	Very high	78 Å²	78	44.4 Å²	44.4	34%	0.339	20%	0.202	S	C	.	.	H	α-helix	trans	-65.6	-40.2	172.8	-67.1	169.5	-166.1	169.8	0	111.8	S220 E221 E222 R228	S220-K224 WeakPolarHBondContact O-CG 3.47Å; S220-K224 PolarHBondContact O-N 3.27Å; E221-K224 WeakPolarHBondContact O-CB 3.45Å; E221-K224 PolarHBondContact O-N 2.95Å; E221-K224 IonicContact OE1-NZ 3.51Å; E221-K224 PolarHBondContact OE1-NZ 3.09Å; E222-K224 PolarHBondContact O-N 3.43Å; K224-R228 WeakPolarHBondContact O-CB 3.39Å; K224-R228 PolarHBondContact O-N 3.38Å
225	L	95.8	Very high	95.9	Very high	41 Å²	41	47.6 Å²	47.6	22%	0.215	22%	0.219	C	C	.	.	H	α-helix	trans	-65.5	-41.6	174.9	-67.9	172.7	0	0	0	111.3	G79 C80 L100 E221 E222 R228 F229	G79-L225 WeakPolarHBondContact O-CD2 3.18Å; C80-L225 HydrophobicContact CB-CD1 4.41Å; L100-L225 HydrophobicContact CB-CD1 3.84Å; L100-L225 HydrophobicContact CD1-CD1 3.76Å; L100-L225 HydrophobicContact CG-CD1 4.45Å; E221-L225 PolarHBondContact O-N 3.42Å; E221-L225 VanDerWaalsContact O-N 3.09Å; E222-L225 CarbonylContact O-C 3.55Å; E222-L225 WeakPolarHBondContact O-CA 3.22Å; E222-L225 WeakPolarHBondContact O-CB 3.25Å; E222-L225 PolarHBondContact O-N 2.99Å; L225-R228 WeakPolarHBondContact O-CB 3.49Å; L225-R228 PolarHBondContact O-N 2.94Å; L225-F229 WeakPolarHBondContact O-CB 3.49Å; L225-F229 PolarHBondContact O-N 3.18Å
226	Y	95.1	Very high	95.9	Very high	64 Å²	64	54.3 Å²	54.3	25%	0.251	25%	0.245	S	C	.	.	H	α-helix	trans	-61.5	-46.1	175.4	-179.4	-122.7	0	0	0	111.9	E59 E222 H223 R228 F229 L230	E59-Y226 HydrophobicContact CG-CD1 4.27Å; E59-Y226 HydrophobicContact CG-CE1 3.77Å; E222-Y226 PolarHBondContact O-N 3.45Å; H223-Y226 PolarHBondContact O-N 2.96Å; Y226-R228 VanDerWaalsContact C-N 3.3Å; Y226-R228 PolarHBondContact O-N 2.94Å; Y226-F229 HydrophobicContact CD2-CD1 4.18Å; Y226-F229 HydrophobicContact CE2-CD1 4.21Å; Y226-F229 WeakPolarHBondContact O-CB 3.4Å; Y226-F229 PolarHBondContact O-N 2.89Å; Y226-F229 VanDerWaalsContact O-N 3.16Å; Y226-L230 HydrophobicContact CD1-CD1 4.17Å; Y226-L230 HydrophobicContact CD2-CG 4.42Å; Y226-L230 HydrophobicContact CE1-CD1 3.7Å; Y226-L230 HydrophobicContact CE1-CG 4.3Å; Y226-L230 HydrophobicContact CE2-CD1 4.33Å; Y226-L230 HydrophobicContact CE2-CD2 3.99Å; Y226-L230 HydrophobicContact CE2-CG 4.03Å; Y226-L230 WeakPolarHBondContact O-CG 3.27Å; Y226-L230 PolarHBondContact O-N 3.18Å
227	L	95.6	Very high	95.8	Very high	23 Å²	23	52 Å²	52	12%	0.12	23%	0.232	C	C	.	.	H	α-helix	trans	-57.7	-42.4	173.7	-81.6	172.8	0	0	0	112.4	E59 K60 H223 L230 D231	E59-L227 HydrophobicContact CB-CD2 3.44Å; E59-L227 VanDerWaalsContact CB-CD2 3.44Å; E59-L227 HydrophobicContact CB-CG 4.3Å; K60-L227 HydrophobicContact CG-CD1 4.28Å; K60-L227 HydrophobicContact CG-CD2 3.76Å; H223-L227 PolarHBondContact O-N 2.78Å; L227-L230 PolarHBondContact O-N 2.79Å; L227-D231 PolarHBondContact O-N 2.86Å
228	R	95.9	Very high	95.4	Very high	153 Å²	153	57.2 Å²	57.2	58%	0.577	26%	0.255	S	S	*	.	H	α-helix	trans	-65.1	-41.9	176	-174.6	179.3	-178.8	176.5	-0.7	111.6	K224 L225 Y226 L230 D231 E232	K224-R228 WeakPolarHBondContact O-CB 3.39Å; K224-R228 PolarHBondContact O-N 3.38Å; L225-R228 WeakPolarHBondContact O-CB 3.49Å; L225-R228 PolarHBondContact O-N 2.94Å; Y226-R228 VanDerWaalsContact C-N 3.3Å; Y226-R228 PolarHBondContact O-N 2.94Å; R228-L230 VanDerWaalsContact C-N 3.34Å; R228-L230 PolarHBondContact O-N 3.05Å; R228-D231 PolarHBondContact O-N 3.41Å; R228-E232 WeakPolarHBondContact O-CG 3.43Å; R228-E232 PolarHBondContact O-N 3.43Å
229	F	96.7	Very high	94.9	Very high	117 Å²	117	65.9 Å²	65.9	51%	0.513	30%	0.295	S	S	.	.	H	α-helix	trans	-57.7	-47.4	174.5	165	-95.9	0	0	0	111.1	L225 Y226 E232 F233	L225-F229 WeakPolarHBondContact O-CB 3.49Å; L225-F229 PolarHBondContact O-N 3.18Å; Y226-F229 HydrophobicContact CD2-CD1 4.18Å; Y226-F229 HydrophobicContact CE2-CD1 4.21Å; Y226-F229 WeakPolarHBondContact O-CB 3.4Å; Y226-F229 PolarHBondContact O-N 2.89Å; Y226-F229 VanDerWaalsContact O-N 3.16Å; F229-E232 PolarHBondContact O-N 2.88Å; F229-F233 HydrophobicContact CE1-CD1 4.18Å; F229-F233 AromaticContact CZ-CD1 3.95Å; F229-F233 HydrophobicContact CZ-CD1 3.95Å; F229-F233 VanDerWaalsContact O-CB 3.32Å; F229-F233 WeakPolarHBondContact O-CB 3.39Å; F229-F233 PolarHBondContact O-N 3.03Å
230	L	97.2	Very high	94.9	Very high	6 Å²	6	68.1 Å²	68.1	3%	0.031	30%	0.303	C	S	.	.	H	α-helix	trans	-62.1	-44	177.5	-66.8	177.5	0	0	0	112.1	L52 E55 I56 E59 Y226 L227 R228 F233 Q234	L52-L230 HydrophobicContact CD2-CD2 3.81Å; E55-L230 HydrophobicContact CB-CD1 4.41Å; E55-L230 HydrophobicContact CG-CD1 3.82Å; E55-L230 HydrophobicContact CG-CD2 4.26Å; I56-L230 HydrophobicContact CD1-CB 4.15Å; I56-L230 HydrophobicContact CG1-CB 3.55Å; I56-L230 HydrophobicContact CG1-CD1 4.17Å; E59-L230 HydrophobicContact CG-CD1 4Å; Y226-L230 HydrophobicContact CD1-CD1 4.17Å; Y226-L230 HydrophobicContact CD2-CG 4.42Å; Y226-L230 HydrophobicContact CE1-CD1 3.7Å; Y226-L230 HydrophobicContact CE1-CG 4.3Å; Y226-L230 HydrophobicContact CE2-CD1 4.33Å; Y226-L230 HydrophobicContact CE2-CD2 3.99Å; Y226-L230 HydrophobicContact CE2-CG 4.03Å; Y226-L230 WeakPolarHBondContact O-CG 3.27Å; Y226-L230 PolarHBondContact O-N 3.18Å; L227-L230 PolarHBondContact O-N 2.79Å; R228-L230 VanDerWaalsContact C-N 3.34Å; R228-L230 PolarHBondContact O-N 3.05Å; L230-F233 PolarHBondContact O-N 3.36Å; L230-Q234 VanDerWaalsContact O-CB 3.3Å; L230-Q234 WeakPolarHBondContact O-CB 3.31Å; L230-Q234 PolarHBondContact O-N 2.95Å
231	D	96.8	Very high	94.9	Very high	51 Å²	51	71.6 Å²	71.6	27%	0.273	32%	0.319	S	S	.	.	H	α-helix	trans	-62.2	-44	177.8	-82.9	-31.6	0	0	0	111	I56 K60 L227 R228 Q234 N235	I56-D231 WeakPolarHBondContact CD1-OD1 3.37Å; K60-D231 IonicContact NZ-OD1 2.7Å; K60-D231 PolarHBondContact NZ-OD1 2.97Å; K60-D231 IonicContact NZ-OD2 3.52Å; K60-D231 PolarHBondContact NZ-OD2 3.43Å; L227-D231 PolarHBondContact O-N 2.86Å; R228-D231 PolarHBondContact O-N 3.41Å; D231-Q234 WeakPolarHBondContact O-CB 3.46Å; D231-Q234 PolarHBondContact O-N 3.39Å; D231-N235 VanDerWaalsContact O-CG 3.31Å; D231-N235 PolarHBondContact O-N 3.39Å; D231-N235 VanDerWaalsContact O-N 3.09Å; D231-N235 PolarHBondContact O-ND2 3.2Å
232	E	97.4	Very high	94.7	Very high	111 Å²	111	74 Å²	74	52%	0.519	33%	0.329	S	S	.	.	H	α-helix	trans	-67.1	-42.2	176	-70.1	-60.6	158.5	0	0	112.5	R228 F229 Q234 N235 Y236	R228-E232 WeakPolarHBondContact O-CG 3.43Å; R228-E232 PolarHBondContact O-N 3.43Å; F229-E232 PolarHBondContact O-N 2.88Å; E232-Q234 VanDerWaalsContact C-N 3.25Å; E232-Q234 PolarHBondContact O-N 3.1Å; E232-N235 WeakPolarHBondContact O-CB 3.41Å; E232-N235 PolarHBondContact O-N 3.2Å; E232-N235 VanDerWaalsContact O-N 3.11Å; E232-Y236 PolarHBondContact O-N 3.2Å
233	F	96.9	Very high	94.7	Very high	74 Å²	74	75.4 Å²	75.4	33%	0.325	34%	0.335	S	S	.	.	H	α-helix	trans	-64.3	-35.4	176.6	-167.7	-173.4	0	0	0	111.3	L48 L52 F229 L230 N235 Y236 C237	L48-F233 HydrophobicContact CD2-CE2 3.84Å; L48-F233 HydrophobicContact CD2-CZ 3.7Å; L52-F233 HydrophobicContact CD1-CB 4.25Å; L52-F233 HydrophobicContact CD1-CD1 4.21Å; L52-F233 HydrophobicContact CD1-CD2 4.4Å; L52-F233 HydrophobicContact CD1-CG 4.01Å; L52-F233 HydrophobicContact CD2-CD1 4.07Å; F229-F233 HydrophobicContact CE1-CD1 4.18Å; F229-F233 AromaticContact CZ-CD1 3.95Å; F229-F233 HydrophobicContact CZ-CD1 3.95Å; F229-F233 VanDerWaalsContact O-CB 3.32Å; F229-F233 WeakPolarHBondContact O-CB 3.39Å; F229-F233 PolarHBondContact O-N 3.03Å; L230-F233 PolarHBondContact O-N 3.36Å; F233-N235 VanDerWaalsContact C-N 3.32Å; F233-N235 PolarHBondContact O-N 3.31Å; F233-Y236 HydrophobicContact CD2-CD1 4.24Å; F233-Y236 HydrophobicContact CE2-CD1 4.23Å; F233-Y236 WeakPolarHBondContact O-CB 3.47Å; F233-Y236 PolarHBondContact O-N 2.83Å; F233-C237 PolarHBondContact O-N 2.84Å; F233-C237 PolarHBondContact O-SG 3.23Å
234	Q	96.2	Very high	94.7	Very high	24 Å²	24	78.7 Å²	78.7	11%	0.112	35%	0.349	C	S	.	.	H	α-helix	trans	-64.9	-38.6	174.3	-168.3	-162	69.4	0	0	111.4	N49 L52 T53 I56 L230 D231 E232 C237 K238	N49-Q234 VanDerWaalsContact ND2-CG 3.33Å; N49-Q234 WeakPolarHBondContact ND2-CG 3.46Å; N49-Q234 PolarHBondContact ND2-O 2.87Å; L52-Q234 HydrophobicContact CB-CB 4.11Å; L52-Q234 HydrophobicContact CB-CG 4.14Å; L52-Q234 HydrophobicContact CD1-CB 4.1Å; T53-Q234 PolarHBondContact OG1-NE2 2.82Å; I56-Q234 HydrophobicContact CD1-CB 4.06Å; I56-Q234 HydrophobicContact CD1-CG 4.41Å; L230-Q234 VanDerWaalsContact O-CB 3.3Å; L230-Q234 WeakPolarHBondContact O-CB 3.31Å; L230-Q234 PolarHBondContact O-N 2.95Å; D231-Q234 WeakPolarHBondContact O-CB 3.46Å; D231-Q234 PolarHBondContact O-N 3.39Å; E232-Q234 VanDerWaalsContact C-N 3.25Å; E232-Q234 PolarHBondContact O-N 3.1Å; Q234-C237 PolarHBondContact O-N 2.93Å; Q234-K238 WeakPolarHBondContact O-CG 3.27Å
235	N	95.4	Very high	94.7	Very high	67 Å²	67	78.7 Å²	78.7	36%	0.358	35%	0.35	S	S	.	.	H	α-helix	trans	-66.6	-43.1	176.3	-68.4	-25.2	0	0	0	111.6	D231 E232 F233 C237 K238 E239	D231-N235 VanDerWaalsContact O-CG 3.31Å; D231-N235 PolarHBondContact O-N 3.39Å; D231-N235 VanDerWaalsContact O-N 3.09Å; D231-N235 PolarHBondContact O-ND2 3.2Å; E232-N235 WeakPolarHBondContact O-CB 3.41Å; E232-N235 PolarHBondContact O-N 3.2Å; E232-N235 VanDerWaalsContact O-N 3.11Å; F233-N235 VanDerWaalsContact C-N 3.32Å; F233-N235 PolarHBondContact O-N 3.31Å; N235-C237 PolarHBondContact O-N 3.33Å; N235-K238 WeakPolarHBondContact O-CB 3.21Å; N235-K238 PolarHBondContact O-N 2.71Å; N235-K238 PolarHBondContact OD1-NZ 3.44Å; N235-E239 PolarHBondContact O-N 3.46Å
236	Y	94.9	Very high	94.6	Very high	154 Å²	154	81.4 Å²	81.4	60%	0.604	36%	0.359	S	S	*	.	H	α-helix	trans	-53.3	-41.9	173	175.2	-95.5	0	0	0	112.4	E232 F233 K238 E239	E232-Y236 PolarHBondContact O-N 3.2Å; F233-Y236 HydrophobicContact CD2-CD1 4.24Å; F233-Y236 HydrophobicContact CE2-CD1 4.23Å; F233-Y236 WeakPolarHBondContact O-CB 3.47Å; F233-Y236 PolarHBondContact O-N 2.83Å; Y236-K238 PolarHBondContact O-N 2.79Å; Y236-E239 PolarHBondContact O-N 3.05Å
237	C	92	Very high	94.6	Very high	1 Å²	1	82.8 Å²	82.8	1%	0.007	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-14.1	178.5	-61.3	0	0	0	0	114.4	S41 D45 L48 N49 F233 Q234 N235	S41-C237 PolarHBondContact OG-O 3.47Å; D45-C237 HydrophobicContact CB-CB 4.49Å; L48-C237 VanDerWaalsContact CD2-SG 3.53Å; N49-C237 HydrophobicContact CB-CB 4.2Å; F233-C237 PolarHBondContact O-N 2.84Å; F233-C237 PolarHBondContact O-SG 3.23Å; Q234-C237 PolarHBondContact O-N 2.93Å; N235-C237 PolarHBondContact O-N 3.33Å
238	K	89	Confident	94.5	Very high	113 Å²	113	87.8 Å²	87.8	49%	0.491	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-18.5	180	-65	169.7	-165.8	156	0	112.9	N49 Q234 N235 Y236	N49-K238 VanDerWaalsContact ND2-CE 3.3Å; N49-K238 WeakPolarHBondContact ND2-CE 3.46Å; N49-K238 WeakPolarHBondContact ND2-CG 3.1Å; Q234-K238 WeakPolarHBondContact O-CG 3.27Å; N235-K238 WeakPolarHBondContact O-CB 3.21Å; N235-K238 PolarHBondContact O-N 2.71Å; N235-K238 PolarHBondContact OD1-NZ 3.44Å; Y236-K238 PolarHBondContact O-N 2.79Å
239	E	85.4	Confident	94.3	Very high	182 Å²	182	81.8 Å²	81.8	85%	0.85	37%	0.371	S	S	*	.			trans	-72	0	175.6	-64.8	-176.8	177	0	0	111.6	N235 Y236	N235-E239 PolarHBondContact O-N 3.46Å; Y236-E239 PolarHBondContact O-N 3.05Å

Retrieved 239 of 239 residues in 156.7 ms (Link to these results)

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